# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-16T20:20:21+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'P 63/m' AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1000134","10.176","0.0001","10.176","0.0001","8.4121","0.0001","90","","90","","120","","754.4","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Barium pentoxomercuroruthenate(VI)","","- Ba Hg O5 Ru -","- Ba Hg O5 Ru -","- Ba6 Hg6 O30 Ru6 -","6","0.5","","Hansen, T; Le Bail, A; Laligant, Y","Synthesis and structure approach of barium-oxomercurato(II)- oxoruthenate(VI) Ba Hg Ru O5","Journal of Solid State Chemistry","1995","120","","223","230","10.1006/jssc.1995.1402","","","","","","0.04","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000353","11.935","0.001","11.935","0.001","7.852","0.001","90","","90","","120","","968.6","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Barium tris(oxohexafluoroniobate) hydrogendifluoride","","- Ba5 F20 H Nb3 O3 -","- Ba5 F20 H0.1667 Nb3 O3 -","- Ba10 F40 H0.3334 Nb6 O6 -","2","0.166667","","Crosnier-Lopez, M P; Duroy, H; Fourquet, J L","Ba~5~Nb~3~O~3~F~18~(HF~2~): synthesis and crystal structure","Journal of Solid State Chemistry","1993","107","","211","217","10.1006/jssc.1993.1340","","","","","","0.025","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000428","9.888","0.0001","9.888","0.0001","3.217","0.0001","90","","90","","120","","272.4","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Barium calcium indium oxide (0.86/2/6/12)","","- Ba0.86 Ca2 In6 O12 -","- Ba0.86 Ca2 In6 O12 -","- Ba0.86 Ca2 In6 O12 -","1","0.0833333","","Baldinozzi, G; Goutenoire, F; Hervieu, M; Suard, E; Grebille, D","Incommensurate modulated disorder in Ba0.85 Ca2.15 In6 O12","Acta Crystallographica B (39,1983-)","1996","52","","780","789","","","","","","","0.024","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001003","13.226","0.002","13.226","0.002","32.37","0.02","90","","90","","120","","4903.8","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Calcium nitrate hydrate (1/2/1.2)","","- Ca H2.47 N2 O7.235 -","- Ca H2.88235 N2 O7.23294 -","- Ca34 H98 N68 O245.92 -","34","2.83333","","Leclaire, A","Structure cristalline d un nouvel hydrate du nitrate de calcium Ca (N O~3~)~2~ (H~2~ O)~1.235~","Acta Crystallographica B (24,1968-38,1982)","1976","32","","1950","1953","10.1107/S0567740876006845","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001079","7.667","0.004","7.667","0.004","18.64","0.004","90","","90","","120","","948.9","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tin tungsten oxide (10/16/46)","","- O46 Sn10 W16 -","- O46 Sn10 W16 -","- O46 Sn10 W16 -","1","0.0833333","","Goreaud, M; Labbe, P H; Raveau, B","A mixed-valence tungsten oxide of divalent tin: Sn~10~ W~16~ O~46~","Acta Crystallographica B (24,1968-38,1982)","1980","36","","15","19","10.1107/S0567740880002348","","","","","","0.06","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001111","6.774","","6.774","","9.922","","90","","90","","120","","394.3","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Dipotassium titanium cyclo-trisilicate","","- K2 O9 Si3 Ti -","- K2 O9 Si3 Ti -","- K4 O18 Si6 Ti2 -","2","0.166667","","Choisnet, J; Deschanvres, A; Raveau, B","Evolution structural de nouveaux germanates et silicates de type Wadeite et de structure apparentee","Journal of Solid State Chemistry","1973","7","","408","417","10.1016/0022-4596(73)90169-2","","","","","","0.085","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001112","6.896","","6.896","","9.943","","90","","90","","120","","409.5","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Dirubidium titanium cyclo-trisilicate","","- O9 Rb2 Si3 Ti -","- O9 Rb2 Si3 Ti -","- O18 Rb4 Si6 Ti2 -","2","0.166667","","Choisnet, J; Deschanvres, A; Raveau, B","Evolution structural de nouveaux germanates et silicates de type Wadeite et de structure apparentee","Journal of Solid State Chemistry","1973","7","","408","417","10.1016/0022-4596(73)90169-2","","","","","","0.05","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001113","6.86","","6.86","","10.12","","90","","90","","120","","412.4","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Dipotassium tin(IV) cyclo-trisilicate","","- K2 O9 Si3 Sn -","- K2 O9 Si3 Sn -","- K4 O18 Si6 Sn2 -","2","0.166667","","Choisnet, J; Deschanvres, A; Raveau, B","Evolution structural de nouveaux germanates et silicates de type Wadeite et de structure apparentee","Journal of Solid State Chemistry","1973","7","","408","417","10.1016/0022-4596(73)90169-2","","","","","","0.092","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001114","6.943","","6.943","","10.04","","90","","90","","120","","419.1","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Dirubidium tin(IV) cyclo-trisilicate","","- O9 Rb2 Si3 Sn -","- O9 Rb2 Si3 Sn -","- O18 Rb4 Si6 Sn2 -","2","0.166667","","Choisnet, J; Deschanvres, A; Raveau, B","Evolution structural de nouveaux germanates et silicates de type Wadeite et de structure apparentee","Journal of Solid State Chemistry","1973","7","","408","417","10.1016/0022-4596(73)90169-2","","","","","","0.096","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001115","6.99","","6.99","","10.267","","90","","90","","120","","434.4","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Dithallium titanium cyclo-trigermanate","","- Ge3 O9 Ti Tl2 -","- Ge3 O9 Ti Tl2 -","- Ge6 O18 Ti2 Tl4 -","2","0.166667","","Choisnet, J; Deschanvres, A; Raveau, B","Evolution structural de nouveaux germanates et silicates de type Wadeite et de structure apparentee","Journal of Solid State Chemistry","1973","7","","408","417","10.1016/0022-4596(73)90169-2","","","","","","0.103","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001116","7.191","","7.191","","10.36","","90","","90","","120","","463.9","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Dicaesium titanium cyclo-trigermanate","","- Cs2 Ge3 O9 Ti -","- Cs2 Ge3 O9 Ti -","- Cs4 Ge6 O18 Ti2 -","2","0.166667","","Choisnet, J; Deschanvres, A; Raveau, B","Evolution structural de nouveaux germanates et silicates de type Wadeite et de structure apparentee","Journal of Solid State Chemistry","1973","7","","408","417","10.1016/0022-4596(73)90169-2","","","","","","0.054","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001117","7.288","","7.288","","10.472","","90","","90","","120","","481.7","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Dicaesium tin(IV) cyclo-trigermanate","","- Cs2 Ge3 O9 Sn -","- Cs2 Ge3 O9 Sn -","- Cs4 Ge6 O18 Sn2 -","2","0.166667","","Choisnet, J; Deschanvres, A; Raveau, B","Evolution structural de nouveaux germanates et silicates de type Wadeite et de structure apparentee","Journal of Solid State Chemistry","1973","7","","408","417","10.1016/0022-4596(73)90169-2","","","","","","0.065","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001244","7.6018","0.0004","7.6018","0.0004","2.9066","0.0002","90","","90","","120","","145.5","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Silicon nitride - $-beta","","- N4 Si3 -","- N4 Si3 -","- N8 Si6 -","2","0.166667","","Billy, M; Labbe, J C; Selvaraj, A; Roult, G","Modifications structurales du nitrure de silicium en fonction de la temperature","Materials Research Bulletin","1983","18","","921","934","10.1016/0025-5408(83)90003-X","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001245","7.614","0.0004","7.614","0.0004","2.9123","0.0002","90","","90","","120","","146.2","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Silicon nitride - $-beta","","- N4 Si3 -","- N4 Si3 -","- N8 Si6 -","2","0.166667","","Billy, M; Labbe, J C; Selvaraj, A; Roult, G","Modifications structurales du nitrure de silicium en fonction de la temperature","Materials Research Bulletin","1983","18","","921","934","10.1016/0025-5408(83)90003-X","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001246","7.617","0.0004","7.617","0.0004","2.9134","0.0002","90","","90","","120","","146.4","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Silicon nitride - $-beta","","- N4 Si3 -","- N4 Si3 -","- N8 Si6 -","2","0.166667","","Billy, M; Labbe, J C; Selvaraj, A; Roult, G","Modifications structurales du nitrure de silicium en fonction de la temperature","Materials Research Bulletin","1983","18","","921","934","10.1016/0025-5408(83)90003-X","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001247","7.6272","0.0006","7.6272","0.0006","2.9182","0.0003","90","","90","","120","","147","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Silicon nitride - $-beta","","- N4 Si3 -","- N4 Si3 -","- N8 Si6 -","2","0.166667","","Billy, M; Labbe, J C; Selvaraj, A; Roult, G","Modifications structurales du nitrure de silicium en fonction de la temperature","Materials Research Bulletin","1983","18","","921","934","10.1016/0025-5408(83)90003-X","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001248","7.6322","0.0006","7.6322","0.0006","2.9191","0.0004","90","","90","","120","","147.3","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Silicon nitride - $-beta","","- N4 Si3 -","- N4 Si3 -","- N8 Si6 -","2","0.166667","","Billy, M; Labbe, J C; Selvaraj, A; Roult, G","Modifications structurales du nitrure de silicium en fonction de la temperature","Materials Research Bulletin","1983","18","","921","934","10.1016/0025-5408(83)90003-X","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001249","7.6374","0.0007","7.6374","0.0007","2.922","0.0004","90","","90","","120","","147.6","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Silicon nitride - $-beta","","- N4 Si3 -","- N4 Si3 -","- N8 Si6 -","2","0.166667","","Billy, M; Labbe, J C; Selvaraj, A; Roult, G","Modifications structurales du nitrure de silicium en fonction de la temperature","Materials Research Bulletin","1983","18","","921","934","10.1016/0025-5408(83)90003-X","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001630","16.67799","0.003","16.67799","0.003","12.717","0.003","90","","90","","120","","3063.4","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Caesium molybdenum phosphorus oxide hydrate (8.35/13/10/62/1)","","- Cs8.35 H2 Mo13 O63 P10 -","- Cs8.351 H2.3333 Mo13 O63 P10 -","- Cs16.702 H4.6666 Mo26 O126 P20 -","2","0.166667","","Hoareau, T; Leclaire, A; Borel, M - M; Grandin, A; Raveau, B","A zeolitic mixed valence molybdenum monophosphate with a tunnel structure: Cs8+x (Mo O4) Mo12 O18 (P O4)10 .(H2 O)","European Journal of Solid State Inorganic Chemistry","1994","31","","727","737","","","","","","","0.054","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001641","16.989","0.003","16.989","0.003","11.866","0.003","90","","90","","120","","2966","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Nonacaesium tecto-trialumononamolybdo(V)undecaphosphate(V)","","- Al3 Cs9 Mo9 O59 P11 -","- Al3 Cs9 Mo9 O59 P11 -","- Al6 Cs18 Mo18 O118 P22 -","2","0.166667","","Guesdon, A; Borel, M M; Leclaire, A; Grandin, A; Raveau, B","An aluminophosphate of molybdenum(V) with a tunnel structure: Cs9 Mo9 Al3 P11 O59","Journal of Solid State Chemistry","1995","114","","451","458","10.1006/jssc.1995.1068","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001863","16.952","0.002","16.952","0.002","11.833","0.001","90","","90","","120","","2944.9","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","Dipotassium heptacaesium tecto-nonamolybdo(V)trialumoundecaphosphate(V)","","- Al3 Cs7 K2 Mo9 O59 P11 -","- Al3 Cs7.002 K1.998 Mo9 O59 P11 -","- Al6 Cs14.004 K3.996 Mo18 O118 P22 -","2","0.166667","","Guesdon, A; Leclaire, A; Borel, M M; Raveau, B","Significant structural disorganization in alkaline molybdenum(V) aluminophosphates","Chemistry of Materials (1,1989-","1995","7","","1873","1878","10.1021/cm00058a018","","","","","","0.043","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007243","11.67","0.01","11.67","0.01","12.12","0.01","90","","90","","120","","1429.5","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Tellurium hexahydroxide - trisodiumcyclo-triphosphate - water (1/2/6)","","- H18 Na6 O30 P6 Te -","- H15 Na6 O30 P6 Te -","- H30 Na12 O60 P12 Te2 -","2","0.166667","","Boudjada, N; Averbuch-Pouchot, M T; Durif, A","Structure du trimetaphosphate-tellurate de sodium hexahydrate Te (O H)6 (Na3 P3 O9)2 (H2 O)6","Acta Crystallographica B (24,1968-38,1982)","1981","37","","645","647","10.1107/S0567740881003762","","","","","","0.04","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008035","7.942","0.002","7.942","0.002","4.441","0.002","90","","90","","120","","242.6","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Uranium(III) bromide","","- Br3 U -","- Br3 U -","- Br6 U2 -","2","0.166667","","Levy, J H; Taylor, J C; Wilson, P W","The structure of uranium tribromide by neutron diffraction profile analysis","Journal of the Less-Common Metals","1975","39","","265","270","10.1016/0022-5088(75)90200-3","","","","","","0.1","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008321","11.67","0.01","11.67","0.01","12.12","0.01","90","","90","","120","","1429.5","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Bis(sodium cyclo-triphosphate) hexaoxotelluric acid hexahydrat","","- H18 Na6 O30 P6 Te -","- H24 Na6 O30 P6 Te -","- H48 Na12 O60 P12 Te2 -","2","0.166667","","Boudjada, N; Lambert Andron, B","Neutron structural refinement of Te (O H)~6~ (Na~3~ P~3~ O~9~)~2~ (H~2~ O)~6~, study of hydrogen bonds","Zeitschrift fuer Kristallographie (149,1979-)","1985","172","","45","53","","","","","","","0.054","","","","","","","","","","","","","","","has coordinates","186636","2020-10-21","18:00:00",""
"1008827","9.3938","0.0008","9.3938","0.0008","6.9013","0.0005","90","","90","","120","","527.4","","","","","","","","","","","","exchanged) - synthetic","6","P 63/m","-P 6c","176","","Calcium neodymium phosphate(V) silicate fluoride oxide (9/1/5/1/1.5/0.25)","Britholite (N","- Ca9 F1.5 Nd O24.25 P5 Si -","- Ca9 F1.54 Nd O24.28 P4.9998 Si1.0002 -","- Ca9 F1.54 Nd O24.28 P4.9998 Si1.0002 -","1","0.0833333","","Boyer, L; Savariault, J-M; Carpena, J; Lacout, J-L","A neodymium-substituted britholite compound","Acta Crystallographica C (39,1983-)","1998","54","","1057","1057","","","","","","","0.035","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010480","6.45","","6.45","","15.98","","90","","90","","120","","575.7","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Nonacarbonyl diiron","","- C9 Fe2 O9 -","- C9 Fe2 O9 -","- C18 Fe4 O18 -","2","0.166667","","Powell, H M; Ewens, R V G","The Crystal Structure of Iron Enneacarbonyl","Journal of the Chemical Society","1939","1939","","286","292","","","","","","","","","","","","","","","","","","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"1010564","21.66","","21.66","","21.54","","90","","90","","120","","8751.7","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Boron tungsten oxide hydrate *","","- B2 H124 O149 W28 -","","","14","1.16667","","Kraus, O","Zur Kristallchemie der Heteropolysaeuren: Gibt es eine ""isomere Borwolframsaeure""?","Naturwissenschaften","1940","28","","238","239","10.1007/BF01491436","","","","","","","","","","","","","","","","","","","","","","278158","2022-09-26","15:28:11",""
"1010647","9.37","0.02","9.37","","6.88","0.02","90","","90","","120","","523.1","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pentacalcium fluoride tris(phosphate)","","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","","Bale, W F","A comparative Roentgen-ray diffraction study of several natural apatites and the apatite-like constituent of bone and tooth substance","American Journal of Roentgenology","1940","43","","735","747","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010779","8.47","0.02","8.47","","8.09","0.02","90","","90","","120","","502.6","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Aluminium borate","Jeremejewite","- Al B O3 -","","","1","0.0833333","","Strunz, H","Gitterkonstante und Raumgruppe von Rhodizit und Jeremejewit","Naturwissenschaften","1938","26","","217","217","","","","","","","","","","","","","","","","","","","","","","","130149","2020-10-21","18:00:00",""
"1010916","9.52","0.03","9.52","0.03","6.85","0.03","90","","90","","120","","537.6","","","","","","","","","","","","from Bamle Mines, Krageroe, Norway","4","P 63/m","-P 6c","176","","Pentacalcium tris(phosphate) chloride","Chlorapatite","- Ca5 Cl O12 P3 -","- Ca5 Cl O12 P3 -","- Ca10 Cl2 O24 P6 -","2","0.166667","","Hendricks, S B; Jefferson, M E; Mosley, V M","The Crystal Structures of Some Natural and Synthetic Apatite-Like Substances","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1932","81","","352","369","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010996","9.37","0.01","9.37","0.01","6.88","0.01","90","","90","","120","","523.1","","","","","","","","","","","","from Quebec Province, Canada","4","P 63/m","-P 6c","176","","Pentacalcium tris(phosphate) fluoride","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","","Hendricks, S B; Jefferson, M E; Mosley, V M","The Crystal Structures of Some Natural and Synthetic Apatite-Like Substances","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1932","81","","352","369","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010997","10.24","0.02","10.24","0.02","7.43","0.02","90","","90","","120","","674.7","","","","","","","","","","","","from Velardena Mine, Santa Eulalia District, Chihuahua, Mexic","4","P 63/m","-P 6c","176","","Pentalead tris(arsenate) chloride","Mimetite","- As3 Cl O12 Pb5 -","- As3 Cl O12 Pb5 -","- As6 Cl2 O24 Pb10 -","2","0.166667","","Hendricks, S B; Jefferson, M E; Mosley, V M","The Crystal Structures of Some Natural and Synthetic Apatite-Like Substances","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1932","81","","352","369","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011044","9.37","0.01","9.37","0.01","6.88","0.01","90","","90","","120","","523.1","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Calcium fluoride tris(phosphate)","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","","Naray-Szabo, S","The structure of apatite (Ca F) Ca4 (P O4)3","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1930","75","","387","398","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011137","9.95","0.02","9.95","0.02","7.31","0.02","90","","90","","120","","626.7","","","","","","","","","","","","from Hunter Min. Dist., Shoshone Co., Idaho","4","P 63/m","-P 6c","176","","Pentalead tris(phosphate(V)) chloride","Pyromorphite","- Cl O12 P3 Pb5 -","- Cl O12 P3 Pb5 -","- Cl2 O24 P6 Pb10 -","2","0.166667","","Hendricks, S B; Jefferson, M E; Mosley, V M","The crystal structures of some natural and synthetic apatite-like substances","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1932","81","","352","369","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011138","10.31","0.02","10.31","0.02","7.34","0.02","90","","90","","120","","675.7","","","","","","","","","","","","from Yuma Co., Arizona","4","P 63/m","-P 6c","176","","Pentalead tris(vanadate) chloride","Vanadinite","- Cl O12 Pb5 V3 -","- Cl O12 Pb5 V3 -","- Cl2 O24 Pb10 V6 -","2","0.166667","","Hendricks, S B; Jefferson, M E; Mosley, V M","The Crystal Structures of Some Natural and Synthetic Apatite-Like Substances","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1932","81","","352","369","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011242","9.4","0.03","9.4","0.03","6.93","0.03","90","","90","","120","","530.3","","","","","","","","","","","","synthetic","4","P 63/m","-P 6c","176","","Pentacalcium tris(phosphate) hydroxide","Hydroxylapatite","- Ca5 H O13 P3 -","- Ca5 H O13 P3 -","- Ca10 H2 O26 P6 -","2","0.166667","","Hendricks, S B; Jefferson, M E; Mosley, V M","The Crystal Structures of Some Natural and Synthetic Apatite-Like Substances","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1932","81","","352","369","","","","","","","","","","","","","","","","","","","","","","has coordinates","200452","2020-10-21","18:00:00",""
"1100121","4.912","0.0008","4.912","0.0008","9.919","0.001","90","","90","","120","","207.26","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Barium Manganese Carbonate Difluoride","","- C Ba F2 Mn O3 -","- C Ba F2 Mn O3 -","- C2 Ba2 F4 Mn2 O6 -","2","0.166667","","Ben Ali, A.; Maisonneuve, V.; Smiri, L.S.; Leblanc, M.","Synthesis and crystal structure of Ba Zn (C O3) F2; revision of the structure of Ba Mn (C O3) F2","Solid State Sciences","2002","4","7","891","894","10.1016/S1293-2558(02)01339-0","","","","","","0.019","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1100122","4.8523","0.0008","4.8523","0.0008","9.854","0.001","90","","90","","120","","200.93","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Barium Zinc Carbonate Difluoride","","- C Ba F2 O3 Zn -","- C Ba F2 O3 Zn -","- C2 Ba2 F4 O6 Zn2 -","2","0.166667","","Ben Ali, A.; Maisonneuve, V.; Smiri, L.S.; Leblanc, M.","Synthesis and crystal structure of Ba Zn (C O3) F2; revision of the structure of Ba Mn (C O3) F2","Solid State Sciences","2002","4","7","891","894","10.1016/S1293-2558(02)01339-0","","","","","","0.016","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1100717","21.232","0.005","21.232","0.005","4.323","0.002","90","","90","","120","","1687.7","1","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Br3 La9 Sb16 -","- Br3 La9 Sb16 -","- Br6 La18 Sb32 -","2","0.166667","","Chong Zheng; Hansjürgen Mattausch; Arndt Simon","La9Sb16Br3 and Ce9Sb16Cl3: Stars and Stripes in Rare Earth Halide and Intermetallic Compounds","Inorganic Chemistry","2005","44","","3684","3689","10.1021/ic049220u","","","0.71073","MoKα","","0.0411","0.0411","","","0.0866","0.0866","","","","","","1.608","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1100718","20.8622","0.0016","20.8622","0.0016","4.2728","0.0007","90","","90","","120","","1610.5","0.3","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ce9 Cl3 Sb16 -","- Ce9 Cl3 Sb16 -","- Ce18 Cl6 Sb32 -","2","0.166667","","Chong Zheng; Hansjürgen Mattausch; Arndt Simon","La9Sb16Br3 and Ce9Sb16Cl3: Stars and Stripes in Rare Earth Halide and Intermetallic Compounds","Inorganic Chemistry","2005","44","","3684","3689","10.1021/ic049220u","","","0.71073","MoKα","","0.0521","0.0519","","","0.1043","0.1044","","","","","","1.486","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1101153","11.7691","0.0015","11.7691","0.0015","12.112","0.002","90","","90","","120","","1452.8","0.4","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- B9 Co3 H10 Na5 O39 P6 -","- B9 Co3 Na5 O39 P6 -","- B18 Co6 Na10 O78 P12 -","2","0.166667","","Yang, Miao; Yu, Jihong; Di, Jiancheng; Li, Jiyang; Chen, Peng; Fang, Qianrong; Chen, Yan; Xu, Ruren","Syntheses, Structures, Ionic Conductivities, and Magnetic Properties of Three New Transition-Metal Borophosphates Na5(H3O){MII3[B3O3(OH)]3(PO4)6}·2H2O (MII = Mn, Co, Ni)","Inorganic Chemistry","2006","45","9","3588","3593","10.1021/ic051916f","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1101154","11.9683","0.0005","11.9683","0.0005","12.1303","0.0006","90","","90","","120","","1504.76","0.12","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- B9 H10 Mn3 Na5 O39 P6 -","- B9 Mn3 Na5 O39 P6 -","- B18 Mn6 Na10 O78 P12 -","2","0.166667","","Yang, Miao; Yu, Jihong; Di, Jiancheng; Li, Jiyang; Chen, Peng; Fang, Qianrong; Chen, Yan; Xu, Ruren","Syntheses, Structures, Ionic Conductivities, and Magnetic Properties of Three New Transition-Metal Borophosphates Na5(H3O){MII3[B3O3(OH)]3(PO4)6}·2H2O (MII = Mn, Co, Ni)","Inorganic Chemistry","2006","45","9","3588","3593","10.1021/ic051916f","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1101155","11.7171","0.0005","11.7171","0.0005","12.0759","0.0007","90","","90","","120","","1435.79","0.12","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- B9 H10 Na5 Ni3 O39 P6 -","- B9 Na5 Ni3 O39 P6 -","- B18 Na10 Ni6 O78 P12 -","2","0.166667","","Yang, Miao; Yu, Jihong; Di, Jiancheng; Li, Jiyang; Chen, Peng; Fang, Qianrong; Chen, Yan; Xu, Ruren","Syntheses, Structures, Ionic Conductivities, and Magnetic Properties of Three New Transition-Metal Borophosphates Na5(H3O){MII3[B3O3(OH)]3(PO4)6}·2H2O (MII = Mn, Co, Ni)","Inorganic Chemistry","2006","45","9","3588","3593","10.1021/ic051916f","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509042","7.49","","7.49","","4.29","","90","","90","","120","","208.426","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Silver strontium europium chloride (0.8/0.8/1.2/6)","","- Ag0.8 Cl6 Eu1.2 Sr0.8 -","- Ag0.8 Cl6 Eu1.206 Sr0.794 -","- Ag0.8 Cl6 Eu1.206 Sr0.794 -","1","0.0833333","","Wickleder, M.S.; Meyer, G.","Neue Derivate des U Cl3-Typs: Die Chloride und Bromide A (Sr Sm) Cl6, A (Sr Eu) Cl6 und A (Ba La) X6 (A= Na, Ag; X= Cl, Br)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1998","624","","1577","1582","10.1002/(SICI)1521-3749(199810)624:10<1577::AID-ZAAC1577>3.0.CO;2-4","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509181","10.48","","10.48","","8.326","","90","","90","","120","","791.935","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ag Cd3 Hf3 F20","","- Ag Cd3 F20 Hf3 -","- Ag Cd3 F20 Hf3 -","- Ag2 Cd6 F40 Hf6 -","2","0.166667","","Graudejus, O.; Mueller, B.G.","Ag2+ in trigonal-bipyramidaler Umgebung: Neue Fluoride mit zweiwertigem Silber: Ag M(II)3 M(IV)3 F20 (M(II) = Cd, Ca, Hg; M(IV) = Zr, Hf)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1996","622","","1549","1556","10.1002/zaac.19966220918","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509182","10.52","","10.52","","8.286","","90","","90","","120","","794.158","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ag Cd3 Zr3 F20","","- Ag Cd3 F20 Zr3 -","- Ag Cd3 F20 Zr3 -","- Ag2 Cd6 F40 Zr6 -","2","0.166667","","Mueller, B.G.; Graudejus, O.","Ag2+ in trigonal-bipyramidaler Umgebung: Neue Fluoride mit zweiwertigem Silber: Ag M(II)3 M(IV)3 F20 (M(II) = Cd, Ca, Hg; M(IV) = Zr, Hf)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1996","622","","1549","1556","10.1002/zaac.19966220918","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509626","11.46","","11.46","","4.66","","90","","90","","120","","530.012","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","K2 Ag12 Te7","","- Ag12 K2 Te7 -","- Ag12 K2 Te7 -","- Ag12 K2 Te7 -","1","0.0833333","","Pertlik, F.","Preparation and crystal structure of K2 Ag12 Te7","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","2001","132","","1509","1513","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509641","15.116","","15.116","","4.406","","90","","90","","120","","871.864","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tl6 Ag19.42 Se12.98","","- Ag19.42 Se12.98 Tl6 -","- Ag19.42 Se12.98 Tl6 -","- Ag19.42 Se12.98 Tl6 -","1","0.0833333","","Klepp, K.O.","Die Kristallstruktur von Tl6 Ag20-x Se14-y und ihre Beziehungen zum Rh20 Si13 und dem Zr6 Ni20 P13 Strukturtyp","Journal of the Less-Common Metals","1987","128","","131","142","10.1016/0022-5088(87)90199-8","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510356","10.5387","","10.5387","","4.7862","","90","","90","","120","","460.358","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Au10 In3 -","- Au10 In3 -","- Au20 In6 -","2","0.166667","","Schubert, K.; Rajasekharan, T.; Jandali, M.Z.","Crystal structure of Au10 In3","Zeitschrift fuer Metallkunde","1982","73","","463","467","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510919","9.2663","","9.2663","","5.6319","","90","","90","","120","","418.792","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sn4 Ir7 B3","","- B3 Ir7 Sn4 -","- B3 Ir7 Sn4 -","- B6 Ir14 Sn8 -","2","0.166667","","Jung, W.; Kluenter, W.","Sn5 Ir6 B2 und Sn4 Ir7 B3: Zinn-Iridiumboride mit eindimensionalen Ir/B-Verbaenden","Zeitschrift fuer Anorganische und Allgemeine Chemie","1996","622","","670","674","10.1002/zaac.19966220416","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510977","9.2008","","9.2008","","5.8079","","90","","90","","120","","425.795","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ce3 Cl3 (B O3)2","","- B2 Ce3 Cl3 O6 -","- B2 Ce3 Cl3 O6 -","- B4 Ce6 Cl6 O12 -","2","0.166667","","Nikelski, T.; Schleid, T.","Zwei Cer(III)-Chlorid-Oxoborate im Vergleich: Ce3 Cl3 (B O3)2 und Ce Cl (B O2)2","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","2200","2205","10.1002/zaac.200300208","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511048","6.08","","6.08","","6.55","","90","","90","","120","","209.691","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- B Cl3 -","- B Cl3 -","- B2 Cl6 -","2","0.166667","","Lipscomb, W.N.; Atoji, M.","B-Cl Distance in Boron Trichloride","Journal of Chemical Physics","1957","27","","195","195","10.1063/1.1743667","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1511049","6.14","","6.14","","6.603","","90","","90","","120","","215.58","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- B Cl3 -","- B Cl3 -","- B2 Cl6 -","2","0.166667","","Riva, A.; Rollier, M.A.","Determinazione roentgenografica della struttura cristallina del cloruro e del bromuro di boro allo stato solido","Gazzetta Chimica Italiana","1947","77","","361","366","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1511187","6.9966","","6.9966","","7.2615","","90","","90","","120","","307.844","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- B I3 -","- B I3 -","- B2 I6 -","2","0.166667","","Krossing, I.; Santiso-Quinones, G.","Reference values for the B - X bond lengths of B I3 and B Br3","Zeitschrift fuer Anorganische und Allgemeine Chemie","2008","634","","704","707","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1511188","6.9909","","6.9909","","7.3642","","90","","90","","120","","311.69","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- B I3 -","- B I3 -","- B2 I6 -","2","0.166667","","Albert, B.; Schmitt, K.","Die Kristallstruktur von Borontriiodid, B I3","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","809","810","10.1002/1521-3749(200105)627:5<809::AID-ZAAC809>3.0.CO;2-J","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1511213","9.5587","","9.5587","","7.2173","","90","","90","","120","","571.088","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","La5 (Si2 B O13)","","- B La5 O13 Si2 -","- B0.999 La5 O13 Si2.001 -","- B1.998 La10 O26 Si4.002 -","2","0.166667","","Tribaudino, M.; Mazza, D.; Delmastro, A.; Lebech, B.","Synthesis and neutron diffraction study of La5 Si2 B O13, an analog of the apatite mineral","Journal of Solid State Chemistry","2000","155","","389","393","10.1006/jssc.2000.8929","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511271","13.9882","","13.9882","","7.4515","","90","","90","","120","","1262.69","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","V2 (B (P O4)3)","","- B O12 P3 V2 -","- B O12 P3 V2 -","- B6 O72 P18 V12 -","6","0.5","","Meisel, M.; Paech, M.; Wulff-Molder, D.; Wilde, L.","Synthese und Kristallstruktur von Vanadium(III)-borophosphat, V2[B(PO4)3]","Zeitschrift fuer Anorganische und Allgemeine Chemie","2004","630","","983","985","10.1002/zaac.200400102","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511279","9.275","","9.275","","3.775","","90","","90","","120","","281.239","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tl3 B O3","","- B O3 Tl3 -","- B O3 Tl3 -","- B2 O6 Tl6 -","2","0.166667","","Marchand, R.; Piffard, Y.; Tournoux, M.","Structure et filiation structurale de phases Tl6 S O7 et Tl3 B O3","Revue de Chimie Minerale","1975","12","","210","217","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511284","3.776","","3.776","","8.806","","90","","90","","120","","108.736","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Y (B O3)","","- B O3 Y -","- B0.999 O2.999 Y -","- B1.998 O5.998 Y2 -","2","0.166667","","El Ghozzi, M.; Arbus, A.; Mahiou, R.; Cousseins, J.C.; Chadeyron, G.","Revised structure of the orthoborate Y B O3","Journal of Solid State Chemistry","1997","128","","261","266","10.1006/jssc.1996.7207","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511439","4.907","","4.907","","9.62","","90","","90","","120","","200.603","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ba Ga (B O3) F2","","- B Ba F2 Ga O3 -","- B Ba F2 Ga O3 -","- B2 Ba2 F4 Ga2 O6 -","2","0.166667","","Barbier, J.; Park, H.-S.","Crystal structures of the new borate fluorides Ba M B O3 F2 (M = Ga, Al)","Journal of Solid State Chemistry","2000","155","","354","358","10.1006/jssc.2000.8924","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511460","6.4304","","6.4304","","6.8466","","90","","90","","120","","245.178","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- B Br3 -","- B Br3 -","- B2 Br6 -","2","0.166667","","Krossing, I.; Santiso-Quinones, G.","Reference values for the B - X bond lengths of B I3 and B Br3","Zeitschrift fuer Anorganische und Allgemeine Chemie","2008","634","","704","707","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1511461","6.406","","6.406","","6.864","","90","","90","","120","","243.939","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- B Br3 -","- B Br3 -","- B2 Br6 -","2","0.166667","","Riva, A.; Rollier, M.A.","Determinazione roentgenografica della struttura cristallina del cloruro e del bromuro di boro allo stato solido","Gazzetta Chimica Italiana","1947","77","","361","366","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1511568","10.5167","","10.5167","","5.8146","","90","","90","","120","","556.941","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Y Ca3 (Ga O)3 (B O3)4","","- B4 Ca3 Ga3 O15 Y -","- B4 Ca3.005 Ga3 O15 Y0.995 -","- B8 Ca6.01 Ga6 O30 Y1.99 -","2","0.166667","","Yu, Y.; Li, R.K.; Wu, Q.S.","Structure of two new borates Y Ca3 (Al O)3 (B O3)4 and Y Ca3 (Ga O)3 (B O3)4","Journal of Solid State Chemistry","2006","179","","429","432","10.1016/j.jssc.2005.11.004","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511750","7.576","","7.576","","3.442","","90","","90","","120","","171.089","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sc Ir3 B4","","- B4 Ir3 Sc -","- B4 Ir3 Sc -","- B8 Ir6 Sc2 -","2","0.166667","","Rogl, P.; Nowotny, H.","Studies of the (Sc, Zr, Hf) - (Rh, Ir) - B systems","Journal of the Less-Common Metals","1979","67","","41","50","10.1016/0022-5088(79)90072-9","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1512768","16.5956","0.0004","16.5956","0.0004","14.3508","0.0008","90","","90","","120","","3422.9","0.2","298","2","298","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C15 H18 Mg N2 O8 -","- C15 H18 Mg N2 O8 -","- C90 H108 Mg6 N12 O48 -","6","0.5","","Paul J. Calderone; Debasis Banerjee; Anna M. Plonka; Sun Jin Kim; John B. Parise","Temperature dependent structure formation and photoluminescence studies of a series of magnesium-based coordination networks","Inorganica Chimica Acta","2013","394","","452","458","10.1016/j.ica.2012.08.033","","","0.71073","MoKα","","0.0892","0.0617","","","0.1669","0.1834","","","","","","1.082","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1512769","16.5956","0.0004","16.5956","0.0004","14.3508","0.0008","90","","90","","120","","3422.9","0.2","293","2","298","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C18.67 H21 Mg N3 O8 -","- C18.74 H21 Mg N2.99 O8 -","- C112.44 H126 Mg6 N17.94 O48 -","6","0.5","","Paul J. Calderone; Debasis Banerjee; Anna M. Plonka; Sun Jin Kim; John B. Parise","Temperature dependent structure formation and photoluminescence studies of a series of magnesium-based coordination networks","Inorganica Chimica Acta","2013","394","","452","458","10.1016/j.ica.2012.08.033","","","0.71073","MoKα","","0.0956","0.0643","","","0.1783","0.2071","","","","","","1.056","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1513377","14.766","0.0017","14.766","0.0017","17.858","0.004","90","","90","","120","","3372","0.9","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C28 H20 O4 -","- C28 H20 O4 -","- C168 H120 O24 -","6","0.5","","Surov, Oleg V.; Voronova, Marina I.; Barannikov, Vladimir P.; Shaposhnikov, Gennady P.","Structural Features and Thermal Stability of 25,26,27,28-Tetrahydroxycalix[4]arene Molecular Complexes with Solvents","The Journal of Physical Chemistry C","2014","118","1","338","","10.1021/jp409003f","","","0.71073","MoKα","","0.0789","0.0569","","","0.1553","0.1637","","","","","","1.024","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513702","12.979","0.002","12.979","0.002","13.565","0.004","90","","90","","120","","1978.9","0.7","120","2","120","2","","","","","","","","7","P 63/m","-P 6c","176","","tris(mu~2~-hydroxy)bis((1,4,7-trimethyl-1,4,7-triazacyclononane)- gallium(III)) bromide dichloromethane solvate","","- C21 H51 Br3 Cl6 Ga2 N6 O3 -","- C21 H51 Br3 Cl6 Ga2 N6 O3 -","- C42 H102 Br6 Cl12 Ga4 N12 O6 -","2","0.166667","","Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian","Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution","Chemical Science","2014","5","1","381","","10.1039/c3sc52104d","","","0.71073","MoKα","","0.0542","0.0436","","","0.0912","0.097","","","","","","1.059","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513703","7.997","0.005","7.997","0.005","18.178","0.007","90","","90","","120","","1006.8","1","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","","tris(tetramethylammonium) (mu~2~-trifluoro-hexafluorodialuminate)","","- C12 H36 Al2 F9 N3 -","- C12 H36 Al2 F9 N3 -","- C24 H72 Al4 F18 N6 -","2","0.166667","","Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian","Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution","Chemical Science","2014","5","1","381","","10.1039/c3sc52104d","","","0.71073","MoKα","","0.0631","0.0426","","","0.098","0.1073","","","","","","1.018","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1515034","23.018","0.003","23.018","0.003","42.321","0.007","90","","90","","120","","19419","5","123","2","123","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C90 H186 Cu5 Ga30 N23 S56 -","- C47.12 Cu4.96 Ga30.04 N10.47 S56 -","- C188.48 Cu19.84 Ga120.16 N41.88 S224 -","4","0.333333","","Xiong, Wei-Wei; Li, Jian-Rong; Hu, Bing; Tan, Bin; Li, Ren-Fu; Huang, Xiao-Ying","Largest discrete supertetrahedral clusters synthesized in ionic liquids","Chemical Science","2012","3","4","1200","","10.1039/c2sc00824f","","","0.71073","MoKα","","0.0891","0.0797","","","0.1516","0.1568","","","","","","1","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1515626","14.3139","0.0009","14.3139","0.0009","30.848","0.002","90","","90","","120","","5473.6","0.6","298","2","298","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C114 H60 B6 Cl12 N12 O12 -","- C114 H60 B6 Cl12 N12 O12 -","- C228 H120 B12 Cl24 N24 O24 -","2","0.166667","","Icli, Burcak; Sheepwash, Erin; Riis-Johannessen, Thomas; Schenk, Kurt; Filinchuk, Yaroslav; Scopelliti, Rosario; Severin, Kay","Dative boron‒nitrogen bonds in structural supramolecular chemistry: multicomponent assembly of prismatic organic cages","Chemical Science","2011","2","9","1719","","10.1039/c1sc00320h","","","1.54186","CuKα","","0.0975","0.0465","","","0.1081","0.121","","","","","","0.796","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516507","7.4597","0.0011","7.4597","0.0011","14.293","0.004","90","","90","","120","","688.8","0.2","300","","300","","","","","","","","","6","P 63/m","-P 6c","176","lanthanum(III) hexacyanidocobaltate(III) pentahydrate","lanthanum(III) hexacyanidocobaltate(III) pentahydrate","","- C6 H10 Co La N6 O5 -","- C6 H10.0002 Co La N6 O5 -","- C12 H20.0004 Co2 La2 N12 O10 -","2","0.166667","","Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.","Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)","Chemical Science","2014","5","9","3409","","10.1039/C4SC00809J","","","0.85","","","0.1199","0.118","","0.0935","0.0931","0.0927","","","","","","0.9954","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1516508","7.3829","0.0008","7.3829","0.0008","13.871","0.002","90","","90","","120","","654.78","0.14","150","2","150","2","","","","","","","","7","P 63/m","-P 6c","176","potassium lanthanum(III) hexacyanidoferrate(II) tetrahydrate","potassium lanthanum(III) hexacyanidoferrate(II) tetrahydrate","","- C6 H8 Fe K La N6 O4 -","- C6 H6 Fe K La N6 O4 -","- C12 H12 Fe2 K2 La2 N12 O8 -","2","0.166667","","Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.","Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)","Chemical Science","2014","5","9","3409","","10.1039/C4SC00809J","","","0.71073","MoKα","","0.0156","0.0145","","","0.0621","0.0659","","","","","","0.615","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516515","7.2338","0.0005","7.2338","0.0005","14.2923","0.0009","90","","90","","120","","647.69","0.08","150","2","150","2","","","","","","","","7","P 63/m","-P 6c","176","lithium lanthanum(III) hexacyanidoferrate(II) tetrahydrate","lithium lanthanum(III) hexacyanidoferrate(II) tetrahydrate","","- C6 H8 Fe La Li N6 O4 -","- C6 Fe La Li N6 O4 -","- C12 Fe2 La2 Li2 N12 O8 -","2","0.166667","","Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J.","Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5)","Chemical Science","2014","5","9","3409","","10.1039/C4SC00809J","","","0.71073","MoKα","","0.0465","0.0461","","","0.1414","0.1417","","","","","","1.281","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516555","16.5774","0.0007","16.5774","0.0007","10.5446","0.0005","90","","90","","120","","2509.54","0.19","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C15 H23 B Mn O3 P -","- C15 H23 B Mn O3 P -","- C90 H138 B6 Mn6 O18 P6 -","6","0.5","","Braunschweig, Holger; Kramer, Thomas; Radacki, Krzysztof; Shang, Rong; Siedler, Eva; Werner, Christine","Isolation of the key intermediates of base-promoted borylene‒carbonyl coupling reactions","Chemical Science","2014","5","6","2271","","10.1039/c4sc00183d","","","0.71073","MoKα","","0.0491","0.0424","","","0.1013","0.105","","","","","","1.154","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517675","5.6022","0.0002","5.6022","0.0002","3.3295","0.0002","90","","90","","120","","90.495","0.007","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sodium Yttrium Fluoride (1.5/1.5/6)","","- F6 Na1.5 Y1.5 -","- F6 Na1.5 Y1.5 -","- F6 Na1.5 Y1.5 -","1","0.0833333","","Grzechnik, A.; Bouvier, P.; Mezouar, M.; Mathews, M.D.; Tyagi, A.K.; Koehler, J.","Hexagonal Na(1.5) Y(1.5) F6 at high pressures","Journal of Solid State Chemistry","2002","165","","159","164","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1520296","9.66584","0.00033","9.66584","0.00033","7.19","0.00029","90","","90","","120","","581.75","0.04","300","","300","","","","","","","","","5","P 63/m","-P 6c","176","","","","- B0.6 La10 N1.4 O24.6 Si5.4 -","- B0.6 La10 N1.4 O24.6 Si5.4 -","- B0.6 La10 N1.4 O24.6 Si5.4 -","1","0.0833333","","Xia, Zhiguo; Molokeev, Maxim S.; Im, Won Bin; Unithrattil, Sanjith; Liu, Quanlin","Crystal Structure and Photoluminescence Evolution of La5(Si2+xB1‒x)(O13‒xNx):Ce3+Solid Solution Phosphors","The Journal of Physical Chemistry C","2015","119","17","9488","","10.1021/acs.jpcc.5b01211","powder diffraction","neutron","1.83515","neutron","","","","","","","","","3.1","3.124","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"1521029","9.6499","","9.6499","","6.7725","","90","","90","","120","","546.167","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca9.8 Na0.1 La0.1) (P O4)6 Cl2","","- Ca9.8 Cl2 La0.1 Na0.1 O24 P6 -","- Ca9.798 Cl2 La0.1038 Na0.1 O24 P6 -","- Ca9.798 Cl2 La0.1038 Na0.1 O24 P6 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Rare-earth elements in chlorapatite (Ca10 (P O4)6 Cl2): uptake, site preference, and degradation of monoclinic structure","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140656","2020-10-21","18:00:00",""
"1521031","9.6474","","9.6474","","6.7747","","90","","90","","120","","546.061","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca9.64 Na0.18 Nd0.18) (P O4)6 Cl2","","- Ca9.64 Cl2 Na0.18 Nd0.18 O24 P6 -","- Ca9.644 Cl2 Na0.174 Nd0.1834 O24 P6 -","- Ca9.644 Cl2 Na0.174 Nd0.1834 O24 P6 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Rare-earth elements in chlorapatite (Ca10 (P O4)6 Cl2): uptake, site preference, and degradation of monoclinic structure","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140658","2020-10-21","18:00:00",""
"1521032","9.6492","","9.6492","","6.7668","","90","","90","","120","","545.628","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca9.66 Na0.17 Sm0.17) (P O4)6 Cl2","","- Ca9.66 Cl2 Na0.17 O24 P6 Sm0.17 -","- Ca9.666 Cl2 Na0.164 O24 P6 Sm0.1702 -","- Ca9.666 Cl2 Na0.164 O24 P6 Sm0.1702 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Rare-earth elements in chlorapatite (Ca10 (P O4)6 Cl2): uptake, site preference, and degradation of monoclinic structure","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140659","2020-10-21","18:00:00",""
"1521033","9.6487","","9.6487","","6.7652","","90","","90","","120","","545.442","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca9.72 Na0.14 Dy0.14) (P O4)6 Cl2","","- Ca9.72 Cl2 Dy0.14 Na0.14 O24 P6 -","- Ca9.714 Cl2 Dy0.138 Na0.144 O24 P6 -","- Ca9.714 Cl2 Dy0.138 Na0.144 O24 P6 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Rare-earth elements in chlorapatite (Ca10 (P O4)6 Cl2): uptake, site preference, and degradation of monoclinic structure","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140660","2020-10-21","18:00:00",""
"1521036","9.4341","","9.4341","","6.8951","","90","","90","","120","","531.462","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","Ca9.674 Na0.045 La0.286 (P0.964 Si0.036 O4)6 (O H)2","","- Ca9.674 H2 La0.286 Na0.045 O26 P5.784 Si0.216 -","- Ca9.674 H2 La0.286 Na0.04 O26 P5.784 Si0.216 -","- Ca9.674 H2 La0.286 Na0.04 O26 P5.784 Si0.216 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Site preference of rare earth elements in hydroxyapatite Ca10 (P O4)6 (O H)2","Journal of Solid State Chemistry","2000","149","","391","398","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521037","9.4205","","9.4205","","6.8846","","90","","90","","120","","529.124","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","Ca9.616 Na0.064 Nd0.317 (P0.952 Si0.048 O4)6 (O H)2","","- Ca9.616 H2 Na0.064 Nd0.317 O26 P5.712 Si0.288 -","- Ca9.616 H2 Na0.064 Nd0.3168 O26 P5.712 Si0.288 -","- Ca9.616 H2 Na0.064 Nd0.3168 O26 P5.712 Si0.288 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Site preference of rare earth elements in hydroxyapatite Ca10 (P O4)6 (O H)2","Journal of Solid State Chemistry","2000","149","","391","398","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521038","9.4202","","9.4202","","6.8832","","90","","90","","120","","528.982","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","Ca9.692 Na0.04 Sm0.271 (P0.963 Si0.037 O4)6 (O H)2","","- Ca9.692 H2 Na0.04 O26 P5.778 Si0.222 Sm0.271 -","- Ca9.692 H2 Na0.04 O26 P5.778 Si0.222 Sm0.2708 -","- Ca9.692 H2 Na0.04 O26 P5.778 Si0.222 Sm0.2708 -","1","0.0833333","","Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M.","Site preference of rare earth elements in hydroxyapatite Ca10 (P O4)6 (O H)2","Journal of Solid State Chemistry","2000","149","","391","398","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521172","9.428","","9.428","","4.583","","90","","90","","120","","352.793","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tl Mo3 Te3","","- Mo3 Te3 Tl -","- Mo3 Te3 Tl -","- Mo6 Te6 Tl2 -","2","0.166667","","Hoenle, W.; von Schnering, H.G.; Yvon, K.; Lipka, A.","New compounds with infinite chains of face-condensed octahedral Mo6 clusters: In Mo3 Se3, In Mo3 Te3, Tl Mo3 Se3 and Tl Mo3 Te3","Journal of the Less-Common Metals","1980","71","","135","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521539","12.4579","","12.4579","","25.1495","","90","","90","","120","","3380.26","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Ta Se2","","- Se2 Ta -","- Se2 Ta -","- Se104 Ta52 -","52","4.33333","","Luedecke, J.; van Smaalen, S.; Wiegers, G.A.; de Boer, J.L.; Spijkerman, A.","Commensurately modulated structure of 4Hb-(Ta Se2) determined by X-ray crystal structure refinement","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","6063","6071","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521874","6.918","","6.918","","10.151","","90","","90","","120","","420.727","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","K2 Zr (Si3 O9)","","- K2 O9 Si3 Zr -","- K2 O9 Si3 Zr -","- K4 O18 Si6 Zr2 -","2","0.166667","","Sakai, K.; Nakagawa, T.; Okuno, M.; Kihara, K.","A mineral wadeite in glass, occurrence and crystal structure","Journal of Mineralogical and Petrological Sciences","2000","95","","24","31","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521929","9.7532","","9.7532","","6.7646","","90","","90","","120","","557.272","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Na Sm9 S2 (Si O4)6","","- Na O24 S2 Si6 Sm9 -","- Na0.976 O24 S2 Si6 Sm9.024 -","- Na0.976 O24 S2 Si6 Sm9.024 -","1","0.0833333","","Sieke, C.; Schleid, T.","Sm4 S3 (Si2 O7) und Na Sm9 S2 (Si O4)6 : zwei Sulfidsilicate mit dreiwertigem Samarium","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","131","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522048","9.3895","","9.3895","","6.895","","90","","90","","120","","526.441","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca1.57 Sm0.43 Na2) (Ca4.43 Sm1.57) (P O4)6 F2","","- Ca6 F2 Na2 O24 P6 Sm2 -","- Ca6 F2 Na2 O24 P6 Sm2 -","- Ca6 F2 Na2 O24 P6 Sm2 -","1","0.0833333","","Toumi, M.; Smiri-Dogguy, L.; Bulou, A.","Crystal structure and polarized Raman spectra of Ca6 Sm2 Na2 (P O4)6 F2","Journal of Solid State Chemistry","2000","149","","308","313","","","","","","","","","","","","","","","","","","","","","","has coordinates","142267","2020-10-21","18:00:00",""
"1522165","9.2496","","9.2496","","5.7486","","90","","90","","120","","425.93","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Eu (Cl O4)3","","- Cl3 Eu O12 -","- Cl3 Eu O12 -","- Cl6 Eu2 O24 -","2","0.166667","","Wickleder, M.S.","Eu (Cl O4)3 : first single crystals of an anhydrous rare-earth perchlorate","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","11","12","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522167","9.3361","","9.3361","","5.8488","","90","","90","","120","","441.498","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Pr (Cl O4)3","","- Cl3 O12 Pr -","- Cl3 O12 Pr -","- Cl6 O24 Pr2 -","2","0.166667","","Wickleder, M.S.; Schaefer, W.","Synthesis and structure of anhydrous rare-earth perchlorates M (Cl O4)3 (M = La, Ce-Er, Y): derivatives of the U Cl3 type structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","309","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522169","9.197","","9.197","","5.597","","90","","90","","120","","409.995","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Er (Cl O4)3","","- Cl3 Er O12 -","- Cl3 Er O12 -","- Cl6 Er2 O24 -","2","0.166667","","Wickleder, M.S.; Schaefer, W.","Synthesis and structure of anhydrous rare-earth perchlorates M (Cl O4)3 (M = La, Ce-Er, Y): derivatives of the U Cl3 type structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","309","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1524085","12.112","","12.112","","4.323","","90","","90","","120","","549.222","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ce6 Ni2 Si3","","- Ce6 Ni4 Si7 -","- Ce6 Ni4 Si7 -","- Ce12 Ni8 Si14 -","2","0.166667","","Bodak, O.I.; Gladyshevskii, E.I.; Kharchenko, O.I.","Crystal structure of Ce6 Ni2 Si3 and related compounds","Soviet Physics, Crystallography (= Kristallografiya)","1974","19","","45","46","","","","","","","","","","","","","","","","","","","","","","has coordinates","144746","2020-10-21","18:00:00",""
"1524707","9.35","","9.35","","4.223","","90","","90","","120","","319.724","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tl Fe3 Te3","","- Fe3 Te3 Tl -","- Fe3 Te3 Tl -","- Fe6 Te6 Tl2 -","2","0.166667","","Klepp, K.O.; Boller, H.","Die Kristallstruktur von Tl Fe3 Te3","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","1979","110","","677","684","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1524730","11.528","","11.528","","4.051","","90","","90","","120","","466.231","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Co3.11 Y4 -","- Co3.11333 Y4 -","- Co9.34 Y12 -","3","0.25","","Kolodziejczyk, A.; Szytula, A.; Leciejewicz, J.; Chmist, J.; Wegrzyn, J.","Structural studies of a magnetic superconductor Y9 Co7","Acta Physica Polonica, A","1987","72","","319","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1524806","7.313","","7.313","","7.87","","90","","90","","120","","364.499","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Cu10 Sn3 -","- Cu10 Sn3 -","- Cu20 Sn6 -","2","0.166667","","Lenz, J.; Schubert, K.","Kristallstruktur von Cu10 Sn3 (m)","Monatshefte fuer Chemie (-108,1977)","1971","102","","1689","1698","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1524897","10.153","","10.153","","7.733","","90","","90","","120","","690.347","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ba5 (P O4)3 F","","- Ba5 F O12 P3 -","- Ba5 F O12 P3 -","- Ba10 F2 O24 P6 -","2","0.166667","","Mathew, M.; Mayer, I.; Dickens, B.; Schroeder, L.W.","Substitution in Barium-Fluoride Apatite: The Crystal Structures of Ba10 (P O/4)6 F2, Ba6 La2 Na2 (P O4)6 F2 and Ba4 Nd3 Na3 (P O4)6 F2","Journal of Solid State Chemistry","1979","28","","79","95","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525225","9.505","","9.505","","34.14","","90","","90","","120","","2671.15","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","(K Ti9 S12)0.81","","- K0.6 S8 Ti6 -","- K0.6 S8 Ti6 -","- K0.6 S8 Ti6 -","1","0.0833333","","Schoellhorn, R.; Fenske, D.; Schramm, W.","Nichtstoechiometrische Alkalimetalltitansulfide mit Kanalstruktur","Angewandte Chemie (German Edition)","1980","92","","477","478","","","","","","","","","","","","","","","","","","","","","","has coordinates","146145","2020-10-21","18:00:00",""
"1525229","9.651","","9.651","","7.155","","90","","90","","120","","577.145","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ca La4 (Si O4)3 O","","- Ca La4 O13 Si3 -","- Ca1.002 La3.998 O13 Si3 -","- Ca2.004 La7.996 O26 Si6 -","2","0.166667","","Schroeder, L.W.; Mathew, M.","Cation ordering in Ca2 La8 (Si O4)6 O2","Journal of Solid State Chemistry","1978","26","","383","387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525421","5.676","","5.676","","7.12","","90","","90","","120","","198.653","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La Ru3 Si2 -","- La Ru3 Si2 -","- La2 Ru6 Si4 -","2","0.166667","","Vandenberg, J.M.; Barz, H.","The crystal structure of a new ternary silicide in the system rare-earth-ruthenium-silicon","Materials Research Bulletin","1980","15","","1493","1498","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525495","9.441","","9.441","","6.877","","90","","90","","120","","530.842","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ca3.678 (P O4)2.298 (O2.548 H4.63)","","- Ca3.678 H4.63 O11.74 P2.298 -","- Ca3.678 O11.738 P2.298 -","- Ca7.356 O23.476 P4.596 -","2","0.166667","","Young, R.A.; Mackie, P.E.","Cristallography of human tooth enamel. Initial structure refinement","Materials Research Bulletin","1980","15","","17","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525496","9.441","","9.441","","6.877","","90","","90","","120","","530.842","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ca3.192 P2.292 O16.424 H15.36 Cl.356","","- Ca3.192 Cl0.356 H15.36 O16.424 P2.292 -","- Ca3.192 Cl0.356 O16.424 P2.292 -","- Ca3.192 Cl0.356 O16.424 P2.292 -","1","0.0833333","","Young, R.A.; Mackie, P.E.","Cristallography of human tooth enamel. Initial structure refinement","Materials Research Bulletin","1980","15","","17","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525497","9.442","","9.442","","6.877","","90","","90","","120","","530.955","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ca3.29 (P O4)2.478 (O8.562 H17.978)","","- Ca3.29 H17.978 O18.474 P2.478 -","- Ca3.29 O18.474 P2.478 -","- Ca3.29 O18.474 P2.478 -","1","0.0833333","","Young, R.A.; Mackie, P.E.","Cristallography of human tooth enamel. Initial structure refinement","Materials Research Bulletin","1980","15","","17","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525498","9.447","","9.447","","6.892","","90","","90","","120","","532.677","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ca4.4 (P O4)2.196 (O9.712 H17.212)","","- Ca4.4 H17.212 O18.496 P2.196 -","- Ca4.4 O18.496 P2.196 -","- Ca4.4 O18.496 P2.196 -","1","0.0833333","","Young, R.A.; Mackie, P.E.","Cristallography of human tooth enamel. Initial structure refinement","Materials Research Bulletin","1980","15","","17","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525499","9.447","","9.447","","6.892","","90","","90","","120","","532.677","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ca4.372 P2.202 O18.130 H16.822 Cl.316","","- Ca4.372 Cl0.316 H16.822 O18.13 P2.202 -","- Ca4.372 Cl0.316 O18.13 P2.202 -","- Ca4.372 Cl0.316 O18.13 P2.202 -","1","0.0833333","","Young, R.A.; Mackie, P.E.","Cristallography of human tooth enamel. Initial structure refinement","Materials Research Bulletin","1980","15","","17","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525598","20.462","","20.462","","3.89184","","90","","90","","120","","1411.18","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ce20 Ni42 P30 -","- Ce20 Ni42 P30 -","- Ce20 Ni42 P30 -","1","0.0833333","","Babizhet'sky, V.S.; Weitzer, F.; Hiebl, K.","Structural chemistry, magnetic and electrical properties of ternary rare-earth nickel phosphides, R20 Ni42 P30 (R = Ce, Sm)","Journal of Alloys Compd.","2001","317","","250","253","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525662","9.736","","9.736","","7.116","","90","","90","","120","","584.154","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ce4.67 Si3 O13","","- Ce4.67 O13 Si3 -","- Ce4.666 O13 Si3 -","- Ce9.332 O26 Si6 -","2","0.166667","","Belokoneva, E.L.; Petrova, T.L.; Simonov, M.A.; Belov, N.V.","Crystal structure of synthetic TR analogs of apatite Dy4.67 (Ge O4)3 O and Ce4.67 (Si O4)3 O","Kristallografiya","1972","17","","490","493","","","","","","","","","","","","","","","","","","","","","","has coordinates","146690","2020-10-21","18:00:00",""
"1525663","9.2","","9.2","","6.808","","90","","90","","120","","499.029","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Dy4.67 (Ge O4)3 O","","- Dy4.67 Ge3 O13 -","- Dy4.66 Ge3 O13 -","- Dy9.32 Ge6 O26 -","2","0.166667","","Belokoneva, E.L.; Petrova, T.L.; Belov, N.V.; Simonov, M.A.","Crystal structure of synthetic TR analogs of apatite Dy4.67 (Ge O4)3 O and Ce4.67 (Si O4)3 O","Kristallografiya","1972","17","","490","493","","","","","","","","","","","","","","","","","","","","","","has coordinates","146691","2020-10-21","18:00:00",""
"1525757","9.3927","","9.3927","","6.8985","","90","","90","","120","","527.067","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ca4.9 (P O4)2.82 O0.72 (O D)","","- Ca4.9 D O13 P2.82 -","- Ca4.9 D O13 P2.82 -","- Ca9.8 D2 O26 P5.64 -","2","0.166667","","Leventouri, T.; Chakoumakos, B.C.; Perdikatsis, B.; Papanearchou, N.","Comparison of crystal structure parameters of natural and synthetic apatites from neutron powder diffraction","Journal of Materials Research","2001","16","","2600","2606","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525961","9.3249","","9.3249","","6.9213","","90","","90","","120","","521.203","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ca3.36 Na0.08) (Ca5.04 Na0.72) (P O4)3.6 (C O3)2.4 (O H)2","","- C2.4 H2 Ca8.4 Na0.8 O23.6 P3.6 -","- C2.4 Ca8.4 Na0.798 O23.6 P3.6 -","- C2.4 Ca8.4 Na0.798 O23.6 P3.6 -","1","0.0833333","","El Feki, H.; Savariault, J.M.; Ben Salah, A.; Jemal, M.","Sodium and carbonate distribution in substituted calcium hydroxyapatite","Solid State Sciences","2000","2","","577","586","","","","","","","","","","","","","","","","","","","","","","has coordinates","147048","2020-10-21","18:00:00",""
"1525969","9.7249","","9.7249","","7.19","","90","","90","","120","","588.884","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na Pb4 (P O4)3","","- Na O12 P3 Pb4 -","- Na O12 P3 Pb4 -","- Na2 O24 P6 Pb8 -","2","0.166667","","El Koumiri, M.; Oishi, S.; Elouadi, B.; Sato, S.; El Ammari, L.","The crystal structure of the lacunar apatite Na Pb4 (P O4)3","Materials Research Bulletin","2000","35","","503","513","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526002","11.056","","11.056","","10.629","","90","","90","","120","","1125.17","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","Ca3 Ge (O H)6 (S O4)1.08 (C O3)0.92 (H2 O)12","","- C0.92 H30 Ca3 Ge O25.08 S1.08 -","- C0.92 H30 Ca3 Ge O25.08 S1.08 -","- C1.84 H60 Ca6 Ge2 O50.16 S2.16 -","2","0.166667","","Merlino, S.; Orlandi, P.","Carraraite and zaccagnaite, two new minerals from the Carrara marble quarries: their chemical compositions, physical properties, and structural features","American Mineralogist","2001","86","","1293","1301","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526015","11.049","","11.049","","25.219","","90","","90","","120","","2666.27","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","(H3 O)0.444 Ce0.888 (Ce0.08 (H3 O)0.14) (S O4)2 (H2 O)4.34","","- Ce0.968 H10.432 O12.924 S2 -","- Ce0.968889 H8.96 O12.9244 S2 -","- Ce8.72 H80.64 O116.32 S18 -","9","0.75","","Filipenko, O.S.; Shilov, G.V.; Atovmyan, L.O.; Ponomarev, V.I.; Leonova, L.S.","Crystal structure of hydroxonium salt of mixed cerium(III) - cerium(IV) sulfate hydrate","Doklady Akad. Nauk","2001","380","","208","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526046","11.747","","11.747","","4.163","","90","","90","","120","","497.498","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Gd6 Co3 Si2","","- Co3 Gd6 Si2 -","- Co3.001 Gd6 Si1.999 -","- Co6.002 Gd12 Si3.998 -","2","0.166667","","Morozkin, A.V.; Klyamkin, S.N.; Sviridov, I.A.","New ternary (Ce6 Ni2 Si3)-type Sm6 (Co, Ni)2 Si3 compounds and their interaction with hydrogen","Journal of Alloys Compd.","2001","316","","236","238","","","","","","","","","","","","","","","","","","","","","","has coordinates","147149","2020-10-21","18:00:00",""
"1526048","11.859","","11.859","","4.194","","90","","90","","120","","510.805","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sm6 Co2 Si3","","- Co2 Si3 Sm6 -","- Co1.999 Si3.001 Sm6 -","- Co3.998 Si6.002 Sm12 -","2","0.166667","","Morozkin, A.V.; Sviridov, I.A.; Klyamkin, S.N.","New ternary (Ce6 Ni2 Si3)-type Sm6 (Co, Ni)2 Si3 compounds and their interaction with hydrogen","Journal of Alloys Compd.","2001","316","","236","238","","","","","","","","","","","","","","","","","","","","","","has coordinates","147151","2020-10-21","18:00:00",""
"1526050","11.81","","11.81","","4.212","","90","","90","","120","","508.767","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sm6 Ni2 Si3","","- Ni2 Si3 Sm6 -","- Ni1.999 Si3.001 Sm6 -","- Ni3.998 Si6.002 Sm12 -","2","0.166667","","Morozkin, A.V.; Klyamkin, S.N.; Sviridov, I.A.","New ternary (Ce6 Ni2 Si3)-type Sm6 (Co, Ni)2 Si3 compounds and their interaction with hydrogen","Journal of Alloys Compd.","2001","316","","236","238","","","","","","","","","","","","","","","","","","","","","","has coordinates","147153","2020-10-21","18:00:00",""
"1526051","12.57","","12.57","","4.016","","90","","90","","120","","549.534","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Sm6 Ni2 Si3 H12","","- H12 Ni2 Si3 Sm6 -","- Ni1.999 Si3.001 Sm6 -","- Ni3.998 Si6.002 Sm12 -","2","0.166667","","Morozkin, A.V.; Klyamkin, S.N.; Sviridov, I.A.","New ternary (Ce6 Ni2 Si3)-type Sm6 (Co, Ni)2 Si3 compounds and their interaction with hydrogen","Journal of Alloys Compd.","2001","316","","236","238","","","","","","","","","","","","","","","","","","","","","","has coordinates","147154","2020-10-21","18:00:00",""
"1526125","3.8351","","3.8351","","9.7512","","90","","90","","120","","124.206","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Y2 (Al Si O5 N)","","- Al N O5 Si Y2 -","- Al1.002 N O5.002 Si1.002 Y2 -","- Al1.002 N O5.002 Si1.002 Y2 -","1","0.0833333","","Gonon, M.F.; Cambier, F.; Descamps, J.C.; Thompson, D.P.","Crystal structure determination of Y2 Si Al O5 N ""B-phase"" by Rietveld analysis","Materials Science Forum","2000","325","","325","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526140","9.9636","","9.9636","","7.2061","","90","","90","","120","","619.532","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Sr2 (Sr2.99 Eu0.01) (P O4)3 Br","","- Br Eu0.01 O12 P3 Sr4.99 -","- Br Eu0.009 O12 P3 Sr4.991 -","- Br2 Eu0.018 O24 P6 Sr9.982 -","2","0.166667","","Noetzold, D.; Wulff, H.","Structural and optical properties of the system Sr5 (P O4)3 (Br, F) : Eu(2+)","Physica Status Solidi, Sectio A: Applied Research","2000","177","","281","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526142","9.8885","","9.8885","","7.2344","","90","","90","","120","","612.624","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","Sr2 (Sr2.99 Eu0.01) (P O4)3 Br0.75 F0.25","","- Br0.75 Eu0.01 F0.25 O12 P3 Sr4.99 -","- Br0.75 Eu0.009 F0.25 O12 P3 Sr4.991 -","- Br1.5 Eu0.018 F0.5 O24 P6 Sr9.982 -","2","0.166667","","Noetzold, D.; Wulff, H.","Structural and optical properties of the system Sr5 (P O4)3 (Br, F): Eu(2+)","Physica Status Solidi, Sectio A: Applied Research","2000","177","","281","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","147259","2020-10-21","18:00:00",""
"1526144","9.7623","","9.7623","","7.2699","","90","","90","","120","","600.017","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","Sr2 (Sr2.99 Eu0.01) (P O4)3 Br0.5 F0.5","","- Br0.5 Eu0.01 F0.5 O12 P3 Sr4.99 -","- Br0.5 Eu0.009 F0.5 O12 P3 Sr4.991 -","- Br Eu0.018 F O24 P6 Sr9.982 -","2","0.166667","","Noetzold, D.; Wulff, H.","Structural and optical properties of the system Sr5 (P O4)3 (Br, F): Eu(2+)","Physica Status Solidi, Sectio A: Applied Research","2000","177","","281","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","147261","2020-10-21","18:00:00",""
"1526145","9.7186","","9.7186","","7.2853","","90","","90","","120","","595.917","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","Sr2 (Sr2.99 Eu0.01) (P O4)3 Br0.25 F0.75","","- Br0.25 Eu0.01 F0.75 O12 P3 Sr4.99 -","- Br0.25 Eu0.009 F0.75 O12 P3 Sr4.991 -","- Br0.5 Eu0.018 F1.5 O24 P6 Sr9.982 -","2","0.166667","","Noetzold, D.; Wulff, H.","Structural and optical properties of the system Sr5 (P O4)3 (Br, F): Eu(2+)","Physica Status Solidi, Sectio A: Applied Research","2000","177","","281","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","147263","2020-10-21","18:00:00",""
"1526214","4.882","","4.882","","9.398","","90","","90","","120","","193.982","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ba Al (B O3) F2","","- Al B Ba F2 O3 -","- Al B Ba F2 O3 -","- Al2 B2 Ba2 F4 O6 -","2","0.166667","","Park, H.-S.; Barbier, J.","Crystal structures of the new borate fluorides Ba M B O3 F2 (M = Ga, Al)","Journal of Solid State Chemistry","2000","155","","354","358","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526246","8.5149","","8.5149","","7.7481","","90","","90","","120","","486.502","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","In4 (Si2 P6 O25)","","- In4 O25 P6 Si2 -","- In4 O24.9996 P6 Si2 -","- In4 O24.9996 P6 Si2 -","1","0.0833333","","Hanawa, M.; Kobayashi, T.; Imoto, H.","Silicophosphates of rhodium and indium","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","216","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","147388","2020-10-21","18:00:00",""
"1526459","9.4372","","9.4372","","6.8881","","90","","90","","120","","531.271","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","Ca3.4 (Ca5.9 (N H4)0.09) ((P O4)4.95 (C O3)1.08 (H2 O)0.45) ((O H)1.65 (H2 O)0.75)","","- C1.08 H4.41 Ca9.3 N0.09 O25.89 P4.95 -","- C1.08 Ca9.302 N0.09 O25.898 P4.944 -","- C1.08 Ca9.302 N0.09 O25.898 P4.944 -","1","0.0833333","","Ivanova, T.I.; Ugolkov, V.L.; Koltsov, A.B.; Frank-Kamenetskaya, O.V.","Crystal structure of calcium-deficient carbonated hydroxyapatite. Thermal decomposition","Journal of Solid State Chemistry","2001","160","","340","349","","","","","","","","","","","","","","","","","","","","","","has coordinates","147650","2020-10-21","18:00:00",""
"1526815","9.7051","","9.7051","","7.2546","","90","","90","","120","","591.758","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","La10 (Si6 O22 N2) O2","","- La10 N2 O24 Si6 -","- La10 N2.0004 O23.9996 Si6 -","- La10 N2.0004 O23.9996 Si6 -","1","0.0833333","","Titeux, S.; Gervais, M.; Verdier, P.; Laurent, Y.","Synthesis and X-ray diffraction study of substituted La10 (Si6 O22 N2) O2 silicon apatites","Materials Science Forum","2000","325","","17","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","148064","2020-10-21","18:00:00",""
"1526817","9.7191","","9.7191","","7.2073","","90","","90","","120","","589.597","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","La9 Ti (Si6 O21 N3) O2","","- La9 N3 O23 Si6 Ti -","- La9 N3 O23 Si6 Ti -","- La9 N3 O23 Si6 Ti -","1","0.0833333","","Titeux, S.; Gervais, M.; Verdier, P.; Laurent, Y.","Synthesis and X-ray diffraction study of substituted La10 (Si6 O22 N2) O2 silicon apatites","Materials Science Forum","2000","325","","17","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526866","14.447","","14.447","","10.686","","90","","90","","120","","1931.53","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","La4.333 Cu2.888 V1.444 O13","","- Cu2.888 La4.333 O13 V1.444 -","- Cu2.87 La4.33333 O13 V1.46333 -","- Cu17.22 La26 O78 V8.78 -","6","0.5","","Vander Griend, D.A.; Barry, S.J.; Malo, S.; Poeppelmeier, K.R.; Dravid, V.P.; Dabbousch, N.M.","La3 Cu2 V O9: a surprising variation on the Y Al O3 structure-type with 2D copper clusters of embedded triangles","Solid State Sciences","2001","3","","569","579","","","","","","","","","","","","","","","","","","","","","","has coordinates","148124","2020-10-21","18:00:00",""
"1527011","9.869","","9.869","","6.851","","90","","90","","120","","577.871","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ba Sm4 (Si O4)3 Se","","- Ba O12 Se Si3 Sm4 -","- Ba O12 Se Si3 Sm4 -","- Ba2 O24 Se2 Si6 Sm8 -","2","0.166667","","Yang, Y.-T.; Ibers, J.A.","Accidental silicon-containing compounds: crystal structures of La3 Al0.44 Si0.93 S7, Ba Sm4 (Si O4)3 Se, and monoclinic and orthorhombic Ln2 (Si O4) Te (Ln = Nd and Sm)","Journal of Solid State Chemistry","2000","155","","433","440","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527328","9","","9","","7.92","","90","","90","","120","","555.573","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tc O F4","","- F4 O Tc -","- F4 O Tc -","- F24 O6 Tc6 -","6","0.5","","Edwards, A.J.; Jones, G.R.; Sills, R.J.C.","Fluride crystal structures. Part XII. Trimeric technetium oxide tetrafluoride","Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971)","1970","1970","","2521","2523","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527576","9.625","","9.625","","6.504","","90","","90","","120","","521.81","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Cd5 (P O4)3 Cl","","- Cd5 Cl O12 P3 -","- Cd5 Cl O12 P3 -","- Cd10 Cl2 O24 P6 -","2","0.166667","","Ivanov, A.; Simonov, M.A.; Belov, N.","Kristallicheskaya struktura Cd-khlorapatita Cd5 (P O4)3 Cl","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1976","17","","375","378","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527855","11.67","","11.67","","9.95","","90","","90","","120","","1173.53","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Sb Cl4 (N C O)","","- C Cl4 N O Sb -","- C Cl4 N O Sb -","- C6 Cl24 N6 O6 Sb6 -","6","0.5","","Mueller, U.","Kristallstruktur von Antimontetrachloridcyanurat (Sb Cl4 N C O)3","Zeitschrift fuer Anorganische und Allgemeine Chemie","1976","422","","141","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528061","9.9812","","9.9812","","16.851","","90","","90","","120","","1453.86","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Hg In10 K8 -","- Hg1.032 In9.968 K8 -","- Hg2.064 In19.936 K16 -","2","0.166667","","Sevov, S.C.; Ostenson, J.E.; Corbett, J.D.","K8 In10 Hg: a Zintl phase with isolated In10 Hg clusters","Journal of Alloys Compd.","1993","202","","289","294","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528080","10.0074","","10.0074","","3.4667","","90","","90","","120","","300.67","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Nb3 Se4 -","- Nb3 Se4 -","- Nb6 Se8 -","2","0.166667","","Smeggil, J.G.","Void Channels in the Nb3 Te4, Ta2 S, and Nb2 Se Structure Types: The Structure of Nb3 Se4","Journal of Solid State Chemistry","1971","3","","248","251","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528342","10.15","","10.15","","6.7938","","90","","90","","120","","606.144","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ca5 (V O4)3 Cl","","- Ca5 Cl O12 V3 -","- Ca5 Cl1.002 O12 V3 -","- Ca10 Cl2.004 O24 V6 -","2","0.166667","","Beck, H.P.; Douiheche, M.; Haberkorn, R.; Kohlmann, H.","Synthesis and characterisation of chloro-vanadato-apatites M5 (V O4)3 Cl (M = Ca, Sr, Ba)","Solid State Sciences","2006","8","","64","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528343","10.2073","","10.2073","","7.3067","","90","","90","","120","","659.286","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Sr5 (V O4)3 Cl","","- Cl O12 Sr5 V3 -","- Cl O12 Sr5 V3 -","- Cl2 O24 Sr10 V6 -","2","0.166667","","Beck, H.P.; Douiheche, M.; Haberkorn, R.; Kohlmann, H.","Synthesis and characterisation of chloro-vanadato-apatites M5 (V O4)3 Cl (M = Ca, Sr, Ba)","Solid State Sciences","2006","8","","64","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528344","10.5468","","10.5468","","7.7437","","90","","90","","120","","745.969","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ba5 (V O4)3 Cl","","- Ba5 Cl O12 V3 -","- Ba5 Cl O12 V3 -","- Ba10 Cl2 O24 V6 -","2","0.166667","","Beck, H.P.; Douiheche, M.; Haberkorn, R.; Kohlmann, H.","Synthesis and characterisation of chloro-vanadato-apatites M5 (V O4)3 Cl (M = Ca, Sr, Ba)","Solid State Sciences","2006","8","","64","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528375","12.309","","12.309","","4.242","","90","","90","","120","","556.605","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","U7 Te12","","- Te12 U7 -","- Te12 U7 -","- Te12 U7 -","1","0.0833333","","Breeze, E.W.; Brett, N.H.","The crystal structure of U7 Te12 and U2 O2 Te","Journal of Nuclear Materials","1971","40","","113","115","","","","","","","","","","","","","","","","","","","","","","has coordinates","150518","2020-10-21","18:00:00",""
"1528484","9.3221","","9.3221","","6.7347","","90","","90","","120","","506.846","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ho8.67 (Si O4)6 (O H)2","","- H2 Ho8.67 O26 Si6 -","- H2 Ho8.662 O26 Si6 -","- H2 Ho8.662 O26 Si6 -","1","0.0833333","","Fleet, M.; Liu, X","High-pressure rare earth silicates: lanthanum silicate with barium phosphate structure, holmium silicate apatite, and lutetium disilicate type X","Journal of Solid State Chemistry","2005","178","","3275","3283","","","","","","","","","","","","","","","","","","","","","","has coordinates","150777","2020-10-21","18:00:00",""
"1528487","9.3762","","9.3762","","2.7786","","90","","90","","120","","211.549","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na Li2 Ru6 O12","","- Li2 Na O12 Ru6 -","- Li2 Na O12 Ru6 -","- Li2 Na O12 Ru6 -","1","0.0833333","","Foo, M.L.; He, T.; Lawes, G.; Zandbergen, H.W.; Huang, Q.; Cava, R.J.; Ramirez, A.P.; Siegrist, T.","Synthesis and characterization of the pseudo-hexagonal hollandites A Li2 Ru6 O12 (A = Na, K)","Journal of Solid State Chemistry","2006","179","","941","948","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528488","9.4053","","9.4053","","2.7672","","90","","90","","120","","211.991","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","K Li2 Ru6 O12","","- K Li2 O12 Ru6 -","- K Li2 O12 Ru6 -","- K Li2 O12 Ru6 -","1","0.0833333","","Foo, M.L.; Lawes, G.; He, T.; Huang, Q.; Siegrist, T.; Zandbergen, H.W.; Ramirez, A.P.; Cava, R.J.","Synthesis and characterization of the pseudo-hexagonal hollandites A Li2 Ru6 O12 (A = Na, K)","Journal of Solid State Chemistry","2006","179","","941","948","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528511","9.39199","","9.39199","","6.84041","","90","","90","","120","","522.55","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na0.5 Tb4.5 (Si O4)3 O","","- Na0.5 O13 Si3 Tb4.5 -","- O13 Si3 Tb4.574 -","- O26 Si6 Tb9.148 -","2","0.166667","","Garra, W.; Marchetti, F.; Merlino, S.","Tb/Na tobermorite: thermal behaviour and high temperature products","Journal of Solid State Chemistry","2009","182","","1529","1532","","","","","","","","","","","","","","","","","","","","","","has coordinates","150876","2020-10-21","18:00:00",""
"1528701","9.738","","9.738","","7.887","","90","","90","","120","","647.712","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","((C H3)4 N) (Sn I3)","","- C4 H12 I3 N Sn -","- C3.99 I3 N Sn -","- C7.98 I6 N2 Sn2 -","2","0.166667","","Lode, C.; Krautscheid, H.","Iodostannate(II) mit kettenfoermigen [Sn I3](-)-Anionen - der Uebergang von fuenffach zu sechsfach koordinierten Sn(II)-Zentralatomen","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","841","846","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528728","9.827","","9.827","","7.304","","90","","90","","120","","610.848","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pb8 K2 (P O4)6","","- K2 O24 P6 Pb8 -","- K2.042 O24 P6 Pb7.998 -","- K2.042 O24 P6 Pb7.998 -","1","0.0833333","","Mathew, M.; Brown, W.E.; Austin, M.; Negas, T.","Lead alkali apatites without hexad anion: The crystal structure of Pb8 K2 (P O4)6","Journal of Solid State Chemistry","1980","35","","69","76","","","","","","","","","","","","","","","","","","","","","","has coordinates","151333","2020-10-21","18:00:00",""
"1529047","10.38775","","10.38775","","5.69198","","90","","90","","120","","531.909","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Y Ca3 (Al O)3 (B O3)4","","- Al3 B4 Ca3 O15 Y -","- Al3 B4 Ca2.999 O15 Y1.001 -","- Al6 B8 Ca5.998 O30 Y2.002 -","2","0.166667","","Yu, Y.; Wu, Q.S.; Li, R.K.","Structure of two new borates Y Ca3 (Al O)3 (B O3)4 and Y Ca3 (Ga O)3 (B O3)4","Journal of Solid State Chemistry","2006","179","","429","432","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529140","9.7532","","9.7532","","7.2371","","90","","90","","120","","596.197","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","La9.71 (Al0.19 Si0.81 O4)6 O2","","- Al1.14 La9.71 O26 Si4.86 -","- Al1.14 La9.72 O26 Si4.86 -","- Al1.14 La9.72 O26 Si4.86 -","1","0.0833333","","Kahlenberg, V.; Krueger, H.","La Al Si O5 and apatite-type La9.71 (Si0.81 Al0.19 O4)6 O2 - the crystal structures of two synthetic lanthanum alumosilicates","Solid State Sciences","2004","6","","553","560","","","","","","","","","","","","","","","","","","","","","","has coordinates","152203","2020-10-21","18:00:00",""
"1529425","23.8013","0.0006","23.8013","0.0006","13.6022","0.0005","90","","90","","120","","6673.3","0.3","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","","Tris[(1,2-bis{diphenylphosphinoethane}platinum(II)]cyclotricatechylene hydrate octakis-dimethylacetamide solvate","","- C131 H158 N8 O15 P6 Pt3 -","- C123 H141 N6 O13 P6 Pt3 -","- C246 H282 N12 O26 P12 Pt6 -","2","0.166667","","Loughrey, Jonathan J.; Patmore, Nathan J.; Baldansuren, Amgalanbaatar; Fielding, Alistair J.; McInnes, Eric J. L.; Hardie, Michaele J.; Sproules, Stephen; Halcrow, Malcolm A.","Platinum(ii) complexes of mixed-valent radicals derived from cyclotricatechylene, a macrocyclic tris-dioxolene","Chem. Sci.","2015","6","12","6935","","10.1039/C5SC02776D","","","0.6998","synchrotron","","0.0828","0.0803","","","0.1886","0.1897","","","","","","1.203","","","","has coordinates,has disorder","170970","2020-10-21","18:00:00",""
"1529489","9.55299","0.00024","9.55299","0.00024","7.21426","0.00023","90","","90","","120","","570.17","0.03","300","","300","","","","","","","","","4","P 63/m","-P 6c","176","","","","- B La5 O13 Si2 -","- B La5 O13 Si2 -","- B2 La10 O26 Si4 -","2","0.166667","","Zhiguo Xia; Maxim S. Molokeev; Won Bin Im; Sanjith Unithrattil; Quanlin Liu","Crystal Structure and Photoluminescence Evolution of La5(Si2+xB1-x)(O13-xNx):Ce3+ Solid Solution Phosphors","The Journal of Physical Chemistry C","2015","119","17","9488","9495","10.1021/acs.jpcc.5b01211","powder diffraction","","1.83515","neutron","","","","","","","","","1.98","2.31","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1529490","9.71207","0.00023","9.71207","0.00023","7.18946","0.0002","90","","90","","120","","587.29","0.03","300","","300","","","","","","","","","4","P 63/m","-P 6c","176","","","","- La5 N O12 Si3 -","- La5 N1.0002 O11.9998 Si3 -","- La10 N2.0004 O23.9996 Si6 -","2","0.166667","","Zhiguo Xia; Maxim S. Molokeev; Won Bin Im; Sanjith Unithrattil; Quanlin Liu","Crystal Structure and Photoluminescence Evolution of La5(Si2+xB1-x)(O13-xNx):Ce3+ Solid Solution Phosphors","The Journal of Physical Chemistry C","2015","119","17","9488","9495","10.1021/acs.jpcc.5b01211","powder diffraction","neutron","1.83515","neutron","","","","","","","","","3.45","3.483","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1529491","9.85486","0.00031","9.85486","0.00031","7.30224","0.00025","90","","90","","120","","614.17","0.03","300","","300","","","","","","","","","5","P 63/m","-P 6c","176","","","","- F2 La7.22 O24 Si6 Sr2.78 -","- F2 La7.218 O24 Si6 Sr2.782 -","- F2 La7.218 O24 Si6 Sr2.782 -","1","0.0833333","","Qingfeng Guo; Libing Liao; Maxim S. Molokeev; Lefu Mei; Haikun Liu","Color Tunable Emission and Energy Transfer of Ce3+ and Tb3+ co-doped Novel La6Sr4(SiO4)6F2 Phosphors with apatite structure","Materials Research Bulletin","2015","72","0","245","251","10.1016/j.materresbull.2015.07.029","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","3.77","1.512","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1529559","9.625","","9.625","","6.747","","90","","90","","120","","541.306","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Co0.99 Ca4.01 Cl0.89 (P O4)3","","- Ca4.01 Cl0.89 Co0.99 O12 P3 -","- Ca4.01 Cl0.89 Co0.99 O12 P3 -","- Ca8.02 Cl1.78 Co1.98 O24 P6 -","2","0.166667","","Anderson, J.B.; Kostiner, E.","The crystal structure of cobalt-substituted calcium chlorapatite","Journal of Solid State Chemistry","1987","66","","343","349","","","","","","","","","","","","","","","","","","","","","","has coordinates","154008","2020-10-21","18:00:00",""
"1529572","14.3421","","14.3421","","4.0528","","90","","90","","120","","721.957","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na2 Pb11 F18 Br6","","- Br6 F18 Na2 Pb11 -","- Br6 F18 Na2.0002 Pb10.9998 -","- Br6 F18 Na2.0002 Pb10.9998 -","1","0.0833333","","Aurivillius, B.","X-ray studies on mixed sodium lead bromide fluorides with the limiting composition 3Pb F2 * Pb Br2 and similar substances","Chemica Scripta","1977","12","","18","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","154021","2020-10-21","18:00:00",""
"1529696","9.139","","9.139","","3.3025","","90","","90","","120","","238.875","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","K.2 V6 S8","","- K0.2 S8 V6 -","- K0.22 S8 V6 -","- K0.22 S8 V6 -","1","0.0833333","","Bronsema, K.D.; Wiegers, G.A.","Structures and some physical properties of phases in the system K-V-S: K.2 V6 S8 and K.6 V S2","Materials Research Bulletin","1987","22","","1073","1080","","","","","","","","","","","","","","","","","","","","","","has coordinates","154196","2020-10-21","18:00:00",""
"1530032","10.023","","10.023","","3.408","","90","","90","","120","","296.501","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ni6 Nb6 P9","","- Nb6 Ni6 P9 -","- Nb6 Ni6 P9 -","- Nb6 Ni6 P9 -","1","0.0833333","","Guerin, R.; Potel, M.; Sergent, M.","Compose a structure derivee de Cr12 P7. Le nouveau phosphure ternaire Ni6 Nb6 P9, structure et proprietes","Journal of the Less-Common Metals","1981","78","","177","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","154992","2020-10-21","18:00:00",""
"1530108","9.397","","9.397","","6.878","","90","","90","","120","","525.982","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ca5 (P O4)3 F.94 Cl.1","","- Ca5 Cl0.1 F0.94 O12 P3 -","- Ca5 Cl0.1 F0.95 O12 P3 -","- Ca10 Cl0.2 F1.9 O24 P6 -","2","0.166667","","Hughes, J.M.; Cameron, M.; Crowley, K.D.","Structural variations in natural F, OH, and Cl apatites","American Mineralogist","1989","74","","870","876","","","","","","","","","","","","","","","","","","","","","","has coordinates","155085","2020-10-21","18:00:00",""
"1530410","9.422","","9.422","","13.79","","90","","90","","120","","1060.18","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na3 Y Si2 O7","","- Na3 O7 Si2 Y -","- Na3 O7 Si2 Y -","- Na18 O42 Si12 Y6 -","6","0.5","","Merinov, B.V.; Belov, N.V.; Maksimov, B.A.","The crystal structure of Na3 Y Si2 O7","Doklady Akademii Nauk SSSR","1981","260","","1128","1130","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530415","7.417","","7.417","","4.272","","90","","90","","120","","203.525","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Pr1.29 Cl3","","- Cl3 Pr1.29 -","- Cl3 Pr1.29 -","- Cl6 Pr2.58 -","2","0.166667","","Meyer, G.; Schleid, T.; Kraemer, K.","The Nature of Pr Cl2.3 Revisited","Journal of the Less-Common Metals","1989","149","","67","71","","","","","","","","","","","","","","","","","","","","","","has coordinates","155515","2020-10-21","18:00:00",""
"1530466","7.374","","7.374","","13.826","","90","","90","","120","","651.079","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","Pr K (Fe (C N)6) (H2 O)4","","- C6 H8 Fe K N6 O4 Pr -","- C6 Fe K N6 O4 Pr -","- C12 Fe2 K2 N12 O8 Pr2 -","2","0.166667","","Mullica, D.F.; Sappenfield, E.L.; Perkins, H.O.","A structural investigation of praseodymium potassium hexacyanoferrate(II) tetrahydrate, Pr K Fe (C N)6 4(H2 O)","Journal of Solid State Chemistry","1988","73","","65","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530714","9.3744","","9.3744","","5.4477","","90","","90","","120","","414.601","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","La2 Th Ta O6 Cl3","","- Cl3 La2 O6 Ta Th -","- Cl3 La2.001 O6 Ta Th0.999 -","- Cl6 La4.002 O12 Ta2 Th1.998 -","2","0.166667","","Schaffrath, U.; Gruehn, R.","Zur Darstellung und Struktur neuer Verbindungen Ln3 M O5 X Cl3 (Ln = La, Ce, Pr, Nd, Th; M = Ta, Nb; X = O, OH, F)","Journal of the Less-Common Metals","1988","137","","61","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530715","9.317","","9.317","","5.356","","90","","90","","120","","402.646","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ce3 Ta O6 Cl3","","- Ce3 Cl3 O6 Ta -","- Ce3 Cl3 O6 Ta -","- Ce6 Cl6 O12 Ta2 -","2","0.166667","","Schaffrath, U.; Gruehn, R.","Zur Darstellung und Struktur neuer Verbindungen Ln3 M O5 X Cl3 (Ln = La, Ce, Pr, Nd, Th; M = Ta, Nb; X = O, OH, F)","Journal of the Less-Common Metals","1988","137","","61","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530719","7.626","","7.626","","4.388","","90","","90","","120","","220.999","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Na1.2 Nd2 Cl6","","- Cl6 Na1.2 Nd2 -","- Cl6 Na1.2 Nd2 -","- Cl6 Na1.2 Nd2 -","1","0.0833333","","Schleid, T.; Meyer, G.","The action of sodium on Nd Cl3 and Pr Cl3: Mixed valence Na Nd2 Cl6 and metallic Na Pr2 Cl6","Inorganica Chimica Acta","1987","140","","113","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","155917","2020-10-21","18:00:00",""
"1530720","7.565","","7.565","","4.292","","90","","90","","120","","212.72","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Na Pr2 Cl6","","- Cl6 Na Pr2 -","- Cl6 Na0.99 Pr2 -","- Cl6 Na0.99 Pr2 -","1","0.0833333","","Schleid, T.; Meyer, G.","The action of sodium on Nd Cl3 and Pr Cl3: Mixed valence Na Nd2 Cl6 and metallic Na Pr2 Cl6","Inorganica Chimica Acta","1987","140","","113","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530761","9.562","","9.562","","7.075","","90","","90","","120","","560.215","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Cd Nd4 (Si O4)3 O","","- Cd Nd4 O13 Si3 -","- Cd Nd4 O13 Si3 -","- Cd2 Nd8 O26 Si6 -","2","0.166667","","Sidorov, P.M.; Fwedokov, N.F.; Belokoneva, E.L.; Simonov, H.A.; Belov, N.V.; Tunik, T.A.","Synthesis and crystal structure of Cd Nd4 (Si O4)3 O","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1977","18","","397","399","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530791","9.45","","9.45","","6.87","","90","","90","","120","","531.314","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Gd4.67 (Si O4)3 O","","- Gd4.67 O13 Si3 -","- Gd4.6666 O13 Si3 -","- Gd9.3332 O26 Si6 -","2","0.166667","","Smolin, Yu.I.; Shepelev, Yu.F.","The crystal structure of (Gd2 O3)7 (Si O2)9","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1969","5","","1823","1825","","","","","","","","","","","","","","","","","","","","","","has coordinates","156004","2020-10-21","18:00:00",""
"1530834","7.0989","","7.0989","","16.623","","90","","90","","120","","725.475","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","K3 Mo2 Cl9","","- Cl9 K3 Mo2 -","- Cl9 K3 Mo2 -","- Cl18 K6 Mo4 -","2","0.166667","","Stranger, R.; Grey, I.E.; Madsen, I.C.; Smith, P.W.","Structure systematics in A3 Mo X9, X=Cl, Br, I, from Rietveld refinement of X-ray powder data","Journal of Solid State Chemistry","1987","69","","162","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","156049","2020-10-21","18:00:00",""
"1530835","7.4808","","7.4808","","17.56779","","90","","90","","120","","851.42","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","K3 Mo2 Br9","","- Br9 K3 Mo2 -","- Br9 K3 Mo2 -","- Br18 K6 Mo4 -","2","0.166667","","Stranger, R.; Madsen, I.C.; Grey, I.E.; Smith, P.W.","Structure systematics in A3 Mo X9, X=Cl, Br, I, from Rietveld refinement of X-ray powder data","Journal of Solid State Chemistry","1987","69","","162","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","156050","2020-10-21","18:00:00",""
"1531395","9.428","","9.428","","3.728","","90","","90","","120","","286.976","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ca2 Co12 As7","","- As7 Ca2 Co12 -","- As7 Ca2 Co12 -","- As7 Ca2 Co12 -","1","0.0833333","","Hellmann, A.; Mewis, A.","Neue Erdalkalimetall-Phosphide und -Arsenide des Cobalts","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","1357","1364","","","","","","","","","","","","","","","","","","","","","","has coordinates","156860","2020-10-21","18:00:00",""
"1531405","9.4258","","9.4258","","3.6812","","90","","90","","120","","283.241","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Dy3 O F5 S","","- Dy3 F5 O S -","- Dy3 F5.001 O0.999 S -","- Dy6 F10.002 O1.998 S2 -","2","0.166667","","Grossholz, H.; Schleid, T.","Dy3 O F5 S : das erste Oxidfluoridsulfid eines Lanthanoids","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","1012","1016","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531531","16.4104","","16.4104","","3.809","","90","","90","","120","","888.341","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","U6 Ni15 P10","","- Ni15 P10 U6 -","- Ni15 P10 U6 -","- Ni30 P20 U12 -","2","0.166667","","Kaczorowski, D.; Potel, M.; Noel, H.","Crystal structure of a novel uranium nickel phosphide U6 Ni15 P10","Journal of Alloys Compd.","2002","347","","128","130","","","","","","","","","","","","","","","","","","","","","","has coordinates","157021","2020-10-21","18:00:00",""
"1531628","16.985","","16.985","","3.877","","90","","90","","120","","968.629","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Dy12 Ni30 As20.6","","- As20.6 Dy12 Ni30 -","- As20.6 Dy12 Ni30 -","- As20.6 Dy12 Ni30 -","1","0.0833333","","Jeitschko, W.; Terbuechte, L.J.; Rodewald, U.C.","The ternary lanthanoid nickel arsenides Tb12 Ni30 As21 and Dy12 Ni30 As21 with (La, Ce)12 Rh30 P21 type related structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","2673","2679","","","","","","","","","","","","","","","","","","","","","","has coordinates","157138","2020-10-21","18:00:00",""
"1531640","7.0823","","7.0823","","9.5621","","90","","90","","120","","415.368","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","(Ge O)3 (Sb O3)2","","- Ge3 O9 Sb2 -","- Ge3 O9 Sb2 -","- Ge6 O18 Sb4 -","2","0.166667","","Ke, Y.-X.; Li, J.M.; Zhang, Y.-G.; Lu, S.-M.; Lei, Z.-B.","Synthesis and structure of a 3-rings antimony germanate: Sb2 Ge3 O9","Solid State Sciences","2002","4","","803","806","","","","","","","","","","","","","","","","","","","","","","has coordinates","157161","2020-10-21","18:00:00",""
"1531821","22.744","","22.744","","3.888","","90","","90","","120","","1741.77","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sm Rh5 Ge3","","- Ge3 Rh5 Sm -","- Ge3 Rh5 Sm -","- Ge36 Rh60 Sm12 -","12","1","","Morozkin, A.V.; Welter, R.; Bogdanov, A.E.","New R Rh5 Ge3 compounds of the new Sm Rh5 Ge3 structure type and their magnetic properties (R = Sm, Gd, Tb)","Journal of Alloys Compd.","2002","340","","49","53","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532170","9.678","","9.678","","7.275","","90","","90","","120","","590.113","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Sr5 (P O4)3 F","","- F O12 P3 Sr5 -","- F O12 P3 Sr5 -","- F2 O24 P6 Sr10 -","2","0.166667","","Swafford, S.H.; Holt, E.M.","New synthetic approaches to monophosphate fluoride ceramics: synthesis and structural characterization of Na2 Mg (P O4) F and Sr5 (P O4)3 F","Solid State Sciences","2002","4","","807","812","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532275","9.4761","","9.4761","","6.9484","","90","","90","","120","","540.349","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Na1.5 Sm8.5) (Si O4)6 F O","","- F Na1.5 O25 Si6 Sm8.5 -","- F Na1.5 O25 Si6 Sm8.5 -","- F Na1.5 O25 Si6 Sm8.5 -","1","0.0833333","","Toumi, M.; Smiri-Dogguy, L.; Bulou, A.","Structure cristalline et spectres Raman polarises de Na1.5 Sm8.5 (Si O4)6 F O","Annales de Chimie (Paris)","2002","27","","17","26","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532375","10.04","","10.04","","4.1","","90","","90","","120","","357.917","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Eu2 Pd12 As7","","- As7 Eu2 Pd12 -","- As7 Eu2 Pd12 -","- As7 Eu2 Pd12 -","1","0.0833333","","Wurth, A.; Keimes, V.; Mewis, A.; Johrendt, D.","Neue ternaere Phosphide und Arsenide mit einem Metall:Nichtmetall-Verhaeltnis im Bereich von 2:1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","2183","2190","","","","","","","","","","","","","","","","","","","","","","has coordinates","158081","2020-10-21","18:00:00",""
"1532376","9.626","","9.626","","3.844","","90","","90","","120","","308.465","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sr2 Rh12 P7","","- P7 Rh12 Sr2 -","- P7 Rh12 Sr2 -","- P7 Rh12 Sr2 -","1","0.0833333","","Wurth, A.; Keimes, V.; Johrendt, D.; Mewis, A.","Neue ternaere Phosphide und Arsenide mit einem Metall:Nichtmetall-Verhaeltnis im Bereich von 2:1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","2183","2190","","","","","","","","","","","","","","","","","","","","","","has coordinates","158082","2020-10-21","18:00:00",""
"1532448","11.217","","11.217","","4.402","","90","","90","","120","","479.661","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ba2 Mg12 Ge7.33","","- Ba2 Ge7.33 Mg12 -","- Ba2 Ge7.292 Mg12 -","- Ba2 Ge7.292 Mg12 -","1","0.0833333","","Zuercher, F.; Nesper, R.","Cationic channels with partial anion occupation in the Zintl phases Ba2 Mg12 Ge7.33 and Ba6 Mg17.4 Li2.6 Ge12 O0.64","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","1581","1589","","","","","","","","","","","","","","","","","","","","","","has coordinates","158164","2020-10-21","18:00:00",""
"1532449","15.378","","15.378","","4.546","","90","","90","","120","","931.022","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ba6 Mg17.4 Li2.6 Ge12 O0.64","","- Ba6 Ge12 Li2.6 Mg17.4 O0.64 -","- Ba6 Ge12 Li2.6 Mg17.4 O0.64 -","- Ba6 Ge12 Li2.6 Mg17.4 O0.64 -","1","0.0833333","","Zuercher, F.; Nesper, R.","Cationic channels with partial anion occupation in the Zintl phases Ba2 Mg12 Ge7.33 and Ba6 Mg17.4 Li2.6 Ge12 O0.64","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","1581","1589","","","","","","","","","","","","","","","","","","","","","","has coordinates","158165","2020-10-21","18:00:00",""
"1532515","7.5585","","7.5585","","2.8855","","90","","90","","120","","142.765","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Si3 N4","","- N4 Si3 -","- N4 Si3 -","- N8 Si6 -","2","0.166667","","Kroll, P.; Milko, M.","Theoretical investigation of the solid state reaction of silicon nitride and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","1737","1750","","","","","","","","","","","","","","","","","","","","","","has coordinates","158443","2020-10-21","18:00:00",""
"1532788","8.1428","","8.1428","","7.6456","","90","","90","","120","","439.025","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sc2 (Se O3)3","","- O9 Sc2 Se3 -","- O9 Sc2 Se3 -","- O18 Sc4 Se6 -","2","0.166667","","Wontcheu, J.; Schleid, T.","Sc2 Se3 O9: Scandium(III) oxoselenate(IV) according to Sc2 (Se O3)3 with a hexagonal ""lone-pair"" channel structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","1463","1465","","","","","","","","","","","","","","","","","","","","","","has coordinates","158774","2020-10-21","18:00:00",""
"1532967","9.751","","9.751","","7.279","","90","","90","","120","","599.378","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Sr9.5 Na0.3 (P O4)6 (O H)1.31","","- H1.31 Na0.3 O25.31 P6 Sr9.5 -","- Na0.3 O25.31 P6 Sr9.498 -","- Na0.3 O25.31 P6 Sr9.498 -","1","0.0833333","","Naddari, T.; Hamdi, B.; Savariault, J.M.; Ben Salah, A.; El Feki, H.","Substitution mechanism of alkali metals for strontium in strontium hydroxyapatite","Materials Research Bulletin","2003","38","","221","230","","","","","","","","","","","","","","","","","","","","","","has coordinates","158986","2020-10-21","18:00:00",""
"1532969","9.755","","9.755","","7.284","","90","","90","","120","","600.282","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Sr9.81 K0.12 (P O4)6 (O H)1.74","","- H1.74 K0.12 O25.74 P6 Sr9.81 -","- K0.12 O25.74 P6 Sr9.808 -","- K0.12 O25.74 P6 Sr9.808 -","1","0.0833333","","Naddari, T.; Ben Salah, A.; Hamdi, B.; El Feki, H.; Savariault, J.M.","Substitution mechanism of alkali metals for strontium in strontium hydroxyapatite","Materials Research Bulletin","2003","38","","221","230","","","","","","","","","","","","","","","","","","","","","","has coordinates","158988","2020-10-21","18:00:00",""
"1532970","9.658","","9.658","","7.081","","90","","90","","120","","572.005","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Pb6 Ca2 Na2 (P O4)6","","- Ca2 Na2 O24 P6 Pb6 -","- Ca2 Na2.002 O24 P6 Pb5.998 -","- Ca2 Na2.002 O24 P6 Pb5.998 -","1","0.0833333","","Naddari, T.; Ben Salah, A.; El Feki, H.; Salles, P.; Savariault, J.M.","Structure and ionic conductivity of the lacunary apatite Pb6 Ca2 Na2 (P O4)6","Solid State Ionics","2003","158","","157","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","158990","2020-10-21","18:00:00",""
"1533064","9.374","","9.374","","6.8826","","90","","90","","120","","523.761","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ca5 (P O4)3 ((O H)0.2 F0.8)","","- Ca5 F0.4 O12.1 P3 -","- Ca5 F0.8 O12.2 P3 -","- Ca10 F1.6 O24.4 P6 -","2","0.166667","","Rodriguez-Lorenzo, L.M.; Gross, K.A.; Hart, J.N.","Structural and chemical analysis of well-crystallized hydroxyfluorapatites","J. Phys. Chem. B","2003","107","","8316","8320","","","","","","","","","","","","","","","","","","","","","","has coordinates","159148","2020-10-21","18:00:00",""
"1533142","9.782","","9.782","","7.083","","90","","90","","120","","586.953","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na Nd9 (Ge O4)6 O2","","- Ge6 Na Nd9 O26 -","- Ge6 Na Nd9 O26 -","- Ge6 Na Nd9 O26 -","1","0.0833333","","Emirdag-Eanes, M.; Pennington, W.T.; Kolis, J.W.","Synthesis, structural characterization and magnetic properties of Na RE9 (Ge O4)6 O2 (RE = Nd, Pr)","Journal of Alloys Compd.","2004","366","","76","80","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533143","9.802","","9.802","","7.116","","90","","90","","120","","592.101","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na Pr9 (Ge O4)6 O2","","- Ge6 Na O26 Pr9 -","- Ge6 Na O26 Pr9 -","- Ge6 Na O26 Pr9 -","1","0.0833333","","Emirdag-Eanes, M.; Pennington, W.T.; Kolis, J.W.","Synthesis, structural characterization and magnetic properties of Na RE9 (Ge O4)6 O2 (RE = Nd, Pr)","Journal of Alloys Compd.","2004","366","","76","80","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533493","9.341","","9.341","","5.835","","90","","90","","120","","440.918","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Nd (Cl O4)3","","- Cl3 Nd O12 -","- Cl3 Nd O12 -","- Cl6 Nd2 O24 -","2","0.166667","","Grupe, S.; Wickleder, M.S.","Der (U Cl3)-Typ mit komplexen Anionen und seine Additions - Substitutions - Variante: Synthese und Kristallstruktur von Nd (Cl O4)3 und Na0.75 Nd0.75 (Re O4)3","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","955","958","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533496","10","","10","","6.3608","","90","","90","","120","","550.861","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na0.564 (Nd0.709 Na0.291) (Re O4)3","","- Na0.855 Nd0.709 O12 Re3 -","- Na0.855 Nd0.7092 O12 Re3 -","- Na1.71 Nd1.4184 O24 Re6 -","2","0.166667","","Grupe, S.; Wickleder, M.S.","Der (U Cl3)-Typ mit komplexen Anionen und seine Additions - Substitutions - Variante: Synthese und Kristallstruktur von Nd (Cl O4)3 und Na0.75 Nd0.75 (Re O4)3","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","955","958","","","","","","","","","","","","","","","","","","","","","","has coordinates","159742","2020-10-21","18:00:00",""
"1533768","16.447","","16.447","","3.7891","","90","","90","","120","","887.647","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Y6 Ni14.92 P10.18","","- Ni14.92 P10.18 Y6 -","- Ni14.919 P10.18 Y6 -","- Ni29.838 P20.36 Y12 -","2","0.166667","","Stojko, S.; Oryshchyn, S.; Guerin, R.; Babizhet'sky, V.S.","Crystal structure of a new ternary phosphide Y6 Ni15-x P10+y (x = 0.08, y = 0.18)","Journal of Alloys Compd.","2004","367","","156","161","","","","","","","","","","","","","","","","","","","","","","has coordinates","160043","2020-10-21","18:00:00",""
"1533776","9.706","","9.706","","3.8394","","90","","90","","120","","313.238","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ce2 Rh12 Si7.11 -","- Ce2 Rh12 Si7.112 -","- Ce2 Rh12 Si7.112 -","1","0.0833333","","Tursina, A.I.; Gribanov, A.V.; Bodak, O.I.; Seropegin, Yu.D.","Crystal structures of the ternary cerium rhodium silicides Ce2 Rh12 Si7 and Ce6 Rh30 Si19","Journal of Alloys Compd.","2004","367","","142","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1533780","15.698","","15.698","","3.8571","","90","","90","","120","","823.152","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ce6 Rh30 Si19 -","- Ce6 Rh30 Si19 -","- Ce6 Rh30 Si19 -","1","0.0833333","","Tursina, A.I.; Gribanov, A.V.; Seropegin, Yu.D.; Bodak, O.I.","Crystal structures of the ternary cerium rhodium silicides Ce2 Rh12 Si7 and Ce6 Rh30 Si19","Journal of Alloys Compd.","2004","367","","142","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1533999","15.9268","","15.9268","","4.2553","","90","","90","","120","","934.798","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Pr5 Ni1.9 Si3","","- Ni1.9 Pr5 Si3 -","- Ni1.906 Pr5 Si3 -","- Ni7.624 Pr20 Si12 -","4","0.333333","","Pecharsky, A.O.; Mozharivsky, Yu.; Dennis, K.W.; Gschneidner, K.A.jr.; McCallum, R.W.; Pecharskii, V.K.; Miller, G.J.","Preparation, crystal structure, heat capacity, magnetism and the magnetocaloric effect of Pr5 Ni1.9 Si3 and Pr Ni","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2003","68","","134452-1","134452-8","","","","","","","","","","","","","","","","","","","","","","has coordinates","160303","2020-10-21","18:00:00",""
"1534031","9.9865","","9.9865","","7.3599","","90","","90","","120","","635.666","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pb5 (Si O4) (V O4)2","","- O12 Pb5 Si V2 -","- O12 Pb5 Si0.999 V2.001 -","- O24 Pb10 Si1.998 V4.002 -","2","0.166667","","Krivovichev, S.V.; Depmeier, W.; Armbruster, T.","One-dimensional lone electron pair micelles in the crystal structure of Pb5 (Si O4) (V O4)2","Materials Research Bulletin","2004","39","","1717","1722","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534471","9.638","","9.638","","7.081","","90","","90","","120","","569.638","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Ce0.40 Ca0.35 Sr0.25)2 (Ce0.86 Ca0.14)3 (Si O4)3 (O.5 F.38)","","- Ca1.12 Ce3.38 F0.38 O12.5 Si3 Sr0.5 -","- Ca1.12 Ce3.38 F0.38 O12.5 Si3 Sr0.5 -","- Ca2.24 Ce6.76 F0.76 O25 Si6 Sr -","2","0.166667","","Genkina, E.A.; Khomyakov, A.P.; Malinovskii, Yu.A.","Crystal structure of Sr-containing britholith","Kristallografiya","1991","36","","39","43","","","","","","","","","","","","","","","","","","","","","","has coordinates","161243","2020-10-21","18:00:00",""
"1534493","9.4236","","9.4236","","18.8955","","90","","90","","120","","1453.19","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- In2.9 Mo15 S19 -","- In2.9045 Mo15 S19 -","- In5.809 Mo30 S38 -","2","0.166667","","Salloum, D.; Gautier, R.; Gougeon, P.; Potel, M.","Syntheses and structural trends of the In(x) Mo15 S19 (0 <= x <= 3.7) compounds containing Mo6 and Mo9 clusters","Journal of Solid State Chemistry","2004","177","","1672","1680","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1534496","9.338","","9.338","","18.952","","90","","90","","120","","1431.18","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- In1.151 Mo15 S19 -","- In1.1506 Mo15 S19 -","- In2.3012 Mo30 S38 -","2","0.166667","","Salloum, D.; Gautier, R.; Gougeon, P.; Potel, M.","Syntheses and structural trends of the In(x) Mo15 S19 (0 <= x <= 3.7) compounds containing Mo6 and Mo9 clusters","Journal of Solid State Chemistry","2004","177","","1672","1680","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1534500","9.2947","","9.2947","","18.9884","","90","","90","","120","","1420.66","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- In0.708 Mo15 S19 -","- In0.708 Mo15 S19 -","- In1.416 Mo30 S38 -","2","0.166667","","Salloum, D.; Gautier, R.; Gougeon, P.; Potel, M.","Syntheses and structural trends of the In(x) Mo15 S19 (0<= x<= 3.7) compounds containing Mo6 and Mo9 clusters","Journal of Solid State Chemistry","2004","177","","1672","1680","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1534504","9.2551","","9.2551","","19.0135","","90","","90","","120","","1410.44","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- In0.482 Mo15 S19 -","- In0.4821 Mo15 S19 -","- In0.9642 Mo30 S38 -","2","0.166667","","Salloum, D.; Gautier, R.; Gougeon, P.; Potel, M.","Syntheses and structural trends of the In(x) Mo15 S19 (0 <= x <= 3.7) compounds containing Mo6 and Mo9 clusters","Journal of Solid State Chemistry","2004","177","","1672","1680","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1534507","9.1999","","9.1999","","19.0596","","90","","90","","120","","1397.05","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- In0.102 Mo15 S19 -","- In0.102 Mo15 S19 -","- In0.204 Mo30 S38 -","2","0.166667","","Salloum, D.; Gautier, R.; Gougeon, P.; Potel, M.","Syntheses and structural trends of the In(x) Mo15 S19 (0 <= x <= 3.7) compounds containing Mo6 and Mo9 clusters","Journal of Solid State Chemistry","2004","177","","1672","1680","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1534511","9.1838","","9.1838","","19.0483","","90","","90","","120","","1391.33","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Mo15 S19 -","- Mo15 S19 -","- Mo30 S38 -","2","0.166667","","Salloum, D.; Gautier, R.; Gougeon, P.; Potel, M.","Syntheses and structural trends of the In(x) Mo15 S19 (0 <= x <= 3.7) compounds containing Mo6 and Mo9 clusters","Journal of Solid State Chemistry","2004","177","","1672","1680","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1534638","9.717","","9.717","","6.1696","","90","","90","","120","","504.489","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","La (H Se O4)3","","- H3 La O12 Se3 -","- H3 La O12 Se3 -","- H6 La2 O24 Se6 -","2","0.166667","","Goehausen, I.; Wickleder, M.S.","Hydrogenselenate der Selten-Erd-Elemente: Synthese und Kristallstruktur von La (H Se O4)3 und Gd (H Se O4) (Se O4)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","1115","1117","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534694","9.845","","9.845","","7.359","","90","","90","","120","","617.705","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ca2 Ba3 (P O4)3 F","","- Ba3 Ca2 F O12 P3 -","- Ba3 Ca2 F O12 P3 -","- Ba6 Ca4 F2 O24 P6 -","2","0.166667","","Grechkin, S.V.; Viting, B.N.; Lazoryak, B.I.; Arkhangel'skii, I.V.","Interaction of substituted fluoroapatites with phosphoric acid","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1991","27","","1298","1301","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534811","18.209","","18.209","","6.3898","","90","","90","","120","","1834.81","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ni20 ((O H)12 (H2 O)6) (H P O4)8 (P O4)4 (H2 O)12.35","","- H56.7 Ni20 O78.35 P12 -","- Ni20 O78.348 P12 -","- Ni20 O78.348 P12 -","1","0.0833333","","Guillou, N.; Gao, Q.-M.; Chang, J.-S.; Forster, P.M.; Noques, M.; Ferey, G.; Cheetham, A.K.; Park, S.-E.","Nickel(II) phosphate VSB-5: a magnetic nanoporous hydrogenation catalyst with 24-ring tunnels","Angew. Chem. Int. ed.","2001","40","","2831","2834","","","","","","","","","","","","","","","","","","","","","","has coordinates","161823","2020-10-21","18:00:00",""
"1534949","9.638","","9.638","","21.35","","90","","90","","120","","1717.52","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","La3 Nd11 (Si O4)9 O3","","- La3 Nd11 O39 Si9 -","- La3 Nd11 O39 Si9 -","- La6 Nd22 O78 Si18 -","2","0.166667","","Malinovskii, Yu.A.; Genkina, E.A.; Dimitrova, O.V.","TR-ordering in crystal structure of La3 Nd11 (Si O4)9 O3","Kristallografiya","1990","35","","328","331","","","","","","","","","","","","","","","","","","","","","","has coordinates","162032","2020-10-21","18:00:00",""
"1535038","13.99","","13.99","","7.444","","90","","90","","120","","1261.75","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(La (H2 O)9) ((C F3) S O3)3","","- C3 H18 F9 La O18 S3 -","- C3 H18 F9 La O18 S3 -","- C6 H36 F18 La2 O36 S6 -","2","0.166667","","Harrowfield, J.M.B.; Patrick, J.M.; Kepert, D.L.; White, A.H.","Structure and stereochemistry in 'f-block' complexes of high coordination number. VIII The (M(unidentate)9) system. Crystal structures of (M (O H2)9) (C F3 S O3)3, M= La, Gd, Lu, Y","Australian Journal of Chemistry","1983","36","","483","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535041","13.7","","13.7","","7.512","","90","","90","","120","","1221.03","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Gd (H2 O)9) ((C F3) S O3)3","","- C3 H18 F9 Gd O18 S3 -","- C3 H18 F9 Gd O18 S3 -","- C6 H36 F18 Gd2 O36 S6 -","2","0.166667","","Harrowfield, J.M.B.; Kepert, D.L.; Patrick, J.M.; White, A.H.","Structure and stereochemistry in 'f-block' complexes of high coordination number. VIII The (M(unidentate)9) system. Crystal structures of (M (O H2)9) (C F3 S O3)3, M= La, Gd, Lu, Y","Australian Journal of Chemistry","1983","36","","483","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535042","13.259","","13.259","","7.751","","90","","90","","120","","1180.08","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Lu (H2 O)9) (C F3 S O3)3","","- C3 H18 F9 Lu O18 S3 -","- C3 H18 F9 Lu O18 S3 -","- C6 H36 F18 Lu2 O36 S6 -","2","0.166667","","Harrowfield, J.M.B.; Kepert, D.L.; Patrick, J.M.; White, A.H.","Structure and Stereochemistry in 'f-Block' Complexes of High Coordination Number. VIII The (M(unidentate)9) System. Crystal Structures of (M (O H2)9) (C F3 S O3)3, M= La, Gd, Lu, Y","Australian Journal of Chemistry","1983","36","","483","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535043","13.52","","13.52","","7.653","","90","","90","","120","","1211.48","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Y (H2 O)9) (C F3 S O3)3","","- C3 H18 F9 O18 S3 Y -","- C3 H18 F9 O18 S3 Y -","- C6 H36 F18 O36 S6 Y2 -","2","0.166667","","Harrowfield, J.M.B.; Kepert, D.L.; Patrick, J.M.; White, A.H.","Structure and Stereochemistry in 'f-Block' Complexes of High Coordination Number. VIII The (M(unidentate)9) System. Crystal Structures of (M (O H2)9) (C F3 S O3)3, M= La, Gd, Lu, Y","Australian Journal of Chemistry","1983","36","","483","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535063","9.6986","","9.6986","","6.6957","","90","","90","","120","","545.437","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Gd4.667 S (Si3 O12)","","- Gd4.667 O12 S Si3 -","- Gd4.686 O12 S Si3 -","- Gd9.372 O24 S2 Si6 -","2","0.166667","","Hartenbach, I.; Schleid, T.","Gd(4.667) S (Si O4)3: Ein Gadoliniumsulfid-ortho-silicat im Bromapatit-Typ","Zeitschrift fuer Anorganische und Allgemeine Chemie","2004","630","","1727","1727","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535144","9.385","","9.385","","6.893","","90","","90","","120","","525.784","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","Ca6 Eu2 Na2 (P O4)6 F2","","- Ca6 Eu2 F2 Na2 O24 P6 -","- Ca5.998 Eu2.002 F2 Na2 O24 P6 -","- Ca5.998 Eu2.002 F2 Na2 O24 P6 -","1","0.0833333","","Mayer, I.; Cohen, S.","The Crystal Structure of Ca6 Eu2 Na2 (P O4)6 F2","Journal of Solid State Chemistry","1983","48","","17","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","162349","2020-10-21","18:00:00",""
"1535258","8.4499","","8.4499","","14.976","","90","","90","","120","","926.04","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Rb0.93 ((C2) (Pr5 Cl8.98)) Cl","","- C2 Cl9.98 Pr5 Rb0.93 -","- C2 Cl9.98 Pr5 Rb0.93 -","- C4 Cl19.96 Pr10 Rb1.86 -","2","0.166667","","Meyer, G.; Uhrlandt, S.","Der erste trigonal-bipyramidale Cluster mit interstitieller C2-Hantel in (Rb (Pr5 (C2)) Cl10)","Angewandte Chemie (German Edition)","1993","105","","1379","1381","","","","","","","","","","","","","","","","","","","","","","has coordinates","162539","2020-10-21","18:00:00",""
"1535405","9.882","","9.882","","3.59","","90","","90","","120","","303.609","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tl.76 Ti6 Se8","","- Se8 Ti6 Tl0.76 -","- Se8 Ti6 Tl0.76 -","- Se8 Ti6 Tl0.76 -","1","0.0833333","","Boller, H.; Klepp, K.O.","Tlx Ti6 Se8 and Tlx Nb6 Se8, two phases with filled up Nb3 Te4 type of structure showing pronounced disorder","Materials Research Bulletin","1983","18","","437","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","162754","2020-10-21","18:00:00",""
"1535406","10.033","","10.033","","3.475","","90","","90","","120","","302.933","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tl0.7 Nb6 Se8","","- Nb6 Se8 Tl0.7 -","- Nb6 Se8 Tl0.7 -","- Nb6 Se8 Tl0.7 -","1","0.0833333","","Boller, H.; Klepp, K.O.","Tlx Ti6 Se8 and Tlx Nb6 Se8, two phases with filled up Nb3Te4-type of structure showing pronounced disorder","Materials Research Bulletin","1983","18","","437","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","162758","2020-10-21","18:00:00",""
"1535865","8.398","","8.398","","14.88","","90","","90","","120","","908.836","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Rb.9 (Nd5 (C2)) Cl9.98","","- C2 Cl9.98 Nd5 Rb0.9 -","- C2 Cl9.98 Nd5 Rb0.9 -","- C4 Cl19.96 Nd10 Rb1.8 -","2","0.166667","","Uhrlandt, S.; Meyer, G.","Trigonal-bipyramidale Cluster mit interstitiellen C2-Hanteln in den Chloriden K (M5 (C2)) Cl10 (M= La, Ce, Pr) und Rb (M5 (C2)) Cl10 (M= Pr, Nd)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1994","620","","1872","1878","","","","","","","","","","","","","","","","","","","","","","has coordinates","163355","2020-10-21","18:00:00",""
"1535869","8.426","","8.426","","14.894","","90","","90","","120","","915.767","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","K (Pr5 (C2)) Cl10","","- C2 Cl10 K Pr5 -","- C2 Cl10.026 K0.98 Pr5 -","- C4 Cl20.052 K1.96 Pr10 -","2","0.166667","","Uhrlandt, S.; Meyer, G.","Trigonal-bipyramidale Cluster mit interstitiellen C2-Hanteln in den Chloriden K (M5 (C2)) Cl10 (M= La, Ce, Pr) und Rb (M5 (C2)) Cl10 (M= Pr, Nd)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1994","620","","1872","1878","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535914","10.099","","10.099","","7.4","","90","","90","","120","","653.611","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pb5 (Ge O4) (V O4)2","","- Ge O12 Pb5 V2 -","- Ge0.999 O12 Pb5 V2.001 -","- Ge1.998 O24 Pb10 V4.002 -","2","0.166667","","Ivanov, S.A.","Full profile refinement of Pb5(GeO4)(VO4)2 crystal structure","Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii)","1990","31","","80","84","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536033","20.448","","20.448","","3.877","","90","","90","","120","","1403.87","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sm20 Ni41.6 P30","","- Ni41.6 P30 Sm20 -","- Ni41.7 P30 Sm20 -","- Ni41.7 P30 Sm20 -","1","0.0833333","","Chikhrii, S.I.; Orishchin, S.V.; Babizhet'sky, V.S.; Aksel'rud, L.G.; Kuz'ma, Yu.B.","Sm20Ni41.6P30 and Tb15Ni28P21 new members of homologic series of hexagonal double-grid structures","Kristallografiya","1993","38","","262","265","","","","","","","","","","","","","","","","","","","","","","has coordinates","163599","2020-10-21","18:00:00",""
"1536036","24.17","","24.17","","3.825","","90","","90","","120","","1935.15","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tb15 Ni28 P21","","- Ni28 P21 Tb15 -","- Ni28 P21 Tb15 -","- Ni56 P42 Tb30 -","2","0.166667","","Chikhrii, S.I.; Orishchin, S.V.; Babizhet'sky, V.S.; Kuz'ma, Yu.B.; Aksel'rud, L.G.","Sm20Ni41.6P30 and Tb15Ni28P21 new members of homologic series of hexagonal double-grid structures","Kristallografiya","1993","38","","262","265","","","","","","","","","","","","","","","","","","","","","","has coordinates","163604","2020-10-21","18:00:00",""
"1536162","11.57","","11.57","","4.23","","90","","90","","120","","490.386","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Th7 Se12","","- Se12 Th7 -","- Se12 Th7 -","- Se12 Th7 -","1","0.0833333","","d'Eye, R.W.M.","The crystal structures of Th Se2 and Th7 Se12","Journal of the Chemical Society","1953","1953","","1670","1671","","","","","","","","","","","","","","","","","","","","","","has coordinates","163770","2020-10-21","18:00:00",""
"1536220","5.437","","5.437","","4.493","","90","","90","","120","","115.023","","","","","","","","","","","","","1","P 63/m","-P 6c","176","","","","- Pu -","- Pu -","- Pu8 -","8","0.666667","","Dabos-Seignon, S.; Dancausse, J.P.; Heathman, S.; Gering, E.; Benedict, U.","Pressure induced phase transition in alpha-Pu","Journal of Alloys Compd.","1993","190","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1536320","5.9855","","5.9855","","3.5469","","90","","90","","120","","110.048","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Na1.23 Ca0.12 Y1.28 Er0.24 F6","","- Ca0.12 Er0.24 F6 Na1.23 Y1.28 -","- Ca0.12 Er0.24 F6 Na1.228 Y1.28 -","- Ca0.12 Er0.24 F6 Na1.228 Y1.28 -","1","0.0833333","","Kabalov, Yu.K.; Grigor'ev, A.P.; Sokolova, E.V.","Determination of crystal structure of a new mineral Na1.23 Ca0.12 Y1.28 TR0.24 F6 using Rietveld technique","Doklady Akademii Nauk SSSR","1993","330","","713","715","","","","","","","","","","","","","","","","","","","","","","has coordinates","163988","2020-10-21","18:00:00",""
"1536431","10.2073","","10.2073","","7.7401","","90","","90","","120","","698.392","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ba5 Cu0.3 (P O4)3 (O H)0.12 O0.74","","- Ba5 Cu0.3 H0.12 O12.86 P3 -","- Ba5 Cu0.304 O12.86 P3 -","- Ba10 Cu0.608 O25.72 P6 -","2","0.166667","","Karpov, A.S.; Nuss, J.; Jansen, M.; Kazin, P.E.; Tret'yakov, Yu.D.","Synthesis, crystal structure and properties of calcium and barium hydroxyapatites containing copper ions in hexagonal channels","Solid State Sciences","2003","5","","1277","1283","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536436","9.7815","","9.7815","","7.3018","","90","","90","","120","","605.022","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Sr5 (P O4)3 (Cu O2)0.333","","- Cu0.333 O12.666 P3 Sr5 -","- Cu0.314 O12.7 P3 Sr5 -","- Cu0.628 O25.4 P6 Sr10 -","2","0.166667","","Kazin, P.E.; Karpov, A.S.; Nuss, J.; Jansen, M.; Tret'yakov, Yu.D.","Crystal structure and properties of strontium phosphate apatite with oxocuprate ions in hexagonal channels","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","344","352","","","","","","","","","","","","","","","","","","","","","","has coordinates","164144","2020-10-21","18:00:00",""
"1536447","8.836","","8.836","","17.84","","90","","90","","120","","1206.25","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na (W6 N Cl18)","","- Cl18 N Na W6 -","- Cl18 N Na W6 -","- Cl36 N2 Na2 W12 -","2","0.166667","","Welch, E.J.; Yu, C.L.; Crawford, N.R.M.; Long, J.R.","Synthesis and characterization of the nitrogen-centered trigonal prismatic clusters [W6 N Cl18](n-) (n = 1-3)","Angew. Chem. Int. ed.","2005","44","","2549","2553","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536538","7.8887","","7.8887","","4.1141","","90","","90","","120","","221.726","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","K0.9 Eu2 Cl6","","- Cl6 Eu2 K0.9 -","- Cl6 Eu2 K0.9 -","- Cl6 Eu2 K0.9 -","1","0.0833333","","Wickleder, C.","K Eu2 Cl6 und K1.6 Eu1.4 Cl5: zwei neue gemischtvalente Europiumchloride","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","1815","1820","","","","","","","","","","","","","","","","","","","","","","has coordinates","164281","2020-10-21","18:00:00",""
"1536543","9.5479","","9.5479","","7.0416","","90","","90","","120","","555.927","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Eu5 F (Si O4)3","","- Eu5 F O12 Si3 -","- Eu5 F O12 Si3 -","- Eu10 F2 O24 Si6 -","2","0.166667","","Wickleder, C.; Hartenbach, I.; Schleid, T.; Lauxmann, P.","Eu4 F (Si O4)3 und Yb5 S (Si O4)3: gemischtvalente Lanthanoid - Silicate mit Apatit-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","1602","1606","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536546","9.7236","","9.7236","","6.4849","","90","","90","","120","","530.992","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Yb5 S (Si O4)3","","- O12 S Si3 Yb5 -","- O12 S Si3 Yb5 -","- O24 S2 Si6 Yb10 -","2","0.166667","","Wickleder, C.; Hartenbach, I.; Lauxmann, P.; Schleid, T.","Eu4 F (Si O4)3 und Yb5 S (Si O4)3: gemischtvalente Lanthanoid - Silicate mit Apatit-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","1602","1606","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536578","9.999","","9.999","","6.07","","90","","90","","120","","525.572","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Yb (Re O4)3","","- O12 Re3 Yb -","- O12 Re3 Yb -","- O24 Re6 Yb2 -","2","0.166667","","Khrustalev, V.N.; Pisarevskii, A.P.; Varfolomeev, M.B.; Shamrai, N.B.; Struchkov, Yu.T.","Crystal structure of high temperature modification of ytterbium perrhenate Yb (Re O4)3","Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))","1993","19","","871","872","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536680","11.304","","11.304","","4.946","","90","","90","","120","","547.33","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tb3.019 Ru1.862 C4.73","","- C4.73 Ru1.862 Tb3.019 -","- C4.73 Ru1.862 Tb3.0195 -","- C18.92 Ru7.448 Tb12.078 -","4","0.333333","","Pohlkamp, M.W.; Hoffmann, R.D.; Kotzyba, G.; Jeitschko, W.","Preparation, properties, and crystal structure of the rare earth ruthenium carbides R3 Ru2 C5 (R = Y, Gd - Er)","Journal of Solid State Chemistry","2001","160","","77","87","","","","","","","","","","","","","","","","","","","","","","has coordinates","164496","2020-10-21","18:00:00",""
"1536684","11.47","","11.47","","5.047","","90","","90","","120","","575.03","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Gd3 Ru1.843 C4.80","","- C4.8 Gd3 Ru1.843 -","- C4.7955 Gd3 Ru1.8431 -","- C19.182 Gd12 Ru7.3724 -","4","0.333333","","Pohlkamp, M.W.; Hoffmann, R.D.; Kotzyba, G.; Jeitschko, W.","Preparation, properties, and crystal structure of the rare earth ruthenium carbides R3 Ru2 C5 (R = Y, Gd - Er)","Journal of Solid State Chemistry","2001","160","","77","87","","","","","","","","","","","","","","","","","","","","","","has coordinates","164500","2020-10-21","18:00:00",""
"1536688","11.45","","11.45","","5.02","","90","","90","","120","","569.961","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Gd3 Ru1.862 C4.97","","- C4.97 Gd3 Ru1.862 -","- C4.97 Gd3 Ru1.862 -","- C19.88 Gd12 Ru7.448 -","4","0.333333","","Pohlkamp, M.W.; Jeitschko, W.; Hoffmann, R.D.; Kotzyba, G.","Preparation, properties, and crystal structure of the rare earth ruthenium carbides R3 Ru2 C5 (R = Y, Gd - Er)","Journal of Solid State Chemistry","2001","160","","77","87","","","","","","","","","","","","","","","","","","","","","","has coordinates","164504","2020-10-21","18:00:00",""
"1536712","9.512","","9.512","","3.923","","90","","90","","120","","307.392","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ca2 Ir12 P7 -","- Ca2 Ir12 P7 -","- Ca2 Ir12 P7 -","1","0.0833333","","Wurth, A.; Loehken, A.; Mewis, A.","Synthese und Kristallstrukturen ternaerer Phosphide und Arsenide des Rhodiums und Iridiums","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","661","666","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1536721","15.532","","15.532","","3.784","","90","","90","","120","","790.563","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ca6 Rh30 P19","","- Ca6 P19 Rh30 -","- Ca6 P19 Rh30 -","- Ca6 P19 Rh30 -","1","0.0833333","","Wurth, A.; Loehken, A.; Mewis, A.","Synthese und Kristallstrukturen ternaerer Phosphide und Arsenide des Rhodiums und Iridiums","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","661","666","","","","","","","","","","","","","","","","","","","","","","has coordinates","164550","2020-10-21","18:00:00",""
"1536724","16.135","","16.135","","3.916","","90","","90","","120","","882.899","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sr6 Rh30 As19","","- As19 Rh30 Sr6 -","- As19 Rh30 Sr6 -","- As19 Rh30 Sr6 -","1","0.0833333","","Wurth, A.; Loehken, A.; Mewis, A.","Synthese und Kristallstrukturen ternaerer Phosphide und Arsenide des Rhodiums und Iridiums","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","661","666","","","","","","","","","","","","","","","","","","","","","","has coordinates","164554","2020-10-21","18:00:00",""
"1536727","15.566","","15.566","","3.821","","90","","90","","120","","801.792","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Eu6 Rh30 P19","","- Eu6 P19 Rh30 -","- Eu6 P19 Rh30 -","- Eu6 P19 Rh30 -","1","0.0833333","","Wurth, A.; Loehken, A.; Mewis, A.","Synthese und Kristallstrukturen ternaerer Phosphide und Arsenide des Rhodiums und Iridiums","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","661","666","","","","","","","","","","","","","","","","","","","","","","has coordinates","164558","2020-10-21","18:00:00",""
"1536730","16.124","","16.124","","3.903","","90","","90","","120","","878.769","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Eu6 Rh30 As19","","- As19 Eu6 Rh30 -","- As19 Eu6 Rh30 -","- As19 Eu6 Rh30 -","1","0.0833333","","Wurth, A.; Loehken, A.; Mewis, A.","Synthese und Kristallstrukturen ternaerer Phosphide und Arsenide des Rhodiums und Iridiums","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","661","666","","","","","","","","","","","","","","","","","","","","","","has coordinates","164562","2020-10-21","18:00:00",""
"1536733","15.508","","15.508","","3.77","","90","","90","","120","","785.206","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Yb6 Rh30 P19","","- P19 Rh30 Yb6 -","- P19 Rh30 Yb6 -","- P19 Rh30 Yb6 -","1","0.0833333","","Wurth, A.; Loehken, A.; Mewis, A.","Synthese und Kristallstrukturen ternaerer Phosphide und Arsenide des Rhodiums und Iridiums","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","661","666","","","","","","","","","","","","","","","","","","","","","","has coordinates","164566","2020-10-21","18:00:00",""
"1536740","9.648","","9.648","","12.157","","90","","90","","120","","980.013","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Na3 Rb (Mo O4)2 (H2 O)9","","- H18 Mo2 Na3 O17 Rb -","- H18 Mo2 Na3 O17 Rb -","- H36 Mo4 Na6 O34 Rb2 -","2","0.166667","","Klevtsova, R.F.; Glinskaya, L.A.; Ishchenko, V.N.; Klevtsov, P.V.; Perepelitsa, A.P.","Double molybdates and tungstates of the composition Na3 M(+) (E O4)2 * 9(H2 O) (M= K, Rb; E= Mo, W): synthesis, structure, dehydratation.","Kristallografiya","1990","35","","1094","1098","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536742","9.515","","9.515","","12.231","","90","","90","","120","","958.981","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Na3 K (W O4)2 (H2 O)9","","- H18 K Na3 O17 W2 -","- K Na3 O17 W2 -","- K2 Na6 O34 W4 -","2","0.166667","","Klevtsova, R.F.; Klevtsov, P.V.; Glinskaya, L.A.; Ishchenko, V.N.; Perepelitsa, A.P.","Double molybdates and tungstates of the composition Na3 M(+) (E O4)2 * 9(H2 O) (M= K, Rb; E= Mo, W): synthesis, structure, dehydratation.","Kristallografiya","1990","35","","1094","1098","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536863","7.38","","7.38","","4.238","","90","","90","","120","","199.896","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Pu Cl3","","- Cl3 Pu -","- Cl3 Pu -","- Cl6 Pu2 -","2","0.166667","","Zachariasen, W.H.","Crystal structure studies of chlorides, bromides, and iodides of plutonium and neptunium","Nat. Nucl. Energy Ser. Div. Iv. Sec. B","1949","14","","1473","1485","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536866","7.405","","7.405","","4.273","","90","","90","","120","","202.915","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Np Cl3","","- Cl3 Np -","- Cl3 Np -","- Cl6 Np2 -","2","0.166667","","Zachariasen, W.H.","Crystal structure studies of chlorides, bromides, and iodides of plutonium and neptunium","Nat. Nucl. Energy Ser. Div. Iv. Sec. B","1949","14","","1473","1485","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536873","7.917","","7.917","","4.382","","90","","90","","120","","237.862","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Np Br3","","- Br3 Np -","- Br3 Np -","- Br6 Np2 -","2","0.166667","","Zachariasen, W.H.","Crystal structure studies of chlorides, bromides, and iodides of plutonium and neptunium","Nat. Nucl. Energy Ser. Div. Iv. Sec. B","1949","14","","1473","1485","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536884","7.806","","7.806","","4.302","","90","","90","","120","","227.017","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Pu (Br0.8 Cl0.2)3","","- Br2.4 Cl0.6 Pu -","- Br2.4 Cl0.6 Pu -","- Br4.8 Cl1.2 Pu2 -","2","0.166667","","Zachariasen, W.H.","Crystal structure studies of chlorides, bromides, and iodides of plutonium and neptunium","Nat. Nucl. Energy Ser. Div. Iv. Sec. B","1949","14","","1473","1485","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536909","9.595","","9.595","","6.067","","90","","90","","120","","483.721","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Nd (H Se O4)3","","- H3 Nd O12 Se3 -","- Nd O12 Se3 -","- Nd2 O24 Se6 -","2","0.166667","","Zakharov, M.A.; Kemnitz, E.; Troyanov, S.I.","Synthesis and crystal structure of the rare earth selenates: Nd(HSeO4)3, Sm(HSeO4)3 and Nd2(SeO4)3*5H2O","Kristallografiya","2004","49","","835","840","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536913","9.522","","9.522","","6.011","","90","","90","","120","","471.991","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Sm (H Se O4)3","","- H3 O12 Se3 Sm -","- H3 O12 Se3 Sm -","- H6 O24 Se6 Sm2 -","2","0.166667","","Zakharov, M.A.; Troyanov, S.I.; Kemnitz, E.","Synthesis and crystal structure of the rare earth selenates: Nd(HSeO4)3, Sm(HSeO4)3 and Nd2(SeO4)3*5H2O","Kristallografiya","2004","49","","835","840","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536914","14.776","","14.776","","3.613","","90","","90","","120","","683.144","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sc6 Co30 Si19","","- Co30 Sc6 Si19 -","- Co30.006 Sc6 Si19 -","- Co30.006 Sc6 Si19 -","1","0.0833333","","Kotur, B.Ya.; Sikirica, M.","Crystal structure of silicide Sc6 Co30 Si19","Kristallografiya","1991","36","","1179","1182","","","","","","","","","","","","","","","","","","","","","","has coordinates","164808","2020-10-21","18:00:00",""
"1537016","12.204","","12.204","","16.886","","90","","90","","120","","2178.02","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Rb3 La Cl6 (H2 O)2","","- Cl6 H4 La O2 Rb3 -","- Cl6 La O2 Rb3 -","- Cl36 La6 O12 Rb18 -","6","0.5","","Reuter, G.; Frenzen, G.; Roffe, M.","Rb3 Ln Cl6 * 2 H2 O (Ln=La-Nd):Darstellung, Kristallstruktur und thermisches Verhalten","Zeitschrift fuer Anorganische und Allgemeine Chemie","1995","621","","630","634","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537127","10.5503","","10.5503","","4.2182","","90","","90","","120","","406.619","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ba.559 Ca0.025 Br.028 Cl.139 F","","- Ba0.559 Br0.028 Ca0.025 Cl0.139 F -","- Ba0.558733 Br0.028 Ca0.0246 Cl0.138667 F -","- Ba6.7048 Br0.336 Ca0.2952 Cl1.664 F12 -","12","1","","Fruehmann, B.; Kubel, F.; Hagemann, H.; Bill, H.","Synthesis and structure of the new fluoride bromide Ba6.668(2) Ca0.332(2) F12 Br2 and solid solutions with composition Ba(7-x) Ca(x) F12 (Cl(y) Br(1-y))2 with x = 0.5, 0 < y < 1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2004","630","","1484","1488","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537131","10.5381","","10.5381","","4.2121","","90","","90","","120","","405.092","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ba.558 Ca.025 Cl.1667 F","","- Ba0.558 Ca0.025 Cl0.1667 F -","- Ba0.558367 Ca0.0249667 Cl0.166667 F -","- Ba6.7004 Ca0.2996 Cl2 F12 -","12","1","","Fruehmann, B.; Kubel, F.; Hagemann, H.; Bill, H.","Synthesis and structure of the new fluoride bromide Ba6.668(2) Ca0.332(2) F12 Br2 and solid solutions with composition Ba(7-x) Ca(x) F12 (Cl(y) Br(1-y))2 with x = 0.5, 0 < y < 1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2004","630","","1484","1488","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537134","10.5717","","10.5717","","4.2381","","90","","90","","120","","410.196","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ba.557 Ca.026 Br.076 Cl.091 F","","- Ba0.557 Br0.076 Ca0.026 Cl0.091 F -","- Ba0.557183 Br0.0758333 Ca0.02615 Cl0.0908333 F -","- Ba6.6862 Br0.91 Ca0.3138 Cl1.09 F12 -","12","1","","Fruehmann, B.; Kubel, F.; Hagemann, H.; Bill, H.","Synthesis and structure of the new fluoride bromide Ba6.668(2) Ca0.332(2) F12 Br2 and solid solutions with composition Ba(7-x) Ca(x) F12 (Cl(y) Br(1-y))2 with x = 0.5, 0 < y < 1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2004","630","","1484","1488","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537137","10.6129","","10.6129","","4.2817","","90","","90","","120","","417.652","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ba.555 Ca0.029 Br.1667 F","","- Ba0.555 Br0.1667 Ca0.029 F -","- Ba0.55475 Br0.166667 Ca0.0285833 F -","- Ba6.657 Br2 Ca0.343 F12 -","12","1","","Fruehmann, B.; Kubel, F.; Hagemann, H.; Bill, H.","Synthesis and structure of the new fluoride bromide Ba6.668(2) Ca0.332(2) F12 Br2 and solid solutions with composition Ba(7-x) Ca(x) F12 (Cl(y) Br(1-y))2 with x = 0.5, 0 < y < 1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2004","630","","1484","1488","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537140","10.5885","","10.5885","","4.2713","","90","","90","","120","","414.724","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ba0.5533 Ca0.03 Br0.1667 F","","- Ba0.5533 Br0.1667 Ca0.03 F -","- Ba0.553033 Br0.166667 Ca0.0303 F -","- Ba6.6364 Br2 Ca0.3636 F12 -","12","1","","Fruehmann, B.; Kubel, F.; Hagemann, H.; Bill, H.","Synthesis and Structure of the new Fluoride Bromide Ba6.668(2)Ca0.332(2)F12Br2 and Solid Solutions with Composition Ba7-xCaxF12(ClyBr1-y)2 with x = 0.5, 0 < y < 1","Zeitschrift fuer Anorganische und Allgemeine Chemie","2004","630","","1484","1488","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537262","10.568","","10.568","","3.726","","90","","90","","120","","360.379","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","N H3 (Mo O3)3","","- H3 Mo3 N O9 -","- Mo3 N O9 -","- Mo6 N2 O18 -","2","0.166667","","Garin, J.L.; Blanc, J.M.","Refinamiento de la estructura cristalina del N H3 (Mo O3)3","Contribuciones Cientificas y Technologicas. Universidad Technica del Estado. Santiago de Chile","1983","13","","43","55","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537405","6.893","","6.893","","10.172","","90","","90","","120","","418.556","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","K2 Zr (Si3 O9)","","- K2 O9 Si3 Zr -","- K2 O9 Si3 Zr -","- K4 O18 Si6 Zr2 -","2","0.166667","","Henshaw, D.E.","The structure of wadeite","Mineralogical Magazine and Journal of the Mineralogical Society (1876-1968)","1955","30","","585","595","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537852","25.771","","25.771","","5.371","","90","","90","","120","","3089.22","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","(Na5.03 K0.98 Cl1.62) (Ca2 Cl2) (Si6 Al6 O24)","","- Al6 Ca2 Cl3.62 K0.98 Na5.03 O24 Si6 -","- Al6 Ca2 Cl3.624 K0.975 Na5.025 O24 Si6 -","- Al24 Ca8 Cl14.496 K3.9 Na20.1 O96 Si24 -","4","0.333333","","Bonaccorsi, E.; Merlino, S.; Orlandi, P.; Pasero, M.; Vezzalini, G.","Quadridavyne, ((Na, K)6 Cl2) (Ca2 Cl2) (Si6 Al6 O24), a new feldspathoid mineral from Vesuvius area","European Journal of Mineralogy (1,1989-)","1994","6","","481","487","","","","","","","","","","","","","","","","","","","","","","has coordinates","166214","2020-10-21","18:00:00",""
"1537854","12.886","","12.886","","5.371","","90","","90","","120","","772.364","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","(Na4 K2 Cl2) (Ca2 Cl2) (Si6 Al6 O24)","","- Al6 Ca2 Cl4 K2 Na4 O24 Si6 -","- Al6 Ca2 Cl4.002 K1.998 Na3.996 O24 Si6 -","- Al6 Ca2 Cl4.002 K1.998 Na3.996 O24 Si6 -","1","0.0833333","","Bonaccorsi, E.; Merlino, S.; Orlandi, P.; Pasero, M.; Vezzalini, G.","Quadridavyne, ((Na, K)6 Cl2) (Ca2 Cl2) (Si6 Al6 O24), a new feldspathoid mineral from Vesuvius area","European Journal of Mineralogy (1,1989-)","1994","6","","481","487","","","","","","","","","","","","","","","","","","","","","","has coordinates","166217","2020-10-21","18:00:00",""
"1538344","6.15","","6.15","","3.7","","90","","90","","120","","121.194","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Nd (F1.5 (O H)1.5)","","- F1.5 H1.5 Nd O1.5 -","- F1.5 Nd O1.5 -","- F3 Nd2 O3 -","2","0.166667","","Marbeuf, A.; Demazeau, G.; Turrell, S.; Hagenmuller, P.; Caro, P.; Derouet, J.","Les hydroxyfluorures de terres rares","Journal of Solid State Chemistry","1971","3","","637","641","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538354","9.41","","9.41","","7.64","","90","","90","","120","","585.873","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na2 Zn2 (Te O3)3","","- Na2 O9 Te3 Zn2 -","- Na2 O9 Te3 Zn2 -","- Na4 O18 Te6 Zn4 -","2","0.166667","","Matzat, E.","Die Kristallstruktur eines unbenannten zeolithaltigen Telluritminerals, (Zn, Fe)2 (Te O3)3) Nax H2-x (H2 O)y","Tschermaks Mineralogische und Petrographische Mitteilungen (-1978)","1967","12","","108","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","166853","2020-10-21","18:00:00",""
"1538444","9.348","","9.348","","3.5755","","90","","90","","120","","270.586","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Zr2 Mn12 P7","","- Mn12 P7 Zr2 -","- Mn12 P7 Zr2 -","- Mn12 P7 Zr2 -","1","0.0833333","","Orishchin, S.V.; Guerin, R.; Zhak, O.V.; Deputier, S.; le Senechal, C.","Crystal structures of Zr2 Mn12 P7 and (Mo, Mn)12 P7","Neorganicheskie Materialy","2004","40","","709","715","","","","","","","","","","","","","","","","","","","","","","has coordinates","166994","2020-10-21","18:00:00",""
"1538659","6.656","","6.656","","12.459","","90","","90","","120","","478.014","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Mn Nb4 S8 -","- Mn Nb4 S8 -","- Mn2 Nb8 S16 -","2","0.166667","","le Blanc-Soreau, A.; Gardette, M.F.; Rouxel, J.; Gorochov, O.","Proprietes electriques et magnetiques de Mn0,25 Nb S2 et Mn0,33 Nb S2","Materials Research Bulletin","1976","11","","1061","1061","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539212","7.8864","","7.8864","","4.395","","90","","90","","120","","236.727","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Pr Br3","","- Br3 Pr -","- Br3 Pr -","- Br6 Pr2 -","2","0.166667","","Schmid, B.; Haelg, B.; Furrer, A.; Urland, W.; Kremer, R.","Structure and crystal fields of Pr Br3 and Pr Cl3: A neutron study","Journal of Applied Physics","1987","61","","3426","3428","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539512","9.9981","","9.9981","","7.344","","90","","90","","120","","635.767","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pb5 (P O4)3 Cl","","- Cl O12 P3 Pb5 -","- Cl O12 P3 Pb5 -","- Cl2 O24 P6 Pb10 -","2","0.166667","","Akao, M.; Innami, Y.; Aoki, H.; Minamikata, S.; Yamada, T.","Flux growth and crystal structure of pyromorphite","Iyo Kizai Kenkyusho Hokoku, Tokyo Ika Shika Daigaku","1989","23","","25","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539768","9.444","","9.444","","6.829","","90","","90","","120","","527.472","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Mn Sm4 (Si O4)3 O","","- Mn O10 Si3 Sm4 -","- Mn O10 Si3 Sm4 -","- Mn2 O20 Si6 Sm8 -","2","0.166667","","Chi Lisheng; Huang, J.-S.; Zhang, H.-H.; Deng Shui-Quan","Synthesis and crystal structure of Mn Sm4 (Si O4)3 O","Jiegon Huaxue","1996","15","","113","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539774","16.679","","16.679","","3.891","","90","","90","","120","","937.415","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Nd3 Ni7 P5 -","- Nd3 Ni7.005 P5 -","- Nd12 Ni28.02 P20 -","4","0.333333","","Chikhrii, S.I.; Kuz'ma, Yu.B.; Orishchin, S.V.; Glovyak, T.","New ternary phosphides R3 Ni7 P5 (R= La, Pr, Nd, Sm, Gd, Tb)","Soviet Physics, Crystallography (= Kristallografiya)","1989","34","","681","684","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539785","10.058","","10.058","","7.416","","90","","90","","120","","649.716","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pb5 (Ge O4)2 (S O4)","","- Ge2 O12 Pb5 S -","- Ge2.0001 O12 Pb5 S0.9999 -","- Ge4.0002 O24 Pb10 S1.9998 -","2","0.166667","","Engel, G.; Deppisch, B.","Die Kristallstruktur von Pb5 (Ge O4)2 S O4 und Pb5 (Ge O4)2 Cr O4, zweier Bleiapatite mit unbesetzten Halogenlagen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1988","562","","131","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539788","10.105","","10.105","","7.428","","90","","90","","120","","656.864","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pb5 (Ge O4)2 (Cr O4)","","- Cr Ge2 O12 Pb5 -","- Cr0.9999 Ge2.0001 O12 Pb5 -","- Cr1.9998 Ge4.0002 O24 Pb10 -","2","0.166667","","Engel, G.; Deppisch, B.","Die Kristallstruktur von Pb5 (Ge O4)2 S O4 und Pb5 (Ge O4)2 Cr O4, zweier Bleiapatite mit unbesetzten Halogenlagen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1988","562","","131","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540158","10.097","","10.097","","7.396","","90","","90","","120","","652.999","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pb5 (Ge V2 O12)","","- Ge O12 Pb5 V2 -","- Ge0.9999 O12 Pb5 V2.0001 -","- Ge1.9998 O24 Pb10 V4.0002 -","2","0.166667","","Ivanov, S.A.; Zavodnik, V.E.","Crystal structire of Pb5 Ge V2 O12","Kristallografiya","1989","34","","824","828","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540288","6.034","","6.034","","18.079","","90","","90","","120","","570.054","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na (V.942 Nb.152) (Nb6 O12) O2","","- Na Nb6.152 O14 V0.942 -","- Na Nb6.152 O14 V0.942 -","- Na2 Nb12.304 O28 V1.884 -","2","0.166667","","Koehler, J.; Miller, G.; Simon, A.","Na(V3-xNbx)Nb6O14 - ein neues Oxoniobat mit (Nb6 O12) - und (M2O9)-Clustern","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","568","","8","21","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540318","7.9648","","7.9648","","4.5119","","90","","90","","120","","247.879","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","La Br3","","- Br3 La -","- Br3 La -","- Br6 La2 -","2","0.166667","","Kraemer, K.; Schleid, T.; Meyer, G.; Urland, W.; Schulze, M.","Three bromides of lanthanum: La Br2, La2 Br5, and La Br3","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","575","","61","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540323","7.5707","","7.5707","","4.3156","","90","","90","","120","","214.212","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Na.38 (Na.19 Ce.81) Cl3","","- Ce0.81 Cl3 Na0.57 -","- Ce0.808 Cl3 Na0.572 -","- Ce1.616 Cl6 Na1.144 -","2","0.166667","","Kraemer, K.; Meyer, G.","Addition und Substitution von Natrium in Cer(III)-chlorid: Na.38(Na.19 Ce.81)Cl3","Zeitschrift fuer Anorganische und Allgemeine Chemie","1990","589","","96","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","169581","2020-10-21","18:00:00",""
"1540860","7.6805","","7.6805","","2.975","","90","","90","","120","","151.984","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Si3 Al3 O3 N5","","- Al3 N5 O3 Si3 -","- Al3 N5.002 O2.998 Si3 -","- Al3 N5.002 O2.998 Si3 -","1","0.0833333","","van Dijen, F.K.; Helmholdt, R.B.; Metselaar, R.","Neutron diffraction study of beta' - sialon","Journal of Materials Science. Letters","1987","6","","1101","1102","","","","","","","","","","","","","","","","","","","","","","has coordinates","172022","2020-10-21","18:00:00",""
"1540908","7.5609","","7.5609","","4.3143","","90","","90","","120","","213.593","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Na U2 Cl6","","- Cl6 Na U2 -","- Cl6 Na U2 -","- Cl6 Na U2 -","1","0.0833333","","Schleid, T.; Meyer, G.","Na U2 Cl6, a reduced metallic chloride of uranium","Naturwissenschaften","1989","76","","118","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541029","9.385","","9.385","","13.716","","90","","90","","120","","1046.23","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Na3 Lu (Si2 O7)","","- Lu Na3 O7 Si2 -","- Lu Na3 O7 Si2 -","- Lu6 Na18 O42 Si12 -","6","0.5","","Tamazyan, R.A.; Malinovskii, Yu.A.; Simonov, V.I.; Sirota, M.I.","Crystal structure and twinning in sodium lutetium silicate Na3 Lu (Si2 O7)","Kristallografiya","1988","33","","1128","1133","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541057","12.664","","12.664","","3.789","","90","","90","","120","","526.256","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ni20 U6 P13","","- Ni20 P13 U6 -","- Ni19.88 P12.84 U6 -","- Ni19.88 P12.84 U6 -","1","0.0833333","","Troc, R.; Kaczorowski, D.; Noel, H.; Le Bihan, T.","Crystal structure of U6 Ni2 0 Pi13 and U6 Ni20 As13","Journal of Alloys Compd.","1992","184","","L27","L31","","","","","","","","","","","","","","","","","","","","","","has coordinates","172278","2020-10-21","18:00:00",""
"1541693","14.121","","14.121","","16.316","","90","","90","","120","","2817.57","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb4 (O H)4 )3 (C O3) (Cl O4)10 (H2 O)6","","- C H24 Cl10 O61 Pb12 -","- C Cl10 O60.9998 Pb12 -","- C2 Cl20 O122 Pb24 -","2","0.166667","","Hong, S.H.; Olin, A.","On the crystal structure of (Pb4 (O H)4 )3 (C O3) (Cl O4)10 (H2 O)6","Acta Chemica Scandinavica (1-27,1973-42,1988)","1973","27","","2309","2320","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541957","9.35","","9.35","","6.85","","90","","90","","120","","518.614","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","Ca4.33 Sr.51 La.16 (P O4)3 (O H).5 F.5","","- Ca4.33 F0.5 H0.5 La0.16 O12.5 P3 Sr0.51 -","- Ca4.3301 F0.5 La0.1599 O12.5 P3 Sr0.51 -","- Ca8.6602 F La0.3198 O25 P6 Sr1.02 -","2","0.166667","","Borisov, S.V.; Klevtsova, R.F.","Crystal Structure of Rare-Earth-Strontium-Apatite","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1963","4","","629","631","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541966","9.491","","9.491","","6.937","","90","","90","","120","","541.161","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ca1.31 Na4.32 ((O H).94 (S O4)3)","","- Ca1.31 H0.94 Na4.32 O12.94 S3 -","- Ca1.31 Na4.32 O12.94 S3 -","- Ca2.62 Na8.64 O25.88 S6 -","2","0.166667","","Deganello, S.","The crystal structure of cesanite at 336 and 339C","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","1984","1984","","522","528","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542288","7.872","0.0009","7.872","0.0009","7.3258","0.001","90","","90","","120","","393.15","0.08","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Fe2 O9 Se3 -","- Fe2 O9 Se3 -","- Fe4 O18 Se6 -","2","0.166667","","Kovrugin, Vadim M.; Gordon, Elijah E.; Kasapbasi, Esra E.; Whangbo, Myung-Hwan; Colmont, Marie; Siidra, Oleg I.; Colis, Silviu; Krivovichev, Sergey V.; Mentré, Olivier","Bonding Scheme, Hydride Character, and Magnetic Paths of (HPO3)2‒Versus (SeO3)2‒Building Units in Solids","The Journal of Physical Chemistry C","2016","120","3","1650","","10.1021/acs.jpcc.5b10889","","","0.71073","MoKα","","0.0157","0.0141","","","0.0308","0.0311","","","","","","1.098","","","","has coordinates","177424","2020-10-21","18:00:00",""
"1542289","8.0195","0.0002","8.0195","0.0002","7.37","0.0002","90","","90","","120","","410.481","0.018","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Fe2 H3 O9 P3 -","- Fe2 H3 O9 P3 -","- Fe4 H6 O18 P6 -","2","0.166667","","Kovrugin, Vadim M.; Gordon, Elijah E.; Kasapbasi, Esra E.; Whangbo, Myung-Hwan; Colmont, Marie; Siidra, Oleg I.; Colis, Silviu; Krivovichev, Sergey V.; Mentré, Olivier","Bonding Scheme, Hydride Character, and Magnetic Paths of (HPO3)2‒Versus (SeO3)2‒Building Units in Solids","The Journal of Physical Chemistry C","2016","120","3","1650","","10.1021/acs.jpcc.5b10889","","","0.71073","MoKα","","0.0154","0.0133","","","0.0413","0.0433","","","","","","1.249","","","","has coordinates","177424","2020-10-21","18:00:00",""
"1543615","13.2463","0.0016","13.2463","0.0016","29.783","0.004","90","","90","","120","","4525.7","1","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","[K(Kryptofix-2,2,2)]2[Pb2(mBDCA-5t)]","","- C84 H132 K2 N12 O18 Pb2 -","- C83.655 H132 K2 N12 O18 Pb2 -","- C167.31 H264 K4 N24 O36 Pb4 -","2","0.166667","","Stauber, Julia; Mueller, Peter; Dai, Yizhe; Wu, Gang; Nocera, Daniel G.; Cummins, Christopher","Multi-electron reactivity of a cofacial di-tin(II) cryptand: Partial reduction of sulfur and selenium and reversible generation of S3●−","Chem. Sci.","2016","","","","","10.1039/C6SC01754A","","","0.71073","MoKα","","0.0532","0.0267","","","0.0517","0.0612","","","","","","1.014","","","","has coordinates,has disorder","184267","2020-10-21","18:00:00",""
"1543616","13.1963","0.0019","13.1963","0.0019","29.806","0.005","90","","90","","120","","4495.1","1.2","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","[K(Kryptofix-2,2,2]2[Sn2(mBDCA-5t)]","","- C84 H132 K2 N12 O18 Sn2 -","- C84 H132 K2 N12 O18 Sn2 -","- C168 H264 K4 N24 O36 Sn4 -","2","0.166667","","Stauber, Julia; Mueller, Peter; Dai, Yizhe; Wu, Gang; Nocera, Daniel G.; Cummins, Christopher","Multi-electron reactivity of a cofacial di-tin(II) cryptand: Partial reduction of sulfur and selenium and reversible generation of S3●−","Chem. Sci.","2016","","","","","10.1039/C6SC01754A","","","0.71073","MoKα","","0.0481","0.0372","","","0.0931","0.1008","","","","","","1.047","","","","has coordinates,has disorder","184267","2020-10-21","18:00:00",""
"1545071","9.721","0.004","9.721","0.004","7.186","0.005","90","","90","","120","","588.1","0.5","","","","","","","","","","","","4","P 63/m","-P 6c","176","Na2Pb8(PO4)6","","","- Na2 O24 P6 Pb8 -","- Na1.998 O24 P6 Pb7.998 -","- Na1.998 O24 P6 Pb7.998 -","1","0.0833333","","Toumi, M.; Mhiri, T.","Crystal structure and spectroscopic studies of Na2Pb8(PO4)6","Journal of the Ceramic Society of Japan","2008","116","","904","908","","","","","","","","","","","","","","","","","","","","","","has coordinates","190695","2020-10-21","18:00:00",""
"1545255","10.4852","0.001","10.4852","0.001","23.308","0.003","90","","90","","120","","2219.2","0.4","240","0.14","240","0.14","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30 H30 B2 F8 Fe N24 -","- C30 H30 B2 F7.99 Fe N24 -","- C60 H60 B4 F15.98 Fe2 N48 -","2","0.166667","","Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez","Gas confinement in compartmentalized coordination polymers for highly selective sorption","Chem. Sci.","2017","8","4","3109","","10.1039/C6SC05122G","","x-ray","0.71073","MoKα","","0.2252","0.1085","","","0.2302","0.3038","","","","","","1.055","","","","has coordinates,has disorder","194998","2020-10-21","18:00:00",""
"1545256","10.369","0.0005","10.369","0.0005","22.9628","0.0015","90","","90","","120","","2138.1","0.2","120","2","120.15","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30 H30 B2 F8 Fe N24 -","- C30 H30 B2 F8 Fe N24 -","- C60 H60 B4 F16 Fe2 N48 -","2","0.166667","","Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez","Gas confinement in compartmentalized coordination polymers for highly selective sorption","Chem. Sci.","2017","8","4","3109","","10.1039/C6SC05122G","","","0.71073","MoKα","","0.1389","0.109","","","0.2739","0.2978","","","","","","1.08","","","","has coordinates,has disorder","194998","2020-10-21","18:00:00",""
"1545257","10.55931","0.00006","10.55931","0.00006","23.6672","0.0002","90","","90","","120","","2285.33","0.03","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C31.12 H30 Cl2 Fe N24 O10.24 -","- C31.1232 H30 Cl2 Fe N24 O10.2464 -","- C62.2464 H60 Cl4 Fe2 N48 O20.4928 -","2","0.166667","","Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez","Gas confinement in compartmentalized coordination polymers for highly selective sorption","Chem. Sci.","2017","8","4","3109","","10.1039/C6SC05122G","powder diffraction","","0.799933","","","","","","","","","","","2.183","","","","","","","has coordinates","213921","2020-10-21","18:00:00",""
"1545258","10.52034","0.00006","10.52034","0.00006","23.5917","0.0003","90","","90","","120","","2261.25","0.03","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C31.63 H33.26 Cl2 Fe N24 O8 -","- C31.6356 H33.2712 Cl2 Fe N24 O8 -","- C63.2712 H66.5424 Cl4 Fe2 N48 O16 -","2","0.166667","","Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez","Gas confinement in compartmentalized coordination polymers for highly selective sorption","Chem. Sci.","2017","8","4","3109","","10.1039/C6SC05122G","powder diffraction","","0.799933","","","","","","","","","","","1.919","","","","","","","has coordinates","213921","2020-10-21","18:00:00",""
"1545259","10.5426","0.0002","10.5426","0.0002","23.6588","0.0005","90","","90","","120","","2277.29","0.08","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30.78 H33.12 Cl2 Fe N24 O8 -","- C30.78 H33.12 Cl2 Fe N24 O8 -","- C61.56 H66.24 Cl4 Fe2 N48 O16 -","2","0.166667","","Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez","Gas confinement in compartmentalized coordination polymers for highly selective sorption","Chem. Sci.","2017","8","4","3109","","10.1039/C6SC05122G","powder diffraction","","0.799933","","","","","","","","","","","1.285","","","","","","","has coordinates","213921","2020-10-21","18:00:00",""
"1545260","10.57127","0.0001","10.57127","0.0001","23.4813","0.00037","90","","90","","120","","2272.52","0.05","298","","298","","","","","","","","","7","P 63/m","-P 6c","176","","","","- C31.044 H30 B2 F8 Fe N24 O2.088 -","- C31.044 H30 B2 F8 Fe N24 O2.088 -","- C62.088 H60 B4 F16 Fe2 N48 O4.176 -","2","0.166667","","Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez","Gas confinement in compartmentalized coordination polymers for highly selective sorption","Chem. Sci.","2017","8","4","3109","","10.1039/C6SC05122G","powder diffraction","","0.799933","","","","","","","","","","","3.271","","","","","","","has coordinates","213921","2020-10-21","18:00:00",""
"1545261","10.57281","0.000077","10.57281","0.000077","23.49996","0.00033","90","","90","","120","","2274.99","0.04","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C31.8 H33.6 B2 F8 Fe N24 -","- C31.7976 H33.5952 B2 F8 Fe N24 -","- C63.5952 H67.1904 B4 F16 Fe2 N48 -","2","0.166667","","Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez","Gas confinement in compartmentalized coordination polymers for highly selective sorption","Chem. Sci.","2017","8","4","3109","","10.1039/C6SC05122G","powder diffraction","","0.799933","","","","","","","","","","","3.738","","","","","","","has coordinates","213921","2020-10-21","18:00:00",""
"1545262","10.5681","0.00007","10.5681","0.00007","23.4989","0.0003","90","","90","","120","","2272.86","0.04","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30.84 H33.36 B2 F8 Fe N24 -","- C30.84 H33.36 B2 F8 Fe N24 -","- C61.68 H66.72 B4 F16 Fe2 N48 -","2","0.166667","","Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez","Gas confinement in compartmentalized coordination polymers for highly selective sorption","Chem. Sci.","2017","8","4","3109","","10.1039/C6SC05122G","powder diffraction","","0.799933","","","","","","","","","","","3.442","","","","","","","has coordinates","213921","2020-10-21","18:00:00",""
"1546417","9.4048","0.0005","9.4048","0.0005","5.4253","0.0003","90","","90","","120","","415.58","0.04","","","293","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cl3 La3 O6 W -","- Cl3 La3 O6 W -","- Cl6 La6 O12 W2 -","2","0.166667","","Brixner, L. H.; Chen, H. Y.; Foris, C. M.","Structure and luminescence of some rare earth halotungstates of the type Ln3WO6Cl3","Journal of Solid State Chemistry","1982","44","","99","107","","","x-ray","0.71069","MoKα","","","0.028","","","0.036","","","","","","","","","","","has coordinates","198200","2020-10-21","18:00:00",""
"1546500","9.4092","0.0002","9.4092","0.0002","5.4276","0.0002","90","","90","","120","","416.14","0.02","","","295","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cl3 La3 O6 W -","- Cl3 La3 O6 W -","- Cl6 La6 O12 W2 -","2","0.166667","","Parise, J. B.; Brixner, L. H.; Prince, E.","Refinement of the structure of trilanthanum trichlorohexaoxotungstate, La~3~WO~6~Cl~3~, from neutron powder diffraction data","Acta Crystallographica, Section C: Crystal Structure Communications","1983","39","10","1326","1328","10.1107/s0108270183008409","powder diffraction","neutron","1.5416","","","","","","","","","","0.06","","","","","","","","has coordinates","200782","2020-10-21","18:00:00",""
"1547683","24.5149","0.0006","24.5149","0.0006","9.7646","0.0002","90","","90","","120","","5082.1","0.2","100","","100","","","","","","","","","5","P 63/m","-P 6c","176","","","","- C18 H36 Br7 N12 Pb2 -","- C18 H36 Br7 N12 Pb2 -","- C108 H216 Br42 N72 Pb12 -","6","0.5","","Lin, Haoran; Zhou, Chenkun; Tian, Yu; Besara, Tiglet; Neu, Jennifer; Siegrist, Theo; Zhou, Yan; Bullock, James; Schanze, Kirk; Ming, Wenmei; Du, Mao Hua; Ma, Biwu","Bulk Assembly of Organic Metal Halide Nanotubes","Chem. Sci.","2017","","","","","10.1039/C7SC03675B","","","0.71073","MoKα","","0.0593","0.0518","","0.0729","0.0698","0.0728","","","","","","1.0634","","","","has coordinates","202041","2020-10-21","18:00:00",""
"1548311","23.7146","0.0012","23.7146","0.0012","19.1834","0.0011","90","","90","","120","","9343","0.9","150","2","150","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C9 H56 K Mo10 N O42 S10 -","- C9 K1.00333 Mo10 N0.996667 O41.6867 S10 -","- C54 K6.02 Mo60 N5.98 O250.12 S60 -","6","0.5","","Hong-Ying Zang; Andreu Ruiz de la Oliva; Haralampos N. Miras; De-Liang Long; Roy T. McBurney; Leroy Cronin","Discovery of gigantic molecular nanostructures using a flow reaction array as a search engine","Nature Communications","2014","5","","3715","","10.1038/ncomms4715","","","0.71073","MoKα","","0.0292","0.0247","","","0.071","0.075","","","","","","1.079","","","","has coordinates","203774","2020-10-21","18:00:00",""
"1548369","26.009","0.004","26.009","0.004","9.8065","0.0017","90","","90","","120","","5745","1.6","173","2","173","2","","","","","","","","4","P 63/m","-P 6c","176","[Th3(bptc)3(O)(H2O)3.78][(Cl)(C5H14N3Cl)(H2O)8]","","","- C15 H7 O7.59 Th -","- C15 H7 O7.59333 Th -","- C90 H42 O45.56 Th6 -","6","0.5","","Yuxiang Li; Zaixing Yang; Yanlong Wang; Zhuanling Bai; Tao Zheng; Xing Dai; Shengtang Liu; Daxiang Gui; Wei Liu; Meng Chen; Lanhua Chen; Juan Diwu; Lingyan Zhu; Ruhong Zhou; Zhifang Chai; Thomas E. Albrecht-Schmitt; Shuao Wang","A mesoporous cationic thorium-organic framework that rapidly traps anionic persistent organic pollutants","Nature Communications","2017","8","","1354","","10.1038/s41467-017-01208-w","","","0.71073","MoKα","","0.0777","0.0764","","","0.1895","0.1903","","","","","","1.103","","","","has coordinates,has disorder","203932","2020-10-21","18:00:00",""
"1549763","9.384","0.002","9.384","0.002","6.8842","0.0006","90","","90","","120","","525","0.16","","","","","","","","","","","","6","P 63/m","-P 6c","176","fluorapatite","","fluorapatite","- Ca4.83 F Mn0.15 O12 P3 Sr0.02 -","- Ca4.841 F Mn0.144 O12 P3 Sr0.015 -","- Ca9.682 F2 Mn0.288 O24 P6 Sr0.03 -","2","0.166667","","Arima, H.; Kida, Y.; Mikouchi, T.; Sugiyama, K.","The location of Mn (MnO: 2.0 wt%) in fluorapatit from Lavra da Golconda, near Governador Valadares, Minas Gerais, Brazil","Journal of Mineralogical and Petrological Sciences","2018","113","","119","125","","","","","","","","","","","","","","","","","","","","","","has coordinates","209378","2020-10-21","18:00:00",""
"1550748","9.7078","0.0002","9.7078","0.0002","7.2393","0.0001","90","","90","","120","","590.839","0.019","","","","","","","","","","","","5","P 63/m","-P 6c","176","La9.113K0.8464Si5.895O25.7674F0.2326","","","- F0.2326 K0.8464 La9.113 O25.7674 Si5.895 -","- F0.2326 K0.8464 La9.1128 O25.7674 Si5.8956 -","- F0.2326 K0.8464 La9.1128 O25.7674 Si5.8956 -","1","0.0833333","","Fukuda, K.; Tsunoda, Y.; Urushihara, D.; Asaka, T.; Yoshida, H.","Flux growth of doped lanthanum silicate oxyapatite crystals with hexagonal tabular morphology","Journal of the Ceramic Society of Japan","2019","127","","143","149","","","","","","","","","","","","","","","","","","","","","","has coordinates","214129","2020-10-21","18:00:00",""
"1559836","9.493","0.004","9.493","0.004","6.852","0.005","90","","90","","120","","534.8","0.5","571","2","571","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- O13 Si3 Tb4.66 -","- O13 Si3 Tb4.656 -","- O26 Si6 Tb9.312 -","2","0.166667","","Chen, Pengyun; Li, R.K.","Two high terbium content apatites: Tb5Si2BO13 and Tb4.66Si3O13","Journal of Alloys and Compounds","2015","622","","859","864","10.1016/j.jallcom.2014.10.159","","","0.71073","MoKα","","0.0373","0.0319","","","0.057","0.0591","","","","","","1.149","","","","has coordinates","260053","2020-12-21","17:40:08",""
"1559837","9.2569","0.001","9.2569","0.001","6.8297","0.0012","90","","90","","120","","506.83","0.12","298","2","298.15","","","","","","","","","4","P 63/m","-P 6c","176","","","","- B O13 Si2 Tb5 -","- B0.9999 O13 Si2.0001 Tb5 -","- B1.9998 O26 Si4.0002 Tb10 -","2","0.166667","","Chen, Pengyun; Li, R.K.","Two high terbium content apatites: Tb5Si2BO13 and Tb4.66Si3O13","Journal of Alloys and Compounds","2015","622","","859","864","10.1016/j.jallcom.2014.10.159","","","0.71073","MoKα","","0.0424","0.0396","","","0.0809","0.0821","","","","","","1.281","","","","has coordinates","260054","2020-12-21","17:45:39",""
"1560686","9.8823","0.0012","9.8823","0.0012","6.2222","0.0016","90","","90","","120","","526.25","0.16","296","2","296","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- As3 Cl Mn5 O12 -","- As3 Cl Mn5 O12 -","- As6 Cl2 Mn10 O24 -","2","0.166667","","Weil, Matthias; Kremer, Reinhard K.","Crystal growth and crystal structures of six novel phases in the Mn/As/O/Cl(Br) system, as well as magnetic properties of α -Mn 3 (AsO 4 ) 2","Journal of Solid State Chemistry","2017","245","","115","126","10.1016/j.jssc.2016.09.027","","","0.71073","MoKα","","0.0176","0.0165","","","0.0396","0.04","","","","","","1.14","","","","has coordinates","262260","2021-02-26","10:15:23",""
"1561304","11.5115","0.0002","11.5115","0.0002","9.3896","0.0003","90","","90","","120","","1077.56","0.04","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","yttium pivalate","catena-tris(mu2-2,2-dimethylpropionato-O,O')yttrium(iii)","","- C15 H27 O6 Y -","- C15 O6 Y -","- C30 O12 Y2 -","2","0.166667","","Tsymbarenko, Dmitry; Martynova, Irina; Grebenyuk, Dimitry; Shegolev, Vsevolod; Kuzmina, Natalia","One-dimensional coordination polymers of whole row rare earth tris-pivalates","Journal of Solid State Chemistry","2018","258","","876","884","10.1016/j.jssc.2017.12.024","powder diffraction","x-ray","1.54187","CuKα","","0.0414","0.0414","","0.0516","0.0516","","","","5.7","","","","","","","has coordinates","263368","2021-03-26","10:30:42",""
"1561305","11.5243","0.0002","11.5243","0.0002","9.3699","0.0003","90","","90","","120","","1077.69","0.04","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","holmium pivalate","catena-tris(mu2-2,2-dimethylpropionato-O,O')yttrium(iii)","","- C15 H27 Ho O6 -","- C15 H27 Ho O6 -","- C30 H54 Ho2 O12 -","2","0.166667","","Tsymbarenko, Dmitry; Martynova, Irina; Grebenyuk, Dimitry; Shegolev, Vsevolod; Kuzmina, Natalia","One-dimensional coordination polymers of whole row rare earth tris-pivalates","Journal of Solid State Chemistry","2018","258","","876","884","10.1016/j.jssc.2017.12.024","powder diffraction","x-ray","1.54187","","","0.0392","0.0383","","0.0429","0.0421","","","","3.79","","","","","","","has coordinates","263368","2021-03-26","10:30:47",""
"1561306","10.7179","0.0019","10.7179","0.0019","9.5131","0.0017","90","","90","","120","","946.4","0.3","120","2","120","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C15 H27 O6 Yb -","- C15 H27 O6 Yb -","- C30 H54 O12 Yb2 -","2","0.166667","","Tsymbarenko, Dmitry; Martynova, Irina; Grebenyuk, Dimitry; Shegolev, Vsevolod; Kuzmina, Natalia","One-dimensional coordination polymers of whole row rare earth tris-pivalates","Journal of Solid State Chemistry","2018","258","","876","884","10.1016/j.jssc.2017.12.024","","","0.71073","MoKα","","0.0644","0.0404","","","0.0695","0.0756","","","","","","1.209","","","","has coordinates","263368","2021-03-26","10:30:51",""
"1561307","10.707","0.003","10.707","0.003","9.467","0.002","90","","90","","120","","939.9","0.4","120","2","120","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C15 H27 Lu O6 -","- C15 H27 Lu O6 -","- C30 H54 Lu2 O12 -","2","0.166667","","Tsymbarenko, Dmitry; Martynova, Irina; Grebenyuk, Dimitry; Shegolev, Vsevolod; Kuzmina, Natalia","One-dimensional coordination polymers of whole row rare earth tris-pivalates","Journal of Solid State Chemistry","2018","258","","876","884","10.1016/j.jssc.2017.12.024","","","0.71073","MoKα","","0.1096","0.0784","","","0.141","0.1531","","","","","","1.257","","","","has coordinates","263368","2021-03-26","10:30:54",""
"1561382","18.571","0.0013","18.571","0.0013","28.8779","0.0015","90","","90","","120","","8625.2","1","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C84 H60 Mg3 N6 O42 P6 -","- C84 H60 Mg3 N6 O42 P6 -","- C168 H120 Mg6 N12 O84 P12 -","2","0.166667","","Ling, Yajing; Bai, Dongjie; Feng, Yunlong; He, Yabing","Alkaline earth-based coordination polymers derived from a cyclotriphosphazene-functionalized hexacarboxylate","Journal of Solid State Chemistry","2016","242","","47","54","10.1016/j.jssc.2016.07.016","","","0.71073","MoKα","","0.1483","0.1047","","","0.2642","0.2971","","","","","","1.001","","","","has coordinates","263483","2021-03-31","08:34:24",""
"1561591","9.7205","0.0013","9.7205","0.0013","7.1987","0.001","90","","90","","120","","589.06","0.14","293","","293","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La9.48 O26 Si5.89 -","- La9.484 O26 Si5.886 -","- La9.484 O26 Si5.886 -","1","0.0833333","","Fukuda, Koichiro; Hasegawa, Ryo; Kitagawa, Takuya; Nakamori, Hiroshi; Asaka, Toru; Berghout, Abid; Béchade, Emilie; Masson, Olivier; Jouin, Jenny; Thomas, Philippe","Well-aligned polycrystalline lanthanum silicate oxyapatite grown by reactive diffusion between solid La2SiO5 and gases [SiO+1/2O2]","Journal of Solid State Chemistry","2016","235","","1","6","10.1016/j.jssc.2015.12.007","","x-ray","0.71073","MoKα","","0.0273","0.0169","","","0.0201","0.0215","","","","1.17","1.17","1.12","","","","has coordinates","264002","2021-04-09","07:27:54",""
"1561595","9.4233","0.0001","9.4233","0.0001","13.7882","0.0003","90","","90","","120","","1060.34","0.03","294","2","294","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ho Na3 O7 Si2 -","- Ho Na3 O7 Si2 -","- Ho6 Na18 O42 Si12 -","6","0.5","","Latshaw, Allison M.; Yeon, Jeongho; Smith, Mark D.; zur Loye, Hans-Conrad","Synthesis, structure, and polymorphism of A3LnSi2O7 (A=Na, K; Ln=Sm, Ho, Yb)","Journal of Solid State Chemistry","2016","235","","100","106","10.1016/j.jssc.2015.12.013","","","0.71073","MoKα","","0.019","0.0187","","","0.0442","0.0443","","","","","","1.231","","","","has coordinates","264005","2021-04-09","07:53:39",""
"1561596","9.377","0.0002","9.377","0.0002","13.7187","0.0004","90","","90","","120","","1044.65","0.04","294","2","294.15","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Na3 O7 Si2 Yb -","- Na3 O7 Si2 Yb -","- Na18 O42 Si12 Yb6 -","6","0.5","","Latshaw, Allison M.; Yeon, Jeongho; Smith, Mark D.; zur Loye, Hans-Conrad","Synthesis, structure, and polymorphism of A3LnSi2O7 (A=Na, K; Ln=Sm, Ho, Yb)","Journal of Solid State Chemistry","2016","235","","100","106","10.1016/j.jssc.2015.12.013","","","0.71073","MoKα","","0.0143","0.0142","","","0.0349","0.0349","","","","","","1.273","","","","has coordinates","264006","2021-04-09","07:54:57",""
"1562514","11.2282","0.0016","11.2282","0.0016","6.0823","0.0012","90","","90","","120","","664.08","0.19","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge3 Mn3 O15 Sr4 -","- Ge3 Mn3 O15 Sr4 -","- Ge6 Mn6 O30 Sr8 -","2","0.166667","","West, J. Palmer; Sulejmanovic, Dino; Becht, Gregory; He, Jian; Hitchcock, Dale; Yan, Yonggao; Hwu, Shiou-Jyh","Enhanced ferromagnetic order in Sr4Mn3O3(GeO4)3 featuring canted [MnO4] spin chains of mixed-valent Mn(III)/Mn(IV). Aliovalent substitution of the Sr4−LnMnIII2+MnIV1−O3(GeO4)3 solid-solution","Journal of Solid State Chemistry","2013","206","","51","59","10.1016/j.jssc.2013.07.033","","","0.71073","MoKα","","0.0565","0.0479","","","0.1078","0.1153","","","","","","1.202","","","","has coordinates","265134","2021-05-12","08:12:26",""
"1562515","11.2335","0.0016","11.2335","0.0016","6.0742","0.0012","90","","90","","120","","663.82","0.19","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ge3 La0.18 Mn3 O15 Sr3.82 -","- Ge3 La0.179 Mn3 O15 Sr3.821 -","- Ge6 La0.358 Mn6 O30 Sr7.642 -","2","0.166667","","West, J. Palmer; Sulejmanovic, Dino; Becht, Gregory; He, Jian; Hitchcock, Dale; Yan, Yonggao; Hwu, Shiou-Jyh","Enhanced ferromagnetic order in Sr4Mn3O3(GeO4)3 featuring canted [MnO4] spin chains of mixed-valent Mn(III)/Mn(IV). Aliovalent substitution of the Sr4−LnMnIII2+MnIV1−O3(GeO4)3 solid-solution","Journal of Solid State Chemistry","2013","206","","51","59","10.1016/j.jssc.2013.07.033","","","0.71073","MoKα","","0.0352","0.0315","","","0.0717","0.0731","","","","","","1.253","","","","has coordinates","265134","2021-05-12","08:12:28",""
"1562516","11.232","0.0016","11.232","0.0016","6.0737","0.0012","90","","90","","120","","663.59","0.19","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ge3 Mn3 O15 Pr0.18 Sr3.82 -","- Ge3 Mn3 O15 Pr0.184 Sr3.816 -","- Ge6 Mn6 O30 Pr0.368 Sr7.632 -","2","0.166667","","West, J. Palmer; Sulejmanovic, Dino; Becht, Gregory; He, Jian; Hitchcock, Dale; Yan, Yonggao; Hwu, Shiou-Jyh","Enhanced ferromagnetic order in Sr4Mn3O3(GeO4)3 featuring canted [MnO4] spin chains of mixed-valent Mn(III)/Mn(IV). Aliovalent substitution of the Sr4−LnMnIII2+MnIV1−O3(GeO4)3 solid-solution","Journal of Solid State Chemistry","2013","206","","51","59","10.1016/j.jssc.2013.07.033","","","0.71073","MoKα","","0.0468","0.0396","","","0.0957","0.1012","","","","","","1.17","","","","has coordinates","265134","2021-05-12","08:12:28",""
"1562517","11.2316","0.0016","11.2316","0.0016","6.0755","0.0012","90","","90","","120","","663.74","0.19","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ge3 Mn3 Nd0.18 O15 Sr3.82 -","- Ge3 Mn3 Nd0.172 O15 Sr3.828 -","- Ge6 Mn6 Nd0.344 O30 Sr7.656 -","2","0.166667","","West, J. Palmer; Sulejmanovic, Dino; Becht, Gregory; He, Jian; Hitchcock, Dale; Yan, Yonggao; Hwu, Shiou-Jyh","Enhanced ferromagnetic order in Sr4Mn3O3(GeO4)3 featuring canted [MnO4] spin chains of mixed-valent Mn(III)/Mn(IV). Aliovalent substitution of the Sr4−LnMnIII2+MnIV1−O3(GeO4)3 solid-solution","Journal of Solid State Chemistry","2013","206","","51","59","10.1016/j.jssc.2013.07.033","","","0.71073","MoKα","","0.0306","0.027","","","0.0635","0.0658","","","","","","1.223","","","","has coordinates","265134","2021-05-12","08:12:28",""
"1562518","11.2248","0.0016","11.2248","0.0016","6.0673","0.0012","90","","90","","120","","662.04","0.19","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ge3 Mn3 O15 Sm0.21 Sr3.79 -","- Ge3 Mn3 O15 Sm0.21 Sr3.79 -","- Ge6 Mn6 O30 Sm0.42 Sr7.58 -","2","0.166667","","West, J. Palmer; Sulejmanovic, Dino; Becht, Gregory; He, Jian; Hitchcock, Dale; Yan, Yonggao; Hwu, Shiou-Jyh","Enhanced ferromagnetic order in Sr4Mn3O3(GeO4)3 featuring canted [MnO4] spin chains of mixed-valent Mn(III)/Mn(IV). Aliovalent substitution of the Sr4−LnMnIII2+MnIV1−O3(GeO4)3 solid-solution","Journal of Solid State Chemistry","2013","206","","51","59","10.1016/j.jssc.2013.07.033","","","0.71073","MoKα","","0.0598","0.0494","","","0.1162","0.1232","","","","","","1.164","","","","has coordinates","265134","2021-05-12","08:12:28",""
"1562519","11.2317","0.0016","11.2317","0.0016","6.0705","0.0012","90","","90","","120","","663.2","0.19","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Eu0.15 Ge3 Mn3 O15 Sr3.85 -","- Eu0.15 Ge3 Mn3 O15 Sr3.85 -","- Eu0.3 Ge6 Mn6 O30 Sr7.7 -","2","0.166667","","West, J. Palmer; Sulejmanovic, Dino; Becht, Gregory; He, Jian; Hitchcock, Dale; Yan, Yonggao; Hwu, Shiou-Jyh","Enhanced ferromagnetic order in Sr4Mn3O3(GeO4)3 featuring canted [MnO4] spin chains of mixed-valent Mn(III)/Mn(IV). Aliovalent substitution of the Sr4−LnMnIII2+MnIV1−O3(GeO4)3 solid-solution","Journal of Solid State Chemistry","2013","206","","51","59","10.1016/j.jssc.2013.07.033","","","0.71073","MoKα","","0.0767","0.0627","","","0.1559","0.1721","","","","","","1.211","","","","has coordinates","265134","2021-05-12","08:12:28",""
"1562520","11.2255","0.0016","11.2255","0.0016","6.0703","0.0012","90","","90","","120","","662.45","0.19","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Gd0.15 Ge3 Mn3 O15 Sr3.85 -","- Gd0.15 Ge3 Mn3 O15 Sr3.85 -","- Gd0.3 Ge6 Mn6 O30 Sr7.7 -","2","0.166667","","West, J. Palmer; Sulejmanovic, Dino; Becht, Gregory; He, Jian; Hitchcock, Dale; Yan, Yonggao; Hwu, Shiou-Jyh","Enhanced ferromagnetic order in Sr4Mn3O3(GeO4)3 featuring canted [MnO4] spin chains of mixed-valent Mn(III)/Mn(IV). Aliovalent substitution of the Sr4−LnMnIII2+MnIV1−O3(GeO4)3 solid-solution","Journal of Solid State Chemistry","2013","206","","51","59","10.1016/j.jssc.2013.07.033","","","0.71073","MoKα","","0.0678","0.0597","","","0.1376","0.1445","","","","","","1.132","","","","has coordinates","265134","2021-05-12","08:12:31",""
"1562521","11.2113","0.0016","11.2113","0.0016","6.0617","0.0012","90","","90","","120","","659.84","0.19","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Dy0.12 Ge3 Mn3 O15 Sr3.88 -","- Dy0.119 Ge3 Mn3 O15 Sr3.881 -","- Dy0.238 Ge6 Mn6 O30 Sr7.762 -","2","0.166667","","West, J. Palmer; Sulejmanovic, Dino; Becht, Gregory; He, Jian; Hitchcock, Dale; Yan, Yonggao; Hwu, Shiou-Jyh","Enhanced ferromagnetic order in Sr4Mn3O3(GeO4)3 featuring canted [MnO4] spin chains of mixed-valent Mn(III)/Mn(IV). Aliovalent substitution of the Sr4−LnMnIII2+MnIV1−O3(GeO4)3 solid-solution","Journal of Solid State Chemistry","2013","206","","51","59","10.1016/j.jssc.2013.07.033","","","0.71073","MoKα","","0.0588","0.0503","","","0.1248","0.1317","","","","","","1.148","","","","has coordinates","265134","2021-05-12","08:12:31",""
"1562522","11.2259","0.0016","11.2259","0.0016","6.0482","0.0012","90","","90","","120","","660.08","0.19","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Gd0.29 Ge3 Mn3 O15 Sr3.71 -","- Gd0.289 Ge3 Mn3 O15 Sr3.711 -","- Gd0.578 Ge6 Mn6 O30 Sr7.422 -","2","0.166667","","West, J. Palmer; Sulejmanovic, Dino; Becht, Gregory; He, Jian; Hitchcock, Dale; Yan, Yonggao; Hwu, Shiou-Jyh","Enhanced ferromagnetic order in Sr4Mn3O3(GeO4)3 featuring canted [MnO4] spin chains of mixed-valent Mn(III)/Mn(IV). Aliovalent substitution of the Sr4−LnMnIII2+MnIV1−O3(GeO4)3 solid-solution","Journal of Solid State Chemistry","2013","206","","51","59","10.1016/j.jssc.2013.07.033","","","0.71073","MoKα","","0.049","0.044","","","0.0912","0.0946","","","","","","1.086","","","","has coordinates","265134","2021-05-12","08:12:31",""
"1562913","8.4438","0.0003","8.4438","0.0003","22.215","0.001","90","","90","","120","","1371.68","0.09","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- O74 P18 Ti12 V2 -","- O74.04 P18 Ti12 V2 -","- O74.04 P18 Ti12 V2 -","1","0.0833333","","Titlbach, Sven; Hoffbauer, Wilfried; Glaum, Robert","Equilibrium relations in the system TiO2/V2O5/P2O5 and crystal structure of a NASICON-related vanadyl(V) titanium(IV) phosphate","Journal of Solid State Chemistry","2012","196","","565","573","10.1016/j.jssc.2012.07.022","","","0.71073","MoKα","","0.0491","0.0324","","","","0.0842","","","","","","1.059","","","","has coordinates","265544","2021-05-27","07:50:05",""
"1563108","7.246","0.0003","7.246","0.0003","14.5521","0.0017","90","","90","","120","","661.69","0.09","296","2","296","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- B F O3 Pb2 -","- B F O3 Pb2 -","- B6 F6 O18 Pb12 -","6","0.5","","Zhao, Wenwu; Pan, Shilie; Han, Jian; Yao, Jiyong; Yang, Yun; Li, Junjie; Zhang, Min; Zhang, Lian Han; Hang, Yin","Synthesis, crystal structure and optical properties of the new lead fluoride borate—Pb2BO3F","Journal of Solid State Chemistry","2011","184","11","2849","2853","10.1016/j.jssc.2011.08.024","","","0.71073","MoKα","","0.0176","0.0163","","","0.0367","0.037","","","","","","1.332","","","","has coordinates","265708","2021-06-03","07:49:54",""
"1563287","11.8429","0.0006","11.8429","0.0006","13.8128","0.0014","90","","90","","120","","1677.8","0.2","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- K3 Mg18 Sn11 -","- K3 Mg18 Sn11 -","- K6 Mg36 Sn22 -","2","0.166667","","Lei, Xiao-Wu","K2Mg5−xSn3 and K3Mg18Tt11 (Tt=Sn, pb) with two types of Mg‒Sn/Pb frameworks","Journal of Solid State Chemistry","2011","184","4","852","858","10.1016/j.jssc.2011.02.003","","","0.71073","MoKα","","0.0445","0.0412","","","0.0765","0.0782","","","","","","1.125","","","","has coordinates,has disorder","266354","2021-06-10","08:30:44",""
"1563288","11.9615","0.0006","11.9615","0.0006","13.909","0.0013","90","","90","","120","","1723.4","0.2","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- K3 Mg18 Pb11 -","- K3 Mg18 Pb11.002 -","- K6 Mg36 Pb22.004 -","2","0.166667","","Lei, Xiao-Wu","K2Mg5−xSn3 and K3Mg18Tt11 (Tt=Sn, pb) with two types of Mg‒Sn/Pb frameworks","Journal of Solid State Chemistry","2011","184","4","852","858","10.1016/j.jssc.2011.02.003","","","0.71073","MoKα","","0.0474","0.0342","","","0.0803","0.0868","","","","","","1.177","","","","has coordinates,has disorder","266354","2021-06-10","08:30:44",""
"1563534","9.4058","0.001","9.4058","0.001","6.6531","0.0008","90","","90","","120","","509.74","0.1","415","2","415","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C4 H11 Cl4 Cr N -","- C4.0008 H11.0022 Cl4.0002 Cr N1.0002 -","- C8.0016 H22.0044 Cl8.0004 Cr2 N2.0004 -","2","0.166667","","Ai, Yong; Sun, Rong; Zeng, Yu-Ling; Liu, Jun-Chao; Tang, Yuan-Yuan; Wang, Bing-Wu; Wang, Zheming; Gao, Song; Xiong, Ren-Gen","Coexistence of Magnetic and Electric Orderings in a Divalent Cr2±Based Multiaxial Molecular Ferroelectric","Chemical Science","2021","","","","","10.1039/D1SC01871J","","","0.71073","MoKα","","0.1901","0.1247","","","0.309","0.3474","","","","","","1.006","","","","has coordinates,has disorder","266508","2021-06-17","01:21:42",""
"1563539","9.609","0.0007","9.609","0.0007","7.0521","0.0007","90","","90","","120","","563.9","0.08","295","","295","","","","","","","","synthezed","5","P 63/m","-P 6c","176","","Tetracalcium Tetrabismuth Hexakis (silicate) Oxide","","- Bi2.15 Ca2 H2.5 O12.475 Si3 -","- Bi4.296 Ca4 O19.946 Oh5.004 Si6 -","- Bi4.296 Ca4 O19.946 Oh5.004 Si6 -","1","0.0833333","","Uvarov, Vladimir; Shenawi-Khalil, Sanaa; Popov, Inna","New bismuth calcium oxysilicate with apatite structure: Synthesis and structural characterization","Journal of Solid State Chemistry","2010","183","7","1484","1489","10.1016/j.jssc.2010.04.028","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","0.0456","1.87","","","","","","","has coordinates","266526","2021-06-17","08:42:49",""
"1563586","8.0306","0.0009","8.0306","0.0009","7.4089","0.0013","90","","90","","120","","413.79","0.1","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- B Fe2 O12 P3 -","- B Fe2 O12 P3 -","- B2 Fe4 O24 P6 -","2","0.166667","","Zhang, Wei-Long; Lin, Chen-Sheng; Geng, Lei; Li, Ye-Yu; Zhang, Hao; He, Zhang-Zhen; Cheng, Wen-Dan","Synthesis and characterizations of two anhydrous metal borophosphates: MIII2BP3O12 (M=Fe, In)","Journal of Solid State Chemistry","2010","183","5","1108","1113","10.1016/j.jssc.2010.03.020","","","0.71073","MoKα","","0.0307","0.0268","","","0.0528","0.0543","","","","","","1.136","","","","has coordinates","266565","2021-06-18","09:37:30",""
"1563587","8.1698","0.0006","8.1698","0.0006","7.7375","0.0011","90","","90","","120","","447.25","0.08","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- B In2 O12 P3 -","- B In2 O12 P3 -","- B2 In4 O24 P6 -","2","0.166667","","Zhang, Wei-Long; Lin, Chen-Sheng; Geng, Lei; Li, Ye-Yu; Zhang, Hao; He, Zhang-Zhen; Cheng, Wen-Dan","Synthesis and characterizations of two anhydrous metal borophosphates: MIII2BP3O12 (M=Fe, In)","Journal of Solid State Chemistry","2010","183","5","1108","1113","10.1016/j.jssc.2010.03.020","","","0.71073","MoKα","","0.0135","0.0134","","","0.0329","0.033","","","","","","1.035","","","","has coordinates","266565","2021-06-18","09:37:31",""
"1563732","11.767","0.0009","11.767","0.0009","14.767","0.0012","90","","90","","120","","1770.7","0.2","113","2","113","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C12 H54 F21 In4 N11 -","- C12 H56 F21 In4 N11 -","- C24 H112 F42 In8 N22 -","2","0.166667","","Jayasundera, Anil C.A.; Goff, Richard J.; Li, Yang; Finch, Adrian A.; Lightfoot, Philip","Solvothermal indium fluoride chemistry: Syntheses and crystal structures of K5In3F14, β-(NH4)3InF6 and [NH4]3[C6H21N4]2[In4F21]","Journal of Solid State Chemistry","2010","183","2","356","360","10.1016/j.jssc.2009.11.022","","","0.71073","MoKα","","0.0817","0.0649","","","0.18","0.2169","","","","","","1.102","","","","has coordinates","266733","2021-06-28","09:29:21",""
"1564574","21.9624","0.0004","21.9624","0.0004","20.8625","0.0011","90","","90","","120","","8714.8","0.5","150","2","150.05","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C153 H117 Cl2 Gd7 N36 O38 -","- C153 H117 Cl2 Gd7 N36 O38 -","- C306 H234 Cl4 Gd14 N72 O76 -","2","0.166667","","Lan, Hai-Ming; Yang, Ru-Xia; Yang, Li-Zhen; Zhu, Peng-Yin; Wang, Lu-Lu; Yu, Yu-Ming; Wang, Duo-Zhi","Lanthanide complexes based on the linear bifunctional ligand: Synthesis, structure regulation and magnetic properties","Inorganica Chimica Acta","2020","508","","119593","","10.1016/j.ica.2020.119593","","","0.71073","MoKα","","0.0566","0.0393","","","0.0929","0.1049","","","","","","1.032","","","","has coordinates,has disorder","269017","2021-09-07","08:31:10",""
"1564575","21.8289","0.0004","21.8289","0.0004","20.8477","0.0005","90","","90","","120","","8603.1","0.3","100","0.1","100","0.1","","","","","","","","5","P 63/m","-P 6c","176","","","","- C153 H132 Ho7 N36 O40.5 -","- C153 H132 Ho7 N36 O40.4996 -","- C306 H263.999 Ho14 N72 O80.9992 -","2","0.166667","","Lan, Hai-Ming; Yang, Ru-Xia; Yang, Li-Zhen; Zhu, Peng-Yin; Wang, Lu-Lu; Yu, Yu-Ming; Wang, Duo-Zhi","Lanthanide complexes based on the linear bifunctional ligand: Synthesis, structure regulation and magnetic properties","Inorganica Chimica Acta","2020","508","","119593","","10.1016/j.ica.2020.119593","","x-ray","0.71073","MoKα","","0.0571","0.0417","","","0.1082","0.1181","","","","","","1.068","","","","has coordinates,has disorder","269018","2021-09-07","08:33:59",""
"1564576","21.8806","0.0005","21.8806","0.0005","20.7765","0.0011","90","","90","","120","","8614.3","0.5","150","2","150","","","","","","","","","5","P 63/m","-P 6c","176","","","","- C153 H102 Dy7 N33 O32 -","- C153 H102 Dy7 N33 O32 -","- C306 H204 Dy14 N66 O64 -","2","0.166667","","Lan, Hai-Ming; Yang, Ru-Xia; Yang, Li-Zhen; Zhu, Peng-Yin; Wang, Lu-Lu; Yu, Yu-Ming; Wang, Duo-Zhi","Lanthanide complexes based on the linear bifunctional ligand: Synthesis, structure regulation and magnetic properties","Inorganica Chimica Acta","2020","508","","119593","","10.1016/j.ica.2020.119593","","","0.71073","MoKα","","0.0628","0.0425","","","0.1","0.1146","","","","","","1.024","","","","has coordinates","269019","2021-09-07","08:37:22",""
"1564577","21.7953","0.0005","21.7953","0.0005","20.9712","0.0013","90","","90","","120","","8627.4","0.6","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C153.01 H105 Er7 N36 O32 -","- C153 H105 Er7 N36 O32 -","- C306 H210 Er14 N72 O64 -","2","0.166667","","Lan, Hai-Ming; Yang, Ru-Xia; Yang, Li-Zhen; Zhu, Peng-Yin; Wang, Lu-Lu; Yu, Yu-Ming; Wang, Duo-Zhi","Lanthanide complexes based on the linear bifunctional ligand: Synthesis, structure regulation and magnetic properties","Inorganica Chimica Acta","2020","508","","119593","","10.1016/j.ica.2020.119593","","","0.71073","MoKα","","0.0833","0.0552","","","0.1416","0.1672","","","","","","1.039","","","","has coordinates,has disorder","269020","2021-09-07","08:38:47",""
"1565557","12.9522","0.0018","12.9522","0.0018","14.054","0.003","90","","90","","120","","2041.8","0.6","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C12 H6 O16 Sc3 -","- C12 H6 O16 Sc3 -","- C24 H12 O32 Sc6 -","2","0.166667","","Wang, Pengcheng; Zhang, Liying; Zhu, Ziqian; Wu, Shujie; Shan, Liang; Fan, Yong; Wang, Li; Chen, Xiaodong; Xu, Jianing","Two three-dimensional Sc(III)-MOFs: Synthesis, crystal structure and catalytic property","Inorganica Chimica Acta","2020","501","","119304","","10.1016/j.ica.2019.119304","","","0.71073","MoKα","","0.087","0.0632","","","0.1903","0.203","","","","","","1.113","","","","has coordinates","271129","2021-12-06","09:22:44",""
"1565928","10.4308","0.00005","10.4308","0.00005","7.86002","0.00004","90","","90","","120","","740.61","0.006","","","298","","","","100","","","","","4","P 63/m","-P 6c","176","Ba(VO4)3F","","apatite analogue","- Ba5 F O12 V3 -","- F O12 Pb5 V3 -","- F2 O24 Pb10 V6 -","2","0.166667","","Oka, K.; Nishiki, W.; Takasu, M.; Noma, N.; Iwasaki, M.","Site preference of fluoride anion and potential ionic conductivity in fluorapatites A5(VO4)3F (A = Pb, Sr, and Ba)","Journal of the Ceramic Society of Japan","2022","130","","35","38","10.2109/jcersj2.130.P1-1","","","","","","","","","","","","","","","","","","","","","has coordinates","271967","2022-01-09","06:53:33",""
"1565929","10.01267","0.00007","10.01267","0.00007","7.43169","0.00004","90","","90","","120","","645.235","0.007","","","298","","","","100","","","","","4","P 63/m","-P 6c","176","Sr(VO4)3F","","apatite analogue","- F O12 Sr5 V3 -","- F O12 Pb5 V3 -","- F2 O24 Pb10 V6 -","2","0.166667","","Oka, K.; Nishiki, W.; Takasu, M.; Noma, N.; Iwasaki, M.","Site preference of fluoride anion and potential ionic conductivity in fluorapatites A5(VO4)3F (A = Pb, Sr, and Ba)","Journal of the Ceramic Society of Japan","2022","130","","35","38","10.2109/jcersj2.130.P1-1","","","","","","","","","","","","","","","","","","","","","has coordinates","271968","2022-01-09","06:54:20",""
"1565930","10.10647","0.00015","10.10647","0.00015","7.35582","0.00008","90","","90","","120","","650.67","0.015","","","298","","","","100","","","","","4","P 63/m","-P 6c","176","Pb(VO4)3F","","apatite analogue","- F O12 Pb5 V3 -","- F O12 Pb5 V3 -","- F2 O24 Pb10 V6 -","2","0.166667","","Oka, K.; Nishiki, W.; Takasu, M.; Noma, N.; Iwasaki, M.","Site preference of fluoride anion and potential ionic conductivity in fluorapatites A5(VO4)3F (A = Pb, Sr, and Ba): Pb(VO4)3F","Journal of the Ceramic Society of Japan","2022","130","","35","38","10.2109/jcersj2.130.P1-1","","","","","","","","","","","","","","","","","","","","","has coordinates","271969","2022-01-09","06:54:55",""
"1566330","10.237","","10.237","","7.426","","90","","90","","120","","673.955","","293","","293","","","","","","","","","5","P 63/m","-P 6c","176","","","","- As3 Cl O12 Pb5 Si0 -","- As3 Cl O12 Pb5 -","- As6 Cl2 O24 Pb10 -","2","0.166667","","Jiri Sejkora; Jakub Plasil; Ivana Cisarova; Radek Skoda; Jan Hlousek; Frantisek Veselovsky; Ivana Jebava","Interesting supergene Pb-rich mineral association from the Rovnost mining field, Jachymov (St. Joachimsthal), Czech Republic","Journal of GeoSciences","2011","56","","257","271","10.3190/jgeosci.100","","","0.71073","MoKα","","0.0646","0.0381","","","0.0866","0.0916","","","","2.5","2.5","2.25","","","","has coordinates","272833","2022-02-07","09:18:49",""
"1568691","12.8073","0.0011","12.8073","0.0011","11.5663","0.0014","90","","90","","120","","1643","0.3","300","","300","","","","","","","","","5","P 63/m","-P 6c","176","","C30H30Cl6GdTi3","","- C30 H30 Cl6 Gd Ti3 -","- C30 H30 Cl6 Gd Ti3 -","- C60 H60 Cl12 Gd2 Ti6 -","2","0.166667","","Jiang, Ningxin; Nakritskaia, Daria D.; Xie, Jiaze; Ramanathan, Arun; Varganov, Sergey A.; La Pierre, Henry S.","Tuning symmetry and magnetic blocking of an exchange-coupled lanthanide ion in isomeric, tetrametallic complexes: [LnCl<sub>6</sub>(TiCp<sub>2</sub>)<sub>3</sub>].","Chemical science","2023","14","16","4302","4307","10.1039/d2sc06263a","","x-ray","0.71073","MoKα","","0.0425","0.0356","","","0.0827","0.0889","","","","","","1.14","","","","has coordinates,has disorder","283166","2023-05-05","01:05:22",""
"1568692","12.7237","0.0004","12.7237","0.0004","11.3427","0.0005","90","","90","","120","","1590.28","0.1","100.15","","100.15","","","","","","","","","5","P 63/m","-P 6c","176","","C30H30Cl6TbCl3","","- C30 H30 Cl6 Tb Ti3 -","- C30 H30 Cl6 Tb Ti3 -","- C60 H60 Cl12 Tb2 Ti6 -","2","0.166667","","Jiang, Ningxin; Nakritskaia, Daria D.; Xie, Jiaze; Ramanathan, Arun; Varganov, Sergey A.; La Pierre, Henry S.","Tuning symmetry and magnetic blocking of an exchange-coupled lanthanide ion in isomeric, tetrametallic complexes: [LnCl<sub>6</sub>(TiCp<sub>2</sub>)<sub>3</sub>].","Chemical science","2023","14","16","4302","4307","10.1039/d2sc06263a","","x-ray","0.71073","MoKα","","0.0317","0.0311","","","0.0776","0.0782","","","","","","1.042","","","","has coordinates,has disorder","283166","2023-05-05","01:05:23",""
"1568694","12.8107","0.0018","12.8107","0.0018","11.571","0.002","90","","90","","120","","1644.6","0.4","300","","300","","","","","","","","","5","P 63/m","-P 6c","176","","C30H30Cl6Ti3Tb","","- C30 H30 Cl6 Tb Ti3 -","- C30 H30 Cl6 Tb Ti3 -","- C60 H60 Cl12 Tb2 Ti6 -","2","0.166667","","Jiang, Ningxin; Nakritskaia, Daria D.; Xie, Jiaze; Ramanathan, Arun; Varganov, Sergey A.; La Pierre, Henry S.","Tuning symmetry and magnetic blocking of an exchange-coupled lanthanide ion in isomeric, tetrametallic complexes: [LnCl<sub>6</sub>(TiCp<sub>2</sub>)<sub>3</sub>].","Chemical science","2023","14","16","4302","4307","10.1039/d2sc06263a","","x-ray","0.71073","MoKα","","0.0413","0.0338","","","0.083","0.09","","","","","","1.103","","","","has coordinates,has disorder","283166","2023-05-05","01:05:23",""
"1568695","12.7286","0.0004","12.7286","0.0004","11.3424","0.0005","90","","90","","120","","1591.46","0.1","100","","100","","","","","","","","","5","P 63/m","-P 6c","176","","C30H30Cl6GdTi3","","- C30 H30 Cl6 Gd Ti3 -","- C30 H30 Cl6 Gd Ti3 -","- C60 H60 Cl12 Gd2 Ti6 -","2","0.166667","","Jiang, Ningxin; Nakritskaia, Daria D.; Xie, Jiaze; Ramanathan, Arun; Varganov, Sergey A.; La Pierre, Henry S.","Tuning symmetry and magnetic blocking of an exchange-coupled lanthanide ion in isomeric, tetrametallic complexes: [LnCl<sub>6</sub>(TiCp<sub>2</sub>)<sub>3</sub>].","Chemical science","2023","14","16","4302","4307","10.1039/d2sc06263a","","x-ray","0.71073","MoKα","","0.0326","0.0305","","","0.0735","0.0742","","","","","","1.037","","","","has coordinates,has disorder","283166","2023-05-05","01:05:23",""
"2001605","9.118","0.001","9.118","0.001","3.3035","0.0009","90","","90","","120","","237.85","0.07","295","","","","","","","","","","","2","P 63/m","-P 6c","","","","","- S4 V3 -","- S4 V3 -","- S8 V6 -","2","0.166667","SH1019","Bensch, W.; Koy, J.","Structure of hexagonal V~3~S~4~ determined at three different temperatures","Acta Crystallographica Section C","1993","49","6","1133","1135","10.1107/S0108270192012368","","","0.71073","MoKα","","","0.028","","","0.0233","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001606","9.104","0.002","9.104","0.002","3.2973","0.0008","90","","90","","120","","236.68","0.09","170","","","","","","","","","","","2","P 63/m","-P 6c","","","","","- S4 V3 -","- S4 V3 -","- S8 V6 -","2","0.166667","SH1019","Bensch, W.; Koy, J.","Structure of hexagonal V~3~S~4~ determined at three different temperatures","Acta Crystallographica Section C","1993","49","6","1133","1135","10.1107/S0108270192012368","","","0.71073","MoKα","","","0.0294","","","0.0237","","","","","1.19","1.19","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2001607","9.099","0.001","9.099","0.001","3.297","0.0008","90","","90","","120","","236.39","0.07","100","","","","","","","","","","","2","P 63/m","-P 6c","","","","","- S4 V3 -","- S4 V3 -","- S8 V6 -","2","0.166667","SH1019","Bensch, W.; Koy, J.","Structure of hexagonal V~3~S~4~ determined at three different temperatures","Acta Crystallographica Section C","1993","49","6","1133","1135","10.1107/S0108270192012368","","","0.71073","MoKα","","","0.0298","","","0.0213","","","","","1.21","1.21","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002195","9.659","","9.659","","3.136","","90","","90","","120","","253.4","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Strontium calcium scandium oxide (0.3/0.7/2/4)","","- Ca0.67 O4 Sc2 Sr0.33 -","- Ca0.666667 O4 Sc2 Sr0.333333 -","- Ca2 O12 Sc6 Sr -","3","0.25","","Mueller-Buschbaum, Hk; Muschick, W","Ein neuer Bautyp Sr Ca2 Sc6 O12","Zeitschrift fuer Anorganische und Allgemeine Chemie","1975","412","","209","214","10.1002/zaac.19754120304","","","","","","0.044","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002253","10.299","","10.299","","3.409","","90","","90","","120","","313.1","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Barium distrontium hexayttrium oxide","","- Ba O12 Sr2 Y6 -","- Ba O12 Sr2 Y6 -","- Ba O12 Sr2 Y6 -","1","0.0833333","","Schulze, A R; Mueller-Buschbaum, Hk","About compounds in systems Me O:M2 O3. V. New metastable compounds: Ba Sr2 Y6 O12, Ba Sr2 Er6 O12 and Ba Sr2 Tm6 O12","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1981","36","","837","839","","","","","","","0.08","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002254","10.277","","10.277","","3.385","","90","","90","","120","","309.6","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Barium distrontium hexaerbium oxide","","- Ba Er6 O12 Sr2 -","- Ba Er6 O12 Sr2 -","- Ba Er6 O12 Sr2 -","1","0.0833333","","Schulze, A R; Mueller-Buschbaum, Hk","About compounds in systems Me O:M2 O3. V. New metastable compounds: Ba Sr2 Y6 O12, Ba Sr2 Er6 O12 and Ba Sr2 Tm6 O12","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1981","36","","837","839","","","","","","","0.09","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002255","10.215","","10.215","","3.376","","90","","90","","120","","305.1","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Barium distrontium hexathulium oxide","","- Ba O12 Sr2 Tm6 -","- Ba O12 Sr2 Tm6 -","- Ba O12 Sr2 Tm6 -","1","0.0833333","","Schulze, A R; Mueller-Buschbaum, Hk","About compounds in systems Me O:M2 O3. V. New metastable compounds: Ba Sr2 Y6 O12, Ba Sr2 Er6 O12 and Ba Sr2 Tm6 O12","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1981","36","","837","839","","","","","","","0.08","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002291","7.75","","7.75","","2.98","","90","","90","","120","","155","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Beryllium digallium oxide","","- Be Ga2 O4 -","- Be0.9999 Ga1.9998 O4 -","- Be1.9998 Ga3.9996 O8 -","2","0.166667","","Schweizer, M; Mueller-Buschbaum, Hk","Zur Verbindungsbildung von Me O: M2 O3, Teil III. Zur Kenntnis von Be Ga2 O4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1979","34","","1067","1069","","","","","","","0.066","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002303","17.59999","","17.59999","","3.35","","90","","90","","120","","898.7","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Barium strontium calcium thulium oxide (1/1/1/22/36)","","- Ba Ca O36 Sr Tm22 -","- Ba0.999 Ca0.9998 O36 Sr0.999 Tm21.9996 -","- Ba0.999 Ca0.9998 O36 Sr0.999 Tm21.9996 -","1","0.0833333","","Krueger, J; Mueller-Buschbaum, Hk","Ba Sr Ca Tm22 O36, eine metastabile Verbindung mit partiell hoher Unordnung","Zeitschrift fuer Anorganische und Allgemeine Chemie","1982","494","","103","108","10.1002/zaac.19824940113","","","","","","0.09","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002349","17.59999","0.06","17.59999","","3.33","0.04","90","","90","","120","","893.3","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Barium strontium lutetium oxide (2/1/22/36)","","- Ba2 Lu22 O36 Sr -","- Ba2 Lu22.02 O36 Sr -","- Ba2 Lu22.02 O36 Sr -","1","0.0833333","","Krueger, J; Mueller-Buschbaum, Hk","Ein neues metastabiles Oxometallat mit Tunnelstruktur: Ba2 Sr Lu22 O36","Zeitschrift fuer Anorganische und Allgemeine Chemie","1985","526","","60","66","10.1002/zaac.19855260709","","","","","","0.1","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002387","10.2213","0.0007","10.2213","0.0007","3.3614","0.0005","90","","90","","120","","304.1","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Barium dicalcium hexayttrium oxide","","- Ba Ca2 O12 Y6 -","- Ba Ca2 O12 Y6 -","- Ba Ca2 O12 Y6 -","1","0.0833333","","Schroeder, F; Mueller-Buschbaum, Hk","Neue metastabile Oxolanthanoide: Ba Ca2 Y6 O12 und Ca0.33 Mg Y2.67 O5.33 (=Ca Mg3 Y8 O16)","Journal of the Less-Common Metals","1986","116","","211","218","10.1016/0022-5088(86)90230-4","","","","","","0.092","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002404","9.88","0.003","9.88","0.003","3.211","0.004","90","","90","","120","","271.4","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Barium dicalcium tecto-hexaindate","","- Ba Ca2 In6 O12 -","- Ba Ca2 In6 O12 -","- Ba Ca2 In6 O12 -","1","0.0833333","","Lalla, A; Mueller-Buschbaum, Hk","Zwei neue Erdalkalimetall-Oxoindate: Ba Ca2 In6 O12 und Ba Sr2 In6 O12.","Zeitschrift fuer Anorganische und Allgemeine Chemie","1988","563","","11","15","10.1002/zaac.19885630103","","","","","","0.077","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002405","9.9443","0.0002","9.9443","0.0002","3.2671","0.0002","90","","90","","120","","279.8","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Barium distrontium tecto-hexaindate","","- Ba In6 O12 Sr2 -","- Ba In6 O12 Sr2 -","- Ba In6 O12 Sr2 -","1","0.0833333","","Lalla, A; Mueller-Buschbaum, Hk","Zwei neue Erdalkalimetall-Oxoindate: Ba Ca2 In6 O12 und Ba Sr2 In6 O12.","Zeitschrift fuer Anorganische und Allgemeine Chemie","1988","563","","11","15","10.1002/zaac.19885630103","","","","","","0.061","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002560","5.9072","0.0084","5.9072","0.0084","14.6","0.068","90","","90","","120","","441.2","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Barium calcium strontium ruthenium oxide (3/0.8/0.2/2/9)","","- Ba3 Ca0.8 O9 Ru2 Sr0.2 -","- Ba3 Ca0.8 O9 Ru2 Sr0.2 -","- Ba6 Ca1.6 O18 Ru4 Sr0.4 -","2","0.166667","","Schlueter, D; Mueller-Buschbaum, Hk","Ein Beitrg ueber Ba3 Ca0.8 Sr0.2 Ru2 O9","Journal of Alloys Compd.","1993","190","","L43","L44","10.1016/0925-8388(93)90388-4","","","","","","0.097","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002736","9.4986","0.0009","9.4986","0.0009","6.9436","0.0015","90","","90","","120","","542.5","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Tetraneodymium manganese tris(silicate) oxide","","- Mn Nd4 O13 Si3 -","- Mn Nd4 O13 Si3 -","- Mn2 Nd8 O26 Si6 -","2","0.166667","","Kluever, E; Mueller-Buschbaum, Hk","Ueber einen Lanthanoid-Mangan-Apatit: Nd4 Mn (Si O4)3 O","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1995","50","","61","65","","","","","","","0.0632","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002767","9.7895","0.0013","9.7895","0.0013","6.2021","0.001","90","","90","","120","","514.7","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Copper manganese uranium molybdenum oxide (0.5/0.5/1/3/12)","","- Cu0.5 Mn0.5 Mo3 O12 U -","- Cu0.5 Mn0.5 Mo3 O12 U -","- Cu Mn Mo6 O24 U2 -","2","0.166667","","Sedello, O; Mueller-Buschbaum, Hk","Zur Kristallstruktur von (Cu, Mn) U Mo3 O12","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1996","51","","450","452","","","","","","","0.0666","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002931","17.674","0.003","17.674","0.003","12.516","0.003","90","","90","","120","","3385.8","1.1","","","","","","","","","","","","3","P 63/m","-P 6c","","","","","- Al177 Cr49 Ni -","- Al182 Cr52 Ni4 -","- Al182 Cr52 Ni4 -","1","0.0833333","BK0060","Marsh, R. E.","Concerning the κ Phase of Al‒Cr‒Ni","Acta Crystallographica Section B","1998","54","6","925","926","10.1107/S0108768198007393","","","0.71073","MoKα","","","0.041","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003097","9.567","0.001","9.567","0.001","20.754","0.002","90","","90","","120","","1645.1","0.3","293","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca15 I O37 P9 -","- Ca15 I1.048 O36.98 P9 -","- Ca30 I2.096 O73.96 P18 -","2","0.166667","OS0009","Alberius Henning, Peter; Lidin, Sven; Petříček, Vačlav","Iodo-oxyapatite, the first example from a new class of modulated apatites","Acta Crystallographica Section B","1999","55","2","165","169","10.1107/S0108768198012312","","","0.7107","MoKα","","0.0937","0.0452","","0.0545","0.0459","","","","1.01","1.29","1.29","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003332","10.0077","0.0006","10.0077","0.0006","7.4342","0.0008","90","","90","","120","","644.81","0.09","295","2","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- F O12 Sr5 V3 -","- F0.98 Nd0.061 O12 Sr4.909 V2.916 -","- F1.96 Nd0.122 O24 Sr9.818 V5.832 -","2","0.166667","DU1084","Corker, D. L.; Chai, B. H. T.; Nicholls, J.; Loutts, G. B.","Neodymium-Doped Sr~5~(PO~4~)~3~F and Sr~5~(VO~4~)~3~F","Acta Crystallographica Section C","1995","51","4","549","551","10.1107/S0108270194006906","","","0.71069","MoKα","","","0.022","","","0.027","","","","","0.87","0.87","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003333","9.7156","0.0004","9.7156","0.0004","7.281","0.0003","90","","90","","120","","595.2","0.04","295","2","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- F O12 P3 Sr5 -","- F Nd0.027 O12 P2.925 Sr4.959 -","- F2 Nd0.054 O24 P5.85 Sr9.918 -","2","0.166667","DU1084","Corker, D. L.; Chai, B. H. T.; Nicholls, J.; Loutts, G. B.","Neodymium-Doped Sr~5~(PO~4~)~3~F and Sr~5~(VO~4~)~3~F","Acta Crystallographica Section C","1995","51","4","549","551","10.1107/S0108270194006906","","","0.71069","MoKα","","","0.023","","","0.029","","","","","0.84","0.84","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003986","9.566","0.001","9.566","0.001","12.042","0.002","90","","90","","120","","954.3","0.2","291","","","","","","","","","","crystallized from hexane","6","P 63/m","-P 6c","176","","","","- C11 H15 Cl Fe2 O6 Si3 -","- C9 Cl3 Fe2 O6 Si3 -","- C18 Cl6 Fe4 O12 Si6 -","2","0.166667","BK1089","Simons, R. S.; Tessier, C. A.","Diiron Complex with Three Bridging Silyl Substituents","Acta Crystallographica Section C","1995","51","10","1997","1998","10.1107/S0108270195002873","","","0.71073","MoKα","","","0.0351","","","0.0429","","","","","1.44","1.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2004287","19.34","0.04","19.34","0.04","25.688","0.016","90","","90","","120","","8321","2","120","1","120","1","","","","","","","","5","P 63/m","-P 6c","176","Terbium(III)cerium(IV)hydrogen sulphate hydrate","","","- Ce6 H153.66 O180.45 S27 Tb7 -","- Ce6 O181.72 S27 Tb7 -","- Ce12 O363.44 S54 Tb14 -","2","0.166667","LI1136","Barnes, J. C.","An Acid Terbium(III) Cerium(IV) Sulfate Hydrate, H~9~Tb~7~Ce~6~(SO~4~)~27~.72.2H~2~O","Acta Crystallographica Section C","1995","51","12","2466","2469","10.1107/S0108270195009267","","","0.71069","MoKα","","0.0953","0.0692","","0.1874","0.1631","","","","1.02","1.101","1.101","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2004703","8.2508","0.0006","8.2508","0.0006","18.745","0.002","90","","90","","120","","1105.12","0.16","293","2","","","","","","","","","","7","P 63/m","-P 6c","","","","","- C6 H10 Bi La N6 O5 S6 -","- C6 H6 Bi La N6 O5 S6 -","- C12 H12 Bi2 La2 N12 O10 S12 -","2","0.166667","BR1118","Maniukiewicz, W.; Sieron, L.; Bukowska-Strzyzewska, M.; Turek, A.","Triaquahexathiocyanatobismuthlanthanum Dihydrate, [Bi(SCN)~6~La(H~2~O)~3~].2H~2~O, and Triaquahexathiocyanatobismuthneodymium Dihydrate, [Bi(SCN)~6~Nd(H~2~O)~3~].2H~2~O","Acta Crystallographica Section C","1996","52","4","753","757","10.1107/S0108270195013801","","","0.71073","MoKα","","0.0329","0.0277","","0.0593","0.0537","","","","1.162","1.172","1.172","","","","","has coordinates","208743","2020-10-21","18:00:00",""
"2004704","8.2","0.002","8.2","0.002","18.606","0.003","90","","90","","120","","1083.5","0.4","293","2","","","","","","","","","","7","P 63/m","-P 6c","","","","","- C6 H10 Bi N6 Nd O5 S6 -","- C6 H6 Bi N6 Nd O5 S6 -","- C12 H12 Bi2 N12 Nd2 O10 S12 -","2","0.166667","BR1118","Maniukiewicz, W.; Sieron, L.; Bukowska-Strzyzewska, M.; Turek, A.","Triaquahexathiocyanatobismuthlanthanum Dihydrate, [Bi(SCN)~6~La(H~2~O)~3~].2H~2~O, and Triaquahexathiocyanatobismuthneodymium Dihydrate, [Bi(SCN)~6~Nd(H~2~O)~3~].2H~2~O","Acta Crystallographica Section C","1996","52","4","753","757","10.1107/S0108270195013801","","","0.71073","MoKα","","0.0567","0.0464","","0.141","0.1199","","","","1.071","1.078","1.078","","","","","has coordinates","208743","2020-10-21","18:00:00",""
"2005743","10.076","0.001","10.076","0.001","6.807","0.001","90","","90","","120","","598.4","0.2","296","2","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- As3 Ca5 Cl O12 -","- As3 Ca5 Cl O12 -","- As6 Ca10 Cl2 O24 -","2","0.166667","","","Chlorapatite: Ca~5~(AsO~4~)~3~Cl","Acta Crystallographica C","1996","52","","2959","2960","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2006222","9.1599","0.0013","9.1599","0.0013","5.445","0.003","90","","90","","120","","395.6","0.2","143","2","143","2","","","","","","","","3","P 63/m","-P 6c","176","","2,4,6-Tris(diazo)-cyclohexane-1,3,5-trione","","- C6 N6 O3 -","- C6 N6 O3 -","- C12 N12 O6 -","2","0.166667","FG1274","Jones, Peter G.; Ahrens, Birte; Höpfner, Thomas; Hopf, Henning","2,4,6-Tris(diazo)cyclohexane-1,3,5-trione","Acta Crystallographica Section C","1997","53","6","783","786","10.1107/S0108270197002114","","","0.71073","MoKα","","0.0306","0.0291","","0.0933","0.0885","","","","1.184","1.196","1.196","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2006738","9.3529","0.0008","9.3529","0.0008","29.292","0.004","90","","90","","120","","2219.1","0.4","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Cs5 Mo21 S23 -","- Cs5 Mo21 S23 -","- Cs10 Mo42 S46 -","2","0.166667","TA1146","Picard, S.; Gougeon, P.; Potel, M.","Cs~5~Mo~21~S~23~","Acta Crystallographica Section C","1997","53","11","1519","1521","10.1107/S010827019700752X","","","0.71073","MoKα","","0.0669","0.0284","","0.0912","0.0881","","","","1.107","1.278","1.278","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2007492","9.3938","0.0008","9.3938","0.0008","6.9013","0.0005","90","","90","","120","","527.4","0.07","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","britholite","","","- Ca9 F1.5 Nd O24.25 P5 Si -","- Ca9 F1.54 Nd O24.28 P5.1 Si0.9 -","- Ca9 F1.54 Nd O24.28 P5.1 Si0.9 -","1","0.0833333","","Laurent Boyer; Jean-Michel Savariault; Joëlle Carpena; Jean-Louis Lacout","Neodymium-Substituted Britholite Compound","Acta Crystallographica Section C","1998","54","","1057","1059","","","","","","","","0.0346","","","0.0924","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2007875","9.0124","0.0011","9.0124","0.0011","21.08","0.006","90","","90","","120","","1482.8","0.5","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","Hexakis(imidazole-N^3^)nickel(II) carbonate pentahydrate.","","- C19 H34 N12 Ni O8 -","- C19 H31.98 N12 Ni O8 -","- C38 H63.96 N24 Ni2 O16 -","2","0.166667","BK1383","Povse, Vicente; Perec, Mireille; Baggio, Ricardo; Garland, Maria Teresa","Hexakis(imidazole-<i>N</i>^3^)nickel(II) Carbonate Pentahydrate","Acta Crystallographica Section C","1998","54","12","1817","1820","10.1107/S0108270198007409","","","0.71073","MoKα","","0.081","0.038","","0.112","0.091","","","","1.02","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008226","10.422","0.005","10.422","0.005","7.467","0.003","90","","90","","120","","702.4","0.6","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","pentalead tris(vanadate) iodide","","","- I1.7 O24 Pb9.85 V6 -","- I1.704 O24 Pb9.844 V6 -","- I1.704 O24 Pb9.844 V6 -","1","0.0833333","BR1208","Fabienne Audubert; Jean-Michel Savariault; Jean-Louis Lacout","Pentalead tris(vanadate) iodide, a defect vanadinite-type compound","Acta Crystallographica Section C","1999","55","3","271","273","10.1107/S0108270198005034","","","0.71073","MoKα","","0.0526","0.0364","","","0.0783","0.0705","","","","","","0.834","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009061","19.75","0.003","19.75","0.003","12.24","0.002","90","","90","","120","","4134.7","1.1","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","Hexa-tetraethylammonium di-υ~3~iodo-triυ~4~-iodohexkis(iodosilver(I)), (Et~4~N)~6~[Ag~6~I~11~]I","","- C48 H120 Ag6 I12 N6 -","- C48 H120 Ag6 I12 N6 -","- C96 H240 Ag12 I24 N12 -","2","0.166667","QA0172","Zhao, Yingjun; Su, Weiping; Cao, Rong; Hong, Maochun","Hexakis(tetraethylammonium) tri-μ~4~-iodo-di-μ~3~-iodo-hexakis[iodosilver(I)] iodide, (Et~4~ N)~6~[Ag~6~I~11~]I","Acta Crystallographica Section C","1999","55","10","IUC9900122","","10.1107/S0108270199098765","","","0.71073","MoKα","","0.046","0.035","","0.094","","0.092","","","1.139","","","1.224","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2009601","7.858","0.001","7.858","0.001","7.086","0.001","90","","90","","120","","378.93","0.09","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","","Aluminium hydrogen phosphite","","- Al2 H3 O9 P3 -","- Al2 H3 O9 P3 -","- Al4 H6 O18 P6 -","2","0.166667","CR1025","Morris, Russell E.; Attfield, Martin P.; Cheetham, Anthony K.","Synthesis and structures of two isostructural phosphites, Al~2~(HPO~3~)~3~ and Ga~2~(HPO~3~)~3~","Acta Crystallographica Section C","1994","50","4","473","476","10.1107/S0108270193009217","","","0.71069","MoKα","","0.0177","","","0.0185","","","","","","","","","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2009602","7.91382","0.00006","7.91382","0.00006","7.24062","0.00007","90","","90","","120","","392.716","0.006","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Gallium hydrogen phosphite","","- Ga2 H3 O9 P3 -","- Ga2 H3 O9 P3 -","- Ga4 H6 O18 P6 -","2","0.166667","CR1025","Morris, Russell E.; Attfield, Martin P.; Cheetham, Anthony K.","Synthesis and structures of two isostructural phosphites, Al~2~(HPO~3~)~3~ and Ga~2~(HPO~3~)~3~","Acta Crystallographica Section C","1994","50","4","473","476","10.1107/S0108270193009217","","","1.54178","","","","","","","","","","","","","","","","","","has coordinates","190398","2020-10-21","18:00:00",""
"2010820","8.898","0.002","8.898","0.002","6.947","0.002","90","","90","","120","","476.3","0.2","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","SSS","2,4,6-Tris(methylthio)-1,3,5-triazine","","- C6 H9 N3 S3 -","- C6 H9 N3 S3 -","- C12 H18 N6 S6 -","2","0.166667","JZ1377","Greenberg, Mark; Shteiman, Vitaly; Kaftory, Menahem","2,4,6-Tris(methylthio)-1,3,5-triazine, 3-methyl-4,6-bis(methylthio)-1,3,5-triazine-2(3<i>H</i>)-thione, 1,3-dimethyl-4-methylthio-1,3,5-triazine-2,6(1<i>H</i>,3<i>H</i>)-dithione and 1,3,5-trimethyl-1,3,5-triazine-2,4,6(1<i>H</i>,3<i>H</i>,5<i>H</i>)-trithione","Acta Crystallographica Section C","2000","56","4","465","468","10.1107/S0108270100000214","","","0.7107","MoKα","","0.0641","0.0337","","","","0.0879","","","","","","1.029","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2012036","9.5208","0.0001","9.5208","0.0001","37.5113","0.0005","90","","90","","120","","2944.69","0.06","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","pentarubidium heptacosamolybdenum hentriacontaselenium","","- Mo27 Rb5 Se31 -","- Mo27 Rb5 Se31 -","- Mo54 Rb10 Se62 -","2","0.166667","JZ1447","Picard, S.; Gougeon, P.; Potel, M.","Rb~5~Mo~27~Se~31~, a novel ternary reduced molybdenum selenide containing Mo~12~ and Mo~15~ clusters","Acta Crystallographica Section C","2001","57","6","663","664","10.1107/S0108270101003389","","","0.71069","MoKα","","0.127","0.047","","","","0.12","","","","","","1.052","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2013224","7.549","0.001","7.549","0.001","8.097","0.001","90","","90","","120","","399.61","0.09","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","Lithium aluminium silicide (15/3/6)","","- Al3.39 Li14.61 Si6 -","- Al3.386 Li14.614 Si6 -","- Al3.386 Li14.614 Si6 -","1","0.0833333","TA1397","Spina, Laurent; Tillard, Monique; Belin, Claude","Li~15~Al~3~Si~6~ (Li~14.6~Al~3.4~Si~6~), a compound displaying a heterographite-like anionic framework","Acta Crystallographica Section C","2003","59","2","i9","i10","10.1107/S0108270102022680","","","0.71073","MoKα","","0.064","0.036","","","0.035","0.049","","","","","","1.1","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2013239","7.117","0.005","7.117","0.005","10.542","0.009","90","","90","","120","","462.4","0.6","298","2","298","2","","","","","","","","4","P 63/m","-P 6c","176","FDZG-2","diammonium zirconium getmanate","","- Ge3 N2 O9 Zr -","- Ge3 N2 O9 Zr -","- Ge6 N4 O18 Zr2 -","2","0.166667","BC1005","Zhicheng Liu; Linhong Weng; Zhenxia Chen; Dongyuan Zhao","(NH~4~)~2~ZrGe~3~O~9~: a new microporous zirconogermanate","Acta Crystallographica Section C","2003","59","5","i29","i31","10.1107/S0108270103005353","","","0.71073","MoKα","","0.0763","0.0524","","","0.1025","0.1098","","","","","","1.126","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2013656","9.3376","0.0014","9.3376","0.0014","6.7321","0.001","90","","90","","120","","508.34","0.13","295","1","295","1","","","","","","","","4","P 63/m","-P 6c","176","","","","- Li O26 Si6 Y9 -","- Li O26 Si6 Y9 -","- Li O26 Si6 Y9 -","1","0.0833333","LN1182","Redhammer, Günther R.; Roth, G.","Lithium and sodium yttrium orthosilicate oxyapatite, LiY~9~(SiO~4~)~6~O~2~ and NaY~9~(SiO~4~)~6~O~2~, at both 100K and near room temperature","Acta Crystallographica Section C","2003","59","12","i120","i124","10.1107/S0108270103023321","","","0.71073","MoKα","","","0.0312","","","","0.0542","","","","","","1.067","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2013657","9.3108","0.0014","9.3108","0.0014","6.7088","0.001","90","","90","","120","","503.67","0.13","100","1","100","1","","","","","","","","4","P 63/m","-P 6c","176","","","","- Li O26 Si6 Y9 -","- Li O26 Si6 Y9 -","- Li O26 Si6 Y9 -","1","0.0833333","LN1182","Redhammer, Günther R.; Roth, G.","Lithium and sodium yttrium orthosilicate oxyapatite, LiY~9~(SiO~4~)~6~O~2~ and NaY~9~(SiO~4~)~6~O~2~, at both 100K and near room temperature","Acta Crystallographica Section C","2003","59","12","i120","i124","10.1107/S0108270103023321","","","0.71073","MoKα","","","0.0242","","","","0.0412","","","","","","1.158","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2013658","9.3386","0.001","9.3386","0.001","6.7589","0.0008","90","","90","","120","","510.47","0.1","270","1","270","1","","","","","","","","4","P 63/m","-P 6c","176","","","","- Na O26 Si6 Y9 -","- Na O26 Si6 Y9 -","- Na O26 Si6 Y9 -","1","0.0833333","LN1182","Redhammer, Günther R.; Roth, G.","Lithium and sodium yttrium orthosilicate oxyapatite, LiY~9~(SiO~4~)~6~O~2~ and NaY~9~(SiO~4~)~6~O~2~, at both 100K and near room temperature","Acta Crystallographica Section C","2003","59","12","i120","i124","10.1107/S0108270103023321","","","0.71073","MoKα","","","0.0352","","","","0.0532","","","","","","1.203","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2013659","9.3274","0.001","9.3274","0.001","6.7554","0.0007","90","","90","","120","","508.98","0.09","100","1","100","1","","","","","","","","4","P 63/m","-P 6c","176","","","","- Na O26 Si6 Y9 -","- Na O26 Si6 Y9 -","- Na O26 Si6 Y9 -","1","0.0833333","LN1182","Redhammer, Günther R.; Roth, G.","Lithium and sodium yttrium orthosilicate oxyapatite, LiY~9~(SiO~4~)~6~O~2~ and NaY~9~(SiO~4~)~6~O~2~, at both 100K and near room temperature","Acta Crystallographica Section C","2003","59","12","i120","i124","10.1107/S0108270103023321","","","0.71073","MoKα","","","0.0356","","","","0.0566","","","","","","1.204","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2013840","9.5953","0.0006","9.5953","0.0006","7.0418","0.0004","90","","90","","120","","561.48","0.06","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","lead bismuth calcium sodium phosphate","Pb~4.6~Bi~0.4~Ca~2.6~Na~2.4~(PO~4~)~6~.","","- Bi0.4 Ca2.59 Na2.39 O24 P6 Pb4.61 -","- Bi0.402 Ca2.592 Na2.388 O24 P6 Pb4.614 -","- Bi0.402 Ca2.592 Na2.388 O24 P6 Pb4.614 -","1","0.0833333","SK1662","Besma Hamdi; Jean-Michel Savariault; Hafed El Feki; Abdelhamid Ben Salah","Lead bismuth calcium sodium phosphate: Pb~4.6~Bi~0.4~Ca~2.6~Na~2.4~(PO~4~)~6~","Acta Crystallographica Section C","2004","60","1","i1","i2","10.1107/S0108270103024971","","","0.71073","MoKα","","0.0893","0.0411","","","0.0656","0.0747","","","","","","1.036","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2014093","10.2148","0.0014","10.2148","0.0014","7.174","0.0014","90","","90","","120","","648.26","0.18","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","catena-Poly[1,4-diazonia[2.2.2]octane [silver(I)-tri-μ-thiocyanato-κ^6^S:S]]","","- C9 H14 Ag N5 S3 -","- C9 H14 Ag N5 S3 -","- C18 H28 Ag2 N10 S6 -","2","0.166667","AV1193","Liu, Zhao-Di; Zou, Ying; Tan, Min-Yu; Zhu, Hai-Liang","<i>catena</i>-Poly[1,4-diazoniabicyclo[2.2.2]octane [silver(I)-tri-μ-thiocyanato-κ^6^<i>S</i>:<i>S</i>]]","Acta Crystallographica Section C","2004","60","9","m447","m448","10.1107/S010827010401772X","","","0.71073","MoKα","","0.0683","0.0668","","","0.1667","0.1677","","","","","","1.061","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016782","9.99","0.001","9.99","0.001","7.395","0.001","90","","90","","120","","639.15","0.13","294","2","294","2","","","","","","","","4","P 63/m","-P 6c","176","Strontium fluorarsenate","strontium arsenate fluoride","","- As3 F O12 Sr5 -","- As3 F O12 Sr5 -","- As6 F2 O24 Sr10 -","2","0.166667","SQ3149","Dordević, Tamara; Šutović, Sabina; Stojanović, Jovica; Karanović, Ljiljana","Sr, Ba and Cd arsenates with the apatite-type structure","Acta Crystallographica Section C","2008","64","9","i82","i86","10.1107/S0108270108023457","","","0.71073","MoKα","","0.0177","0.0165","","","0.0366","0.0371","","","","","","1.224","","","","has coordinates,has Fobs","282534","2023-04-10","15:44:47",""
"2016783","10.39","0.001","10.39","0.001","7.575","0.002","90","","90","","120","","708.2","0.2","294","2","294","2","","","","","","","","5","P 63/m","-P 6c","176","Barium strontium chlorarsenate","strontium barium arsenate chloride","","- As3 Ba2.95 Cl O12 Sr2.05 -","- As3 Ba2.951 Cl O12 Sr2.047 -","- As6 Ba5.902 Cl2 O24 Sr4.094 -","2","0.166667","SQ3149","Dordević, Tamara; Šutović, Sabina; Stojanović, Jovica; Karanović, Ljiljana","Sr, Ba and Cd arsenates with the apatite-type structure","Acta Crystallographica Section C","2008","64","9","i82","i86","10.1107/S0108270108023457","","","0.71069","MoKα","","0.0228","0.02","","","0.0482","0.0493","","","","","","1.111","","","","has coordinates,has Fobs","282534","2023-04-10","15:44:48",""
"2016784","9.971","0.001","9.971","0.001","6.514","0.001","90","","90","","120","","560.86","0.12","294","2","294","2","","","","","","","","5","P 63/m","-P 6c","176","Cadmium Chlorarsenate","cadmium arsenate hydroxide chloride","","- As6 Cd10 Cl1.16 H0.84 O24.84 -","- As6 Cd10 Cl1.16 H0.84 O24.84 -","- As6 Cd10 Cl1.16 H0.84 O24.84 -","1","0.0833333","SQ3149","Dordević, Tamara; Šutović, Sabina; Stojanović, Jovica; Karanović, Ljiljana","Sr, Ba and Cd arsenates with the apatite-type structure","Acta Crystallographica Section C","2008","64","9","i82","i86","10.1107/S0108270108023457","","","0.71073","MoKα","","0.0179","0.0176","","","0.0369","0.037","","","","","","1.298","","","","has coordinates,has Fobs","282534","2023-04-10","15:44:48",""
"2016908","19.165","0.003","19.165","0.003","25.06","0.004","90","","90","","120","","7971","2","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","acid neodymium(III)cerium(IV)sulphate hydrate","","","- Ce12 H307.33 Nd14 O360.55 S54 -","- Ce6 Nd7 O180.32 S27 -","- Ce12 Nd14 O360.64 S54 -","2","0.166667","LI1068","Barnes, J. C.; Paton, J. D.; Seaward, K. F.","Structure of an acid neodymium(III) cerium(IV) sulfate hydrate, H~9~Nd~7~Ce~6~(SO~4~)~27~.72.33H~2~O","Acta Crystallographica Section C","1993","49","12","2057","2060","10.1107/S0108270193006171","","","0.71069","MoKα","","0.051","0.0378","","0.1458","0.1156","","","","0.601","0.598","0.598","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2017537","21.7568","0.0003","21.7568","0.0003","23.3983","0.0006","90","","90","","120","","9591.9","0.3","173","2","173","2","","","","","","","","7","P 63/m","-P 6c","176","","Tris(<i>tert</i>-butyl isocyanide)bis[tris(4-methoxyphenyl)phosphine]cobalt(I) perchlorate dichloromethane disolvate","","- C59 H73 Cl5 Co N3 O10 P2 -","- C59 H74 Cl5 Co N3 O10 P2 -","- C354 H444 Cl30 Co6 N18 O60 P12 -","6","0.5","TR3058","Becker, Clifford A. L.; Black, Robert S.; Forbes, Roy P.","Tris(<i>tert</i>-butyl isocyanide)bis[tris(4-methoxyphenyl)phosphine]cobalt(I) perchlorate dichloromethane disolvate and tris(<i>tert</i>-butyl isocyanide)bis[tris(4-methoxyphenyl)phosphine]cobalt(II) bis(perchlorate) dichloromethane disolvate: modification of a trigonal‒bipyramidal structure with change of metal oxidation state","Acta Crystallographica Section C","2010","66","2","m40","m43","10.1107/S0108270109054626","","","0.71073","MoKα","","","0.0473","","","","0.152","","","","","","0.972","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2019970","14.8841","0.0001","14.8841","0.0001","3.685","0.0001","90","","90","","120","","706.99","0.02","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","Hexaerbium triacontacobalt enneakaidecasilicide","","- Co30 Er6 Si19 -","- Co30 Er6 Si19 -","- Co30 Er6 Si19 -","1","0.0833333","","Stetskiv, Andrij; Rozdzynska-Kielbik, Beata; Misztal, Renata; Pavlyuk, Volodymyr","Grown from lithium flux, the ErCo~5~Si~3.17~ silicide is a combination of disordered derivatives of the UCo~5~Si~3~ and Yb~6~Co~30~P~19~ structure types","Acta Crystallographica Section C","2015","71","6","506","510","10.1107/S2053229615009791","","","0.71073","MoKα","","0.0184","0.0163","","","0.0367","0.0376","","","","","","1.154","","","","has coordinates,has Fobs","137550","2020-10-21","18:00:00",""
"2020161","6.0704","","6.0704","","15.3758","","90","","90","","120","","490.685","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ba3 Sr Nb2 O9","","- Ba3 Nb2 O9 Sr -","- Ba3 Nb2 O9 Sr -","- Ba6 Nb4 O18 Sr2 -","2","0.166667","","Zandbergen, H.B.; Ijdo, D.J.W.","Barium strontium niobate and barium strontium tantalate, Ba3 Sr Nb2 O9 and Ba3 Sr Ta2 O9, a Rietveld refinement of neutron powder diffraction data","Acta Crystallographica C (39,1983-)","1983","39","","829","832","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2020162","6.0776","","6.0776","","15.336","","90","","90","","120","","490.577","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ba3 Sr Ta2 O9","","- Ba3 O9 Sr Ta2 -","- Ba3 O9 Sr Ta2 -","- Ba6 O18 Sr2 Ta4 -","2","0.166667","","Zandbergen, H.B.; Ijdo, D.J.W.","Barium Strontium Niobate and Barium Strontium Tantalate, Ba3 Sr Nb2 O9 and Ba3 Sr Ta2 O9, a Rietveld Refinement of Neutron Powder Diffraction Data","Acta Crystallographica C (39,1983-)","1983","39","","829","832","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2020183","7.277","","7.277","","9.656","","90","","90","","120","","442.826","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ba (Cl O4)2 (H2 O)3","","- Ba Cl2 H6 O11 -","- Ba Cl2 H6 O11 -","- Ba2 Cl4 H12 O22 -","2","0.166667","","Gallucci, J.C.; Gerkin, R.E.","Structure of barium perchlorate trihydrate","Acta Crystallographica C (39,1983-)","1988","44","","1873","1876","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2020188","9.4842","","9.4842","","21.006","","90","","90","","120","","1636.35","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Rb3 Mo15 Se17","","- Mo15 Rb3 Se17 -","- Mo15 Rb3 Se17 -","- Mo30 Rb6 Se34 -","2","0.166667","","Gougeon, P.; Potel, M.; Sergent, M.","Structure of Rb3Mo15Se17 Containing the New Mo15 Clusters","Acta Crystallographica C (39,1983-)","1989","45","","182","185","","","","","","","","","","","","","","","","","","","","","","has coordinates","166606","2020-10-21","18:00:00",""
"2020271","20.899","","20.899","","3.863","","90","","90","","120","","1461.19","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","K2 Tm23.33 S36","","- K2 S36 Tm23.33 -","- K2 S36 Tm23.334 -","- K2 S36 Tm23.334 -","1","0.0833333","","Lemoine, P.; Tomas, A.; Vovan, T.; Carre, D.; Guittard, M.","Structure du sulfure de thulium et de potassium K2 Tm23.33 S36","Acta Crystallographica C (39,1983-)","1989","45","","350","353","","","","","","","","","","","","","","","","","","","","","","has coordinates","169493","2020-10-21","18:00:00",""
"2020272","20.688","","20.688","","3.861","","90","","90","","120","","1431.09","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Yb18 In7.33 S36","","- In7.33 S36 Yb18 -","- In7.328 S36 Yb18.006 -","- In7.328 S36 Yb18.006 -","1","0.0833333","","Lemoine, P.; Tomas, A.; Carre, D.; Likforman, A.; Guittard, M.","Structure du sulfure d'ytterbium et d'indium Yb18 In7.33 S36","Acta Crystallographica C (39,1983-)","1989","45","","1858","1861","","","","","","","","","","","","","","","","","","","","","","has coordinates","169495","2020-10-21","18:00:00",""
"2020354","8.037","","8.037","","7.352","","90","","90","","120","","411.267","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Fe2 (H P O3)3","","- Fe2 H3 O9 P3 -","- Fe2 H3 O9 P3 -","- Fe4 H6 O18 P6 -","2","0.166667","","Sghyar, M.; Rafiq, M.; Cot, L.; Durand, J.","Structure du phosphite de fer: Fe2 (P O3 H)3","Acta Crystallographica C (39,1983-)","1991","47","","2515","2517","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2021213","9.0062","0.0005","9.0062","0.0005","23.1525","0.0012","90","","90","","120","","1626.34","0.15","296","2","296","2","","","","","","","","5","P 63/m","-P 6c","176","","Tridecasodium distrontium ditantalum nonaphosphate","","- Na13 O36 P9 Sr2 Ta2 -","- Na13 O36 P9 Sr2 Ta2 -","- Na26 O72 P18 Sr4 Ta4 -","2","0.166667","KY3148","Zhao, Ji; Zhao, Dan; Xue, Ya-Li; Zhong, Qiu; Zhang, Shi-Rui; Liu, Bao-Zhong","Novel tantalum phosphate Na~13~Sr~2~Ta~2~(PO~4~)~9~: synthesis, crystal structure, DFT calculations and Dy^3+^-activated fluorescence performance","Acta Crystallographica Section C","2018","74","9","","","10.1107/S2053229618011877","","","0.71073","MoKα","","0.0208","0.0185","","","0.0416","0.0424","","","","","","1.064","","","","has coordinates,has Fobs","210220","2020-10-21","18:00:00",""
"2021660","13.2027","0.0007","13.2027","0.0007","18.3116","0.0012","90","","90","","120","","2764.3","0.3","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","Poly[hexakis[μ~4~-(2-carboxylatophenyl)sulfanido]di-μ~3~-chlorido-tri-μ~2~-hydroxido-octanickel(II)sodium(I)]","","- C42 H27 Cl2 Na Ni8 O15 S6 -","- C42 H27 Cl2 Na Ni8 O15 S6 -","- C84 H54 Cl4 Na2 Ni16 O30 S12 -","2","0.166667","YP3179","Zhu, Jingyan; Yan, Shan; Xiao, Hongping; Jiang, Jun; Li, Xinhua","Nickel(II) cluster-based mixed-cation coordination polymer synthesized from 2-mercaptobenzoic acid and its application","Acta Crystallographica Section C","2019","75","7","","","10.1107/S2053229619007368","","","0.71073","MoKα","","0.0767","0.0683","","","0.2054","0.2134","","","","","","1.021","","","","has coordinates,has Fobs","215865","2020-10-21","18:00:00",""
"2022993","9.859","0.001","9.859","0.001","7.206","0.002","90","","90","","120","","606.58","0.19","","","","","","","","","","","","4","P 63/m","-P 6c","176","Strontium chloro apatite","","","- Cl O12 P3 Sr5 -","- Cl O12 P3 Sr5 -","- Cl2 O24 P6 Sr10 -","2","0.166667","","Sudarsanan, K.; Young, R. A.","Structure refinement and random error analysis for strontium `chlorapatite', Sr5(PO4)3Cl","Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry","1974","30","6","1381","1386","10.1107/S0567740874004936","","","","","","","","","","","","","","","","","","","","","has coordinates","288563","2023-12-28","19:35:45",""
"2100576","10.9992","0.0001","10.9992","0.0001","6.7639","0.0002","90","","90","","120","","708.68","0.02","296","2","296","2","","","","","","","","4","P 63/m","-P 6c","176","","triethyl-1,3,5-triazine-2,4,6-tricarboxylate","","- C12 H15 N3 O6 -","- C12 H15 N3 O6 -","- C24 H30 N6 O12 -","2","0.166667","BM5031","Tremayne, Maryjane; Kariuki, Benson M.; Chong, Samantha Y.; Seaton, Colin C.","Molecular versus crystal symmetry in tri-substituted triazine, benzene and isocyanurate derivatives","Acta Crystallographica, Section B","2006","62","2","864","874","10.1107/S0108768106020921","","","1.54178","CuKα","","0.0819","0.0764","","","0.207","0.2121","","","","","","1.124","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100578","10.983","0.0003","10.983","0.0005","6.7555","0.0002","90","","90","","120","","705.72","0.04","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","triethyl-1,3,5-triazine-2,4,6-tricarboxylate","triethyl-1,3,5-triazine-2,4,6-tricarboxylate","","- C12 H15 N3 O6 -","- C12 H15 N3 O6 -","- C24 H30 N6 O12 -","2","0.166667","BM5031","Tremayne, Maryjane; Kariuki, Benson M.; Chong, Samantha Y.; Seaton, Colin C.","Molecular versus crystal symmetry in tri-substituted triazine, benzene and isocyanurate derivatives","Acta Crystallographica, Section B","2006","62","2","864","874","10.1107/S0108768106020921","","","1.54056","CuKα~1~","","","","","","","","","","1.9","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2100989","9.388","0.002","9.388","0.002","6.991","0.005","90","","90","","120","","533.6","0.6","","","","","","","","","","","","5","P 63/m","-P 6c","","","","","- C4 H12 Br3 Cd N -","- C9 Br3 Cd N -","- C18 Br6 Cd2 N2 -","2","0.166667","AL0552","Aguirre-Zamalloa, G.; Madariaga, G.; Couzi, M.; Breczewski, T.","X-ray diffraction study of the ferroelectric phase transition of (CH~3~)~4~NCdBr~3~ (TMCB)","Acta Crystallographica Section B","1993","49","4","691","698","10.1107/S010876819300182X","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100991","9.388","0.002","9.388","0.002","6.991","0.005","90","","90","","120","","533.6","0.6","","","","","","","","","","","","5","P 63/m","-P 6c","","","","","- C4 H12 Br3 Cd N -","- C24 Br3 Cd N -","- C48 Br6 Cd2 N2 -","2","0.166667","AL0552","Aguirre-Zamalloa, G.; Madariaga, G.; Couzi, M.; Breczewski, T.","X-ray diffraction study of the ferroelectric phase transition of (CH~3~)~4~NCdBr~3~ (TMCB)","Acta Crystallographica Section B","1993","49","4","691","698","10.1107/S010876819300182X","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101605","9.888","0.0001","9.888","0.0001","3.217","0.0001","90","","90","","120","","272.395","0.009","","","","","","","","","","","","4","P 63/m","-P 6c","","","","","- Ba0.85 Ca2.15 In6 O12 -","- Ba4 Ca2 In6 O12 -","- Ba4 Ca2 In6 O12 -","1","0.0833333","DU0409","Baldinozzi, G.; Goutenoire, F.; Hervieu, M.; Suard, E.; Grebille, D.","Incommensurate modulated disorder in Ba~0.85~Ca~2.15~In~6~O~12~","Acta Crystallographica Section B","1996","52","5","780","789","10.1107/S0108768196006519","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102031","9.126","0.005","9.126","0.005","6.718","0.002","90","0.009","90","0.009","120","0.01","484.5","0.4","293","","293","","","","","","","","","5","P 63/m","-P 6c","176","","","","- C4 H12 Cd Cl3 N -","- C12 Cd Cl3 N -","- C24 Cd2 Cl6 N2 -","2","0.166667","NA0098","Peral, I.; Madariaga, G.; Perez-Etxebarria, A.; Breczewski, T.","X-ray diffraction study of the phase transitions of (CH~3~)~4~NCdCl~3~ between 293 and 80K: a quantitative analysis of the ferroelastic domains distribution below 118K","Acta Crystallographica Section B","2000","56","2","215","225","10.1107/S0108768199013622","","","0.71073","MoKα","","0.107","0.045","","0.032","0.031","","","","0.665","0.87","0.87","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2102086","40.68","0.07","40.68","0.07","12.546","0.001","90","","90","","120","","17980","4","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Al477.44 Cr63.42 Fe51.42 -","- Al477.44 Cr63.42 Fe51.42 -","- Al954.88 Cr126.84 Fe102.84 -","2","0.166667","ZH0020","Mo, Z.M.; Zhou, H.Y.; Kuo, K.H.","Structure of ν-Al~80.61~Cr~10.71~Fe~8.68~, a giant hexagonal approximant of a quasicrystal determined by a combination of electron microscopy and X-ray diffraction","Acta Crystallographica Section B","2000","56","3","392","401","10.1107/S0108768199015761","","","0.71069","MoKα","","0.125","0.0747","","","","0.2068","","","","","","1.085","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102550","7.6044","0.0001","7.6044","0.0001","2.9063","0.0001","90","","90","","120","","145.546","0.006","295","","295","","","","","","","","","2","P 63/m","-P 6c","176","β silicon nitride","","","- N4 Si3 -","- N4 Si3 -","- N8 Si6 -","2","0.166667","AV5009","du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F.","Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~","Acta Crystallographica Section B","2004","60","4","388","405","10.1107/S010876810401393X","","","0.75022","synx","","0.0196","0.0196","","0.0146","","0.0146","","","2.0102","","","2.0102","","","","has coordinates","201912","2020-10-21","18:00:00",""
"2102552","7.6015","0.0003","7.6015","0.0003","2.9061","0.0001","90","","90","","120","","145.425","0.013","200","","295","","","","","","","","","2","P 63/m","-P 6c","176","β silicon nitride","","","- N4 Si3 -","- N4 Si3 -","- N8 Si6 -","2","0.166667","AV5009","du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F.","Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~","Acta Crystallographica Section B","2004","60","4","388","405","10.1107/S010876810401393X","","","0.75037","synx","","0.0136","0.0136","","0.0114","","0.0114","","","1.8857","","","1.8857","","","","has coordinates","201912","2020-10-21","18:00:00",""
"2102554","7.602","0.0002","7.602","0.0002","2.906","0.0001","90","","90","","120","","145.439","0.009","150","","295","","","","","","","","","2","P 63/m","-P 6c","176","β silicon nitride","","","- N4 Si3 -","- N4 Si3 -","- N8 Si6 -","2","0.166667","AV5009","du Boulay, D.; Ishizawa, N.; Atake, T.; Streltsov, V.; Furuya, K.; Munakata, F.","Synchrotron X-ray and <i>ab initio</i> studies of β-Si~3~N~4~","Acta Crystallographica Section B","2004","60","4","388","405","10.1107/S010876810401393X","","","0.75037","synx","","0.0143","0.0143","","0.0136","","0.0136","","","1.8369","","","1.8369","","","","has coordinates","201912","2020-10-21","18:00:00",""
"2102702","9.377","0.011","9.377318","","6.888","0.004","90","","90","","120","","524.5","0.7","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P6 -","- Ca10 F2 O24 P6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102703","9.37834","0.00007","9.37834","0.00007","6.88877","0.00007","90","","90","","120","","524.716","0.01","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P6 -","- Ca10 F2 O24 P6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102704","9.37834","0.00007","9.37834","0.00007","6.88877","0.00007","90","","90","","120","","524.716","0.01","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P6 -","- Ca10 F2 O24 P6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102705","9.38","0.03","9.378214","","6.888","0.007","90","","90","","120","","524.7","1.8","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P5.4 V0.6 -","- Ca10 F2 O24 P5.4 V0.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102706","9.3801","0.0003","9.3801","0.0003","6.8889","0.0002","90","","90","","120","","524.92","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P5.4 V0.6 -","- Ca10 F2 O24 P5.4 V0.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102707","9.3801","0.0003","9.3801","0.0003","6.8889","0.0002","90","","90","","120","","524.92","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P5.4 V0.6 -","- Ca10 F2 O24 P5.4 V0.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102708","9.437","0.015","9.436671","","6.909","0.004","90","","90","","120","","532.8","0.9","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.8 V1.2 -","- Ca10 F2 O24 P4.8 V1.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102709","9.4379","0.0002","9.4379","0.0002","6.90967","0.00017","90","","90","","120","","533.02","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.8 V1.2 -","- Ca10 F2 O24 P4.8 V1.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102710","9.4379","0.0002","9.4379","0.0002","6.90968","0.00017","90","","90","","120","","533.02","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.8 V1.2 -","- Ca10 F2 O24 P4.8 V1.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102711","9.472","0.016","9.472342","","6.922","0.005","90","","90","","120","","537.9","1","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.2 V1.8 -","- Ca10 F2 O24 P4.2 V1.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102712","9.4733","0.0002","9.4733","0.0002","6.92272","0.00017","90","","90","","120","","538.04","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.2 V1.8 -","- Ca10 F2 O24 P4.2 V1.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102713","9.4733","0.0002","9.4733","0.0002","6.92276","0.00017","90","","90","","120","","538.04","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.2 V1.8 -","- Ca10 F2 O24 P4.2 V1.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102714","9.51","0.02","9.509835","","6.937","0.006","90","","90","","120","","543.3","1.8","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3.6 V2.4 -","- Ca10 F2 O24 P3.6 V2.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102715","9.5103","0.0002","9.5103","0.0002","6.93674","0.00018","90","","90","","120","","543.35","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3.6 V2.4 -","- Ca10 F2 O24 P3.6 V2.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102716","9.5103","0.0002","9.5103","0.0002","6.93677","0.00018","90","","90","","120","","543.35","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3.6 V2.4 -","- Ca10 F2 O24 P3.6 V2.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102717","9.57","0.02","9.565158","","6.947","0.006","90","","90","","120","","550.5","1.8","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3 V3 -","- Ca10 F2 O24 P3 V3 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102718","9.56534","0.00019","9.56534","0.00019","6.94712","0.00016","90","","90","","120","","550.47","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3 V3 -","- Ca10 F2 O24 P3 V3 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102719","9.5654","0.0002","9.5654","0.0002","6.94713","0.00016","90","","90","","120","","550.48","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3 V3 -","- Ca10 F2 O24 P3 V3 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102720","9.58","0.03","9.581942","","6.963","0.008","90","","90","","120","","554","2","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P2.4 V3.6 -","- Ca10 F2 O24 P2.4 V3.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102721","9.582","0.0003","9.582","0.0003","6.9628","0.0002","90","","90","","120","","553.64","0.04","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P2.4 V3.6 -","- Ca10 F2 O24 P2.4 V3.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102722","9.5821","0.0003","9.5821","0.0003","6.9628","0.0002","90","","90","","120","","553.65","0.04","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P2.4 V3.6 -","- Ca10 F2 O24 P2.4 V3.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102723","9.6","0.03","9.598996","","6.969","0.01","90","","90","","120","","556.2","1.9","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.8 V4.2 -","- Ca10 F2 O24 P1.8 V4.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102724","9.6029","0.0005","9.6029","0.0005","6.9712","0.0004","90","","90","","120","","556.73","0.06","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.8 V4.2 -","- Ca10 F2 O24 P1.8 V4.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102725","9.6029","0.0005","9.6029","0.0005","6.9713","0.0004","90","","90","","120","","556.74","0.07","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.8 V4.2 -","- Ca10 F2 O24 P1.8 V4.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102726","9.65","0.05","9.646212","","6.981","0.014","90","","90","","120","","563","4","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.2 V4.8 -","- Ca10 F2 O24 P1.2 V4.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102727","9.6454","0.0007","9.6454","0.0007","6.9855","0.0006","90","","90","","120","","562.81","0.1","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.2 V4.8 -","- Ca10 F2 O24 P1.2 V4.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102728","9.6452","0.0007","9.6452","0.0007","6.9855","0.0006","90","","90","","120","","562.8","0.1","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.2 V4.8 -","- Ca10 F2 O24 P1.2 V4.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102729","9.68","0.04","9.680008","","6.999","0.012","90","","90","","120","","568","3","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P0.6 V5.4 -","- Ca10 F2 O24 P0.6 V5.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102730","9.6819","0.0005","9.6819","0.0005","7.0015","0.0004","90","","90","","120","","568.39","0.06","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P0.6 V5.4 -","- Ca10 F2 O24 P0.6 V5.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102731","9.6817","0.0005","9.6817","0.0005","7.0014","0.0004","90","","90","","120","","568.36","0.07","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P0.6 V5.4 -","- Ca10 F2 O24 P0.6 V5.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103045","16.30365","","16.30365","","8.27597","","90","","90","","120","","1905.11","","1.6","","1.6","","","","","","","","","4","P 63/m","-P 6c","176","calcium aluminate deca hydrate","","","- Al2 Ca D16.84 O12.42 -","- Al2 Ca D16.844 O12.422 -","- Al12 Ca6 D101.064 O74.532 -","6","0.5","WS5055","Christensen, Axel Nørlund; Lebech, Bente; Sheptyakov, Denis; Hanson, Jonathan C.","Structure of calcium aluminate decahydrate (CaAl~2~O~4~·10D~2~O) from neutron and X-ray powder diffraction data","Acta Crystallographica, Section B: Structural Science","2007","63","6","850","861","10.1107/S0108768107035136","","neutron","1.8854","neutron","","","","","","","","","","4.3474","","","","","","","has coordinates","209472","2020-10-21","18:00:00",""
"2103090","10.2972","0.0006","10.2972","0.0006","7.069","0.0006","90","","90","","120","","649.12","0.08","298","","300","","","","","","","","","4","P 63/m","-P 6c","176","","","","- As6 Cl2 O18 Pb10 -","- As6 Cl2 O18 Pb10 -","- As6 Cl2 O18 Pb10 -","1","0.0833333","LM5013","Baikie, T; Ferraris, C; Klooster, W.T; Madhavi, S; Pramana, S.S; Pring, A; Schmidt, G; White, T.J","Crystal chemistry of mimetite, Pb~10~(AsO~4~)~6~Cl~1.48~O~0.26~, and finnemanite, Pb~10~(AsO~3~)~6~Cl~2~","Acta Crystallographica Section B","2008","64","1","34","41","10.1107/S0108768107066402","","neutron","1.8834","neutron","","","","","","","","","","0.86","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2103091","10.2055","0.0002","10.2055","0.0002","7.4483","0.0002","90","","90","","120","","671.83","0.03","298","","300","","","","","","","","","4","P 63/m","-P 6c","176","","","","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","1","0.0833333","LM5013","Baikie, T; Ferraris, C; Klooster, W.T; Madhavi, S; Pramana, S.S; Pring, A; Schmidt, G; White, T.J","Crystal chemistry of mimetite, Pb~10~(AsO~4~)~6~Cl~1.48~O~0.26~, and finnemanite, Pb~10~(AsO~3~)~6~Cl~2~","Acta Crystallographica Section B","2008","64","1","34","41","10.1107/S0108768107066402","","neutron","1.8834","neutron","","","","","","","","","","0.65","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2103092","10.2224","0.0003","10.2224","0.0003","7.4494","0.0002","90","","90","","120","","674.15","0.03","373","","300","","","","","","","","","4","P 63/m","-P 6c","176","","","","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","1","0.0833333","LM5013","Baikie, T; Ferraris, C; Klooster, W.T; Madhavi, S; Pramana, S.S; Pring, A; Schmidt, G; White, T.J","Crystal chemistry of mimetite, Pb~10~(AsO~4~)~6~Cl~1.48~O~0.26~, and finnemanite, Pb~10~(AsO~3~)~6~Cl~2~","Acta Crystallographica Section B","2008","64","1","34","41","10.1107/S0108768107066402","","neutron","1.8834","neutron","","","","","","","","","","0.63","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2103093","10.2323","0.0003","10.2323","0.0003","7.4533","0.0002","90","","90","","120","","675.81","0.03","423","","300","","","","","","","","","4","P 63/m","-P 6c","176","","","","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","1","0.0833333","LM5013","Baikie, T; Ferraris, C; Klooster, W.T; Madhavi, S; Pramana, S.S; Pring, A; Schmidt, G; White, T.J","Crystal chemistry of mimetite, Pb~10~(AsO~4~)~6~Cl~1.48~O~0.26~, and finnemanite, Pb~10~(AsO~3~)~6~Cl~2~","Acta Crystallographica Section B","2008","64","1","34","41","10.1107/S0108768107066402","","neutron","1.8834","neutron","","","","","","","","","","0.65","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2103094","10.2415","0.0003","10.2415","0.0003","7.4594","0.0002","90","","90","","120","","677.58","0.03","473","","300","","","","","","","","","4","P 63/m","-P 6c","176","","","","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","1","0.0833333","LM5013","Baikie, T; Ferraris, C; Klooster, W.T; Madhavi, S; Pramana, S.S; Pring, A; Schmidt, G; White, T.J","Crystal chemistry of mimetite, Pb~10~(AsO~4~)~6~Cl~1.48~O~0.26~, and finnemanite, Pb~10~(AsO~3~)~6~Cl~2~","Acta Crystallographica Section B","2008","64","1","34","41","10.1107/S0108768107066402","","neutron","1.8834","neutron","","","","","","","","","","0.58","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2103191","22.59","","22.59","","15.97","","90","","90","","120","","7057.78","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","trans-[Pt(CF3){N=C(Ph)OCH2CH2CH2}(PPh3)2]BF4. [PtC45.8H41F6.4NOBP2]Cl0.2","","?","- C47 F3 N O P2 Pt -","- C282 F18 N6 O6 P12 Pt6 -","6","0.5","BM0047","Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H.","Some 60 new space-group corrections","Acta Crystallographica Section B","2002","58","1","62","77","10.1107/S0108768101017128","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103215","13.619","","13.619","","19.204","","90","","90","","120","","3084.7","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","[Tris(ruthenium(III))(mu3-O)hexatris(mu-benzoate)tris(N-pyridine)] -(hexafluorophosphate)","","?","- C57 H45 F6 N3 O13 P Ru3 -","- C114 H90 F12 N6 O26 P2 Ru6 -","2","0.166667","BM0047","Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H.","Some 60 new space-group corrections","Acta Crystallographica Section B","2002","58","1","62","77","10.1107/S0108768101017128","","","","","","","","","","","","","","","","","","","","","has coordinates","191020","2020-10-21","18:00:00",""
"2103341","11.8152","","11.8152","","16.7019","","90","","90","","120","","2019.2","","","","","","","","","","","","","5","P 63/m","","","","","","- C18 H60 Al3 P3 Si6 -","- C18 H60 Al3 P3 Si6 -","- C36 H120 Al6 P6 Si12 -","2","0.166667","BK0117","Marsh, Richard E.","The space groups of point group <i>C</i>~3~: some corrections, some comments","Acta Crystallographica Section B","2002","58","5","893","899","10.1107/S0108768102011758","","","","","","","","","","","","","","","","","","","","","has coordinates","199473","2020-10-21","18:00:00",""
"2103342","11.239","","11.239","","8.84","","90","","90","","120","","967.026","","","","","","","","","","","","","4","P 63/m","","","","","","- C16 H29 N3 O6 -","- C16 H27 N3 O6 -","- C32 H54 N6 O12 -","2","0.166667","BK0117","Marsh, Richard E.","The space groups of point group <i>C</i>~3~: some corrections, some comments","Acta Crystallographica Section B","2002","58","5","893","899","10.1107/S0108768102011758","","","","","","","","","","","","","","","","","","","","","has coordinates","199473","2020-10-21","18:00:00",""
"2103729","10.6768","0.0003","10.6768","0.0003","3.6566","0.0001","90","","90","","120","","360.986","0.017","295","","295","","","","","","","","","3","P 63/m","-P 6c","176","","","","- In0.54 Nb3 Te4 -","- In0.5392 Nb3 Te4 -","- In1.0784 Nb6 Te8 -","2","0.166667","CK0007","Wunschel, Markus; Dinnebier, Robert E.; Carlson, Stefan; van Smaalen, Sander","Bulk modulus and non-uniform compression of Nb~3~Te~4~ and In~<i>x~</i>Nb~3~Te~4~ (<i>x</i> < 1) channel compounds","Acta Crystallographica Section B","2001","57","5","665","672","10.1107/S0108768101011685","","","0.13918","synchrotron","","","","","","","","","","1.61","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2104669","10.0898","0.0001","10.0898","0.0001","13.2506","0.0001","90","","90","","120","","1168.24","0.019","","","298","","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ca8 Cl3.8 O42.1 Pb12 Si12 -","- Ca8 Cl3.8 O42.1 Pb12 Si12 -","- Ca8 Cl3.8 O42.1 Pb12 Si12 -","1","0.0833333","BK5091","Baikie, Tom; Pramana, Stevin S.; Ferraris, Cristiano; Huang, Yizhong; Kendrick, Emma; Knight, Kevin S.; Ahmad, Zahara; White, T. J.","Polysomatic apatites","Acta Crystallographica Section B","2010","66","1","1","16","10.1107/S0108768109053981","powder diffraction","neutron","","neutron","","","","","","","","","","3.4","","","","","","","has coordinates","199608","2020-10-21","18:00:00",""
"2104744","9.37245","0.00049","9.37245","0.00049","6.88302","0.00063","90","","90","","120","","523.62","0.06","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","KD5037","Elliot, Alexander Dean","Structure of pyrrhotite 5<i>C</i> (Fe~9~S~10~)","Acta Crystallographica Section B","2010","66","3","271","279","10.1107/S0108768110011845","powder diffraction","","","","","","","","","","","","0.01652","","","","","","","","has coordinates","191079","2020-10-21","18:00:00",""
"2104755","9.37243","0.00049","9.37243","0.00049","6.88313","0.00063","90","","90","","120","","523.63","0.06","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","KD5037","Elliot, Alexander Dean","Structure of pyrrhotite 5<i>C</i> (Fe~9~S~10~)","Acta Crystallographica Section B","2010","66","3","271","279","10.1107/S0108768110011845","powder diffraction","","","","","","","","","","","","0.01657","","","","","","","","has coordinates","191079","2020-10-21","18:00:00",""
"2105261","9.6452","0.0002","9.6452","0.0002","6.7636","0.0002","90","","90","","120","","544.92","0.02","293","2","293","2","","","","","","","synthesis as described","4","P 63/m","-P 6c","176","chlorapatite","chlorapatite","","- Ca5 Cl O12 P3 -","- Ca5 Cl O12 P3 -","- Ca10 Cl2 O24 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0313","0.0224","","","0.0525","0.0561","","","","","","1.077","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105262","9.6434","0.0002","9.6434","0.0002","6.7643","0.0002","90","","90","","120","","544.77","0.02","293","2","293","2","","","","","","","synthesis as described","4","P 63/m","-P 6c","176","chlorapatite","chlorapatite","","- Ca5 Cl O12 P3 -","- Ca5 Cl O12 P3 -","- Ca10 Cl2 O24 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0179","0.0171","","","0.045","0.0458","","","","","","1.108","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105263","9.643","0.0002","9.643","0.0002","6.762","0.0001","90","","90","","120","","544.54","0.018","293","2","293","2","","","","","","","synthesis as described","4","P 63/m","-P 6c","176","chlorapatite","chlorapatite","","- Ca5 Cl O12 P3 -","- Ca5 Cl O12 P3 -","- Ca10 Cl2 O24 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0176","0.0173","","","0.0449","0.0451","","","","","","1.183","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105264","9.6414","0.0002","9.6414","0.0002","6.7631","0.0002","90","","90","","120","","544.45","0.02","293","2","293","2","","","","","","","synthesis as described","4","P 63/m","-P 6c","176","chlorapatite","chlorapatite","","- Ca5 Cl O12 P3 -","- Ca5 Cl O12 P3 -","- Ca10 Cl2 O24 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.018","0.0173","","","0.0514","0.052","","","","","","1.119","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105265","9.6368","0.0002","9.6368","0.0002","6.7482","0.0002","90","","90","","120","","542.73","0.02","100","2","100","2","","","","","","","synthesis as described","4","P 63/m","-P 6c","176","chlorapatite","chlorapatite","","- Ca5 Cl O12 P3 -","- Ca5 Cl O12 P3 -","- Ca10 Cl2 O24 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0213","0.0161","","","0.0359","0.038","","","","","","1.098","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105266","9.6341","0.0001","9.6341","0.0001","6.7445","0.0002","90","","90","","120","","542.129","0.018","100","2","100","2","","","","","","","synthesis as described","4","P 63/m","-P 6c","176","chlorapatite","chlorapatite","","- Ca5 Cl O12 P3 -","- Ca5 Cl O12 P3 -","- Ca10 Cl2 O24 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0229","0.0228","","","0.0604","0.0604","","","","","","1.295","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105267","9.634","0.0002","9.634","0.0002","6.744","0.0003","90","","90","","120","","542.08","0.03","100","2","100","2","","","","","","","synthesis as described","4","P 63/m","-P 6c","176","chlorapatite","chlorapatite","","- Ca5 Cl O12 P3 -","- Ca5 Cl O12 P3 -","- Ca10 Cl2 O24 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0291","0.0289","","","0.0811","0.0812","","","","","","1.37","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105268","9.6343","0.0001","9.6343","0.0001","6.743","0.0001","90","","90","","120","","542.031","0.011","100","2","100","2","","","","","","","synthesis as described","4","P 63/m","-P 6c","176","chlorapatite","chlorapatite","","- Ca5 Cl O12 P3 -","- Ca5 Cl O12 P3 -","- Ca10 Cl2 O24 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0161","0.0146","","","0.0357","0.0365","","","","","","1.048","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105277","9.5377","0.0003","9.5377","0.0003","6.7999","0.0005","90","","90","","120","","535.7","0.05","100","2","100","2","","","","","","","synthesis as described","5","P 63/m","-P 6c","176","","","","- Ca5 Cl0.54 H0.46 O12.46 P3 -","- Ca5 Cl0.544 H0.456 O12.455 P3 -","- Ca10 Cl1.088 H0.912 O24.91 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0288","0.0269","","","0.0634","0.0644","","","","","","1.176","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2105278","9.5439","0.0002","9.5439","0.0002","6.8174","0.0003","90","","90","","120","","537.78","0.03","293","2","293","2","","","","","","","synthesis as described","5","P 63/m","-P 6c","176","","","","- Ca5 Cl0.54 H0.46 O12.46 P3 -","- Ca5 Cl0.54 H0.46 O12.46 P3 -","- Ca10 Cl1.08 H0.92 O24.92 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0304","0.028","","","0.0677","0.0689","","","","","","1.203","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2105279","9.4815","0.0002","9.4815","0.0002","6.82","0.0003","90","","90","","120","","530.97","0.03","100","2","100","2","","","","","","","synthesis as described","5","P 63/m","-P 6c","176","","","","- Ca5 Cl0.44 H0.56 O12.56 P3 -","- Ca5 Cl0.44 H0.561 O12.561 P3 -","- Ca10 Cl0.88 H1.122 O25.122 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0355","0.0337","","","0.074","0.0748","","","","","","1.126","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2105280","9.4894","0.0004","9.4894","0.0004","6.8612","0.0007","90","","90","","120","","535.07","0.06","293","2","293","2","","","","","","","synthesis as described","5","P 63/m","-P 6c","176","","","","- Ca5 Cl0.44 H0.56 O12.56 P3 -","- Ca5 Cl0.44 H0.56 O12.56 P3 -","- Ca10 Cl0.88 H1.12 O25.12 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0328","0.0316","","","0.0755","0.0762","","","","","","0.963","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2105281","9.431","0.005","9.431","0.005","6.86","0.005","90","0.005","90","0.005","120","0.005","528.4","0.6","100","2","100","2","","","","","","","synthesis as described","5","P 63/m","-P 6c","176","","","","- Ca5 Cl0.29 H0.71 O12.71 P3 -","- Ca5 Cl0.286 H0.712 O12.716 P3 -","- Ca10 Cl0.572 H1.424 O25.432 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0405","0.0374","","","0.084","0.0852","","","","","","1.217","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2105282","9.4284","0.0008","9.4284","0.0008","6.8756","0.0007","90","","90","","120","","529.32","0.08","293","2","293","2","","","","","","","synthesis as described","5","P 63/m","-P 6c","176","","","","- Ca5 Cl0.28 H0.72 O12.71 P3 -","- Ca5 Cl0.28 H0.72 O12.72 P3 -","- Ca10 Cl0.56 H1.44 O25.44 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0377","0.0328","","","0.0775","0.0808","","","","","","1.065","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2105283","9.4139","0.0002","9.4139","0.0002","6.8679","0.0002","90","","90","","120","","527.1","0.02","100","2","100","2","","","","","","","synthesis as described","5","P 63/m","-P 6c","176","","","","- Ca5 Cl0.18 H0.82 O12.82 P3 -","- Ca5 Cl0.18 H0.818 O12.822 P3 -","- Ca10 Cl0.36 H1.636 O25.644 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0415","0.0385","","","0.0845","0.0856","","","","","","1.133","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2105284","9.423","0.0002","9.423","0.0002","6.8794","0.0003","90","","90","","120","","529","0.03","293","2","293","2","","","","","","","synthesis as described","5","P 63/m","-P 6c","176","","","","- Ca5 Cl0.18 H0.82 O12.82 P3 -","- Ca5 Cl0.18 H0.82 O12.83 P3 -","- Ca10 Cl0.36 H1.64 O25.66 P6 -","2","0.166667","ZB5021","García-Tuñón, Esther; Dacuña, Bruno; Zaragoza, Guillermo; Franco, Jaime; Guitián, Francisco","Cl‒OH ion-exchanging process in chlorapatite (Ca~5~(PO~4~)~3~Cl~<i>x~</i>(OH)~1{-~<i>x</i>}) ‒ a deep insight","Acta Crystallographica Section B","2012","68","5","467","479","10.1107/S0108768112019520","","x-ray","0.7107","MoKα","","0.0304","0.0291","","","0.0677","0.0683","","","","","","1.154","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2105411","7.56","","7.56","","3.512","","90","","90","","120","","173.832","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Zr Ir3 B3.76","","- B3.76 Ir3 Zr -","- B3.76 Ir3 Zr -","- B7.52 Ir6 Zr2 -","2","0.166667","","Rogl, P.","The crystal structure of Zr Ir3 B4","Acta Crystallographica B (24,1968-38,1982)","1978","34","","721","724","10.1107/S0567740878003945","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105415","9.218","","9.218","","9.207","","90","","90","","120","","677.52","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","B (O Te F5)3","","- B F15 O3 Te3 -","- B F15 O3 Te3 -","- B2 F30 O6 Te6 -","2","0.166667","","Sawyer, J.F.; Schrobilgen, G.J.D.","Tris(pentafluorotellurato(VI))boron(III)","Acta Crystallographica B (24,1968-38,1982)","1982","38","","1561","1563","10.1107/S0567740882006384","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105436","7.548","","7.548","","3.487","","90","","90","","120","","172.047","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Hf Ir3 B4","","- B4 Hf Ir3 -","- B4 Hf Ir3 -","- B8 Hf2 Ir6 -","2","0.166667","","Rogl, P.","The crystal structure of Zr Ir3 B4","Acta Crystallographica B (24,1968-38,1982)","1978","34","","721","724","10.1107/S0567740878003945","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2106079","11.945","","11.945","","12.797","","90","","90","","120","","1581.29","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","(N H4)2 Cr3 O10","","- Cr3 H8 N2 O10 -","- Cr3 H8 N2 O10 -","- Cr18 H48 N12 O60 -","6","0.5","","Blum, D.; Guitel, J.C.","Structure de la forme hexagonale du trichromate d'ammonium: (N H4)2 Cr3 O10","Acta Crystallographica B (24,1968-38,1982)","1980","36","","135","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","189062","2020-10-21","18:00:00",""
"2106244","6.308","","6.308","","3.6","","90","","90","","120","","124.056","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tb (O H)3","","- H3 O3 Tb -","- H3 O3 Tb -","- H6 O6 Tb2 -","2","0.166667","","Beall, G.W.; Milligan, W.O.; Korp, J.D.; Bernal, I.","The structure of terbium trihydroxide, Tb (O H)3, by neutron diffraction","Acta Crystallographica B (24,1968-38,1982)","1977","33","","3134","3136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106266","7.382","","7.382","","4.214","","90","","90","","120","","198.872","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Am Cl3 -","- Am Cl3 -","- Am2 Cl6 -","2","0.166667","","Burns, J.H.; Peterson, J.R.","Refinement of the crystal structure of Am Cl3","Acta Crystallographica B (24,1968-38,1982)","1970","26","","1885","1887","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106374","18.315","","18.315","","3.928","","90","","90","","120","","1141.08","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","La7 (O H)18 I3","","- H18 I3 La7 O18 -","- I3 La7 O18 -","- I6 La14 O36 -","2","0.166667","","Lance-Gomez, E.T.; Haschke, J.M.; Butler, W.; Peacor, D.R.","The crystal structure of La7 (O H)18 I3","Acta Crystallographica B (24,1968-38,1982)","1978","34","","758","762","","","","","","","","","","","","","","","","","","","","","","has coordinates","149421","2020-10-21","18:00:00",""
"2106446","10.307","","10.307","","6.496","","90","","90","","120","","597.642","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Cd4.64 (V O4)3 I1.39","","- Cd4.64 I1.39 O12 V3 -","- Cd4.638 I1.3878 O12 V3 -","- Cd9.276 I2.7756 O24 V6 -","2","0.166667","","Sudarsanan, K.; Wilson, A.J.C.; Young, R.A.","The structures of some cadmium 'apatites' Cd5 (M O4)3 X. I. Determination of the structures of Cd5 (V O4)3 I , Cd5 (P O4)3 Br , Cd5 (As O4)3 Br and Cd5 (V O4)3 Br","Acta Crystallographica B (24,1968-38,1982)","1977","33","","3136","3142","","","","","","","","","","","","","","","","","","","","","","has coordinates","150017","2020-10-21","18:00:00",""
"2106447","9.733","","9.733","","6.468","","90","","90","","120","","530.633","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Cd4.82 (P O4)3 Br1.52","","- Br1.52 Cd4.82 O12 P3 -","- Br1.5234 Cd4.821 O12 P3 -","- Br3.0468 Cd9.642 O24 P6 -","2","0.166667","","Sudarsanan, K.; Young, R.A.; Wilson, A.J.C.","The structures of some cadmium 'apatites' Cd5 (M O4)3 X. I. Determination of the structures of Cd5 (V O4)3 I , Cd5 (P O4)3 Br , Cd5 (AS O4)3 Br and Cd5 (V O4)3 Br","Acta Crystallographica B (24,1968-38,1982)","1977","33","","3136","3142","","","","","","","","","","","","","","","","","","","","","","has coordinates","150018","2020-10-21","18:00:00",""
"2106448","10.1","","10.1","","6.519","","90","","90","","120","","575.91","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Cd4.92 (As O4)3 Br1.54","","- As3 Br1.54 Cd4.92 O12 -","- As3 Br1.5372 Cd4.9206 O12 -","- As6 Br3.0744 Cd9.8412 O24 -","2","0.166667","","Sudarsanan, K.; Wilson, A.J.C.; Young, R.A.","The structures of some cadmium 'apatites' Cd5 (M O4)3 X. I. Determination of the structures of Cd5 (V O4)3 I , Cd5 (P O4)3 Br , Cd5 (AS O4)3 Br and Cd5 (V O4)3 Br","Acta Crystallographica B (24,1968-38,1982)","1977","33","","3136","3142","","","","","","","","","","","","","","","","","","","","","","has coordinates","150019","2020-10-21","18:00:00",""
"2106449","10.173","","10.173","","6.532","","90","","90","","120","","585.43","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Cd4.86 (V O4)3 Br1.41","","- Br1.41 Cd4.86 O12 V3 -","- Br1.4064 Cd4.86 O12 V3 -","- Br2.8128 Cd9.72 O24 V6 -","2","0.166667","","Sudarsanan, K.; Young, R.A.; Wilson, A.J.C.","The structures of some cadmium 'apatites' Cd5 (M O4)3 X. I. Determination of the structures of Cd5 (V O4)3 I , Cd5 (P O4)3 Br , Cd5 (AS O4)3 Br and Cd5 (V O4)3 Br","Acta Crystallographica B (24,1968-38,1982)","1977","33","","3136","3142","","","","","","","","","","","","","","","","","","","","","","has coordinates","150020","2020-10-21","18:00:00",""
"2106482","7.412","","7.412","","13.943","","90","","90","","120","","663.373","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","La K (Fe (C N)6) (H2 O)4","","- C6 H8 Fe K La N6 O4 -","- C6 Fe K La N6 O4 -","- C12 Fe2 K2 La2 N12 O8 -","2","0.166667","","Beall, G.W.; Mullica, D.F.; Milligan, W.O.","The crystal structure of La K Fe (C N)6 (H2 O)4","Acta Crystallographica B (24,1968-38,1982)","1978","34","","1446","1449","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106556","34.09","","34.09","","17.664","","90","","90","","120","","17777.6","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Hf18 O10 (O H)26 (S O4)13 (H2 O)33","","- H92 Hf18 O121 S13 -","- Hf18 O121 S13 -","- Hf108 O726 S78 -","6","0.5","","Mark, W.; Hansson, M.","The crystal structure of Hf18 O10 (O H)26 (S O4)13 (H2 O)33","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1101","1108","","","","","","","","","","","","","","","","","","","","","","has coordinates","151323","2020-10-21","18:00:00",""
"2106593","9.564","","9.564","","6.816","","90","","90","","120","","539.932","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ca9.7 (P6 O23.81) Cl2.35 (O H)2.01","","- Ca9.6964 Cl2.348 O2.008 -","- Ca9.6964 Cl2.348 O2.008 -","- Ca9.6964 Cl2.348 O2.008 -","1","0.0833333","","Sudarsanan, K.; Young, R.A.","Structural interactions of F, Cl and O H in apatites","Acta Crystallographica B (24,1968-38,1982)","1978","34","","1401","1407","","","","","","","","","","","","","","","","","","","","","","has coordinates","151706","2020-10-21","18:00:00",""
"2106594","9.488","","9.488","","6.855","","90","","90","","120","","534.426","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ca4.905 (P O4)3.014 Cl.595 (O H)1.67","","- Ca4.9055 Cl0.594 O1.672 -","- Ca4.9055 Cl0.594 O1.672 -","- Ca9.811 Cl1.188 O3.344 -","2","0.166667","","Sudarsanan, K.; Young, R.A.","Structural interactions of F, Cl and OH in Apatites","Acta Crystallographica B (24,1968-38,1982)","1978","34","","1401","1407","","","","","","","","","","","","","","","","","","","","","","has coordinates","151707","2020-10-21","18:00:00",""
"2106595","9.541","","9.541","","6.838","","90","","90","","120","","539.073","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ca9.54 P5.98 O23.58 Cl1.60 (O H)2.74","","- Ca9.5384 Cl1.5984 O2.74 -","- Ca9.5384 Cl1.5984 O2.74 -","- Ca9.5384 Cl1.5984 O2.74 -","1","0.0833333","","Sudarsanan, K.; Young, R.A.","Structural interactions of F, Cl and OH in Apatites","Acta Crystallographica B (24,1968-38,1982)","1978","34","","1401","1407","","","","","","","","","","","","","","","","","","","","","","has coordinates","151708","2020-10-21","18:00:00",""
"2106596","9.4215","","9.4215","","6.8739","","90","","90","","120","","528.414","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ca4.895 (P O4)2.995 Cl.23 F.77 (O H).35","","- Ca4.8938 Cl0.2262 O0.1748 -","- Ca4.8938 Cl0.2262 O0.1748 -","- Ca9.7876 Cl0.4524 O0.3496 -","2","0.166667","","Sudarsanan, K.; Young, R.A.","Structural interactions of F, Cl and OH in Apatites","Acta Crystallographica B (24,1968-38,1982)","1978","34","","1401","1407","","","","","","","","","","","","","","","","","","","","","","has coordinates","151709","2020-10-21","18:00:00",""
"2106597","9.483","","9.483","","6.78","","90","","90","","120","","528.022","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ca9.53 P5.84 O23.33 Cl1.36 (O H)1.65 F0.57","","- Ca9.5268 Cl1.3624 O1.648 -","- Ca9.5268 Cl1.3624 O1.648 -","- Ca9.5268 Cl1.3624 O1.648 -","1","0.0833333","","Sudarsanan, K.; Young, R.A.","Structural interactions of F, Cl and OH in Apatites","Acta Crystallographica B (24,1968-38,1982)","1978","34","","1401","1407","","","","","","","","","","","","","","","","","","","","","","has coordinates","151710","2020-10-21","18:00:00",""
"2106676","9.532","","9.532","","6.199","","90","","90","","120","","487.776","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Mn5 (P O4)3 (Cl0.9 (O H)0.1)","","- Cl0.9 H0.1 Mn5 O12.1 P3 -","- Cl0.9 Mn5 O12.1 P3 -","- Cl1.8 Mn10 O24.2 P6 -","2","0.166667","","Engel, G.; Gramlich, V.; Pretzsch, J.; Baur, W.H.","The crystal structure of hydrothermally grown manganese chlorapatite, Mn5 (P O4)3 Cl0.9 (O H)0.1","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1854","1860","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106683","9.71","","9.71","","18.96","","90","","90","","120","","1548.13","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","K5 Fe3 (S O4)6 (O H)2 (H2 O)9","","- Fe3 H20 K5 O35 S6 -","- Fe3 K5 O35 S6 -","- Fe6 K10 O70 S12 -","2","0.166667","","Giacovazzo, C.; Scordari, F.; Menchetti, S.","Hydrous potassium and ferric iron sulphate (Maus's salt)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2171","2173","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106792","9.9462","","9.9462","","7.1983","","90","","90","","120","","616.701","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb1.56 Ca2.44) (Pb3.06 Ca2.94) (V O4)6 F2","","- Ca5.38 F2 O24 Pb4.62 V6 -","- Ca5.38 F2 O24 Pb4.62 V6 -","- Ca5.38 F2 O24 Pb4.62 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. I. Disequilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","138","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","159187","2020-10-21","18:00:00",""
"2106793","10.0011","","10.0011","","7.1993","","90","","90","","120","","623.615","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb1.12 Ca2.88) (Pb3.78 Ca2.22) (V O4)6 (F0.6 O0.7)","","- Ca5.1 F0.6 O24.7 Pb4.9 V6 -","- Ca5.1 F0.6 O24.7 Pb4.9 V6 -","- Ca5.1 F0.6 O24.7 Pb4.9 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. I. Disequilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","138","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","159188","2020-10-21","18:00:00",""
"2106794","10.0025","","10.0025","","7.1858","","90","","90","","120","","622.62","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb0.64 Ca3.36) (Pb4.14 Ca1.86) (V O4)6 (F0.6 O0.7)","","- Ca5.22 F0.6 O24.7 Pb4.78 V6 -","- Ca5.22 F0.6 O24.7 Pb4.78 V6 -","- Ca5.22 F0.6 O24.7 Pb4.78 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. I. Disequilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","138","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","159189","2020-10-21","18:00:00",""
"2106796","9.7835","","9.7835","","7.0318","","90","","90","","120","","582.889","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb0.57 Ca9.43) (V O4)6 (F0.9 O0.05)2","","- Ca9.43 F1.8 O24.1 Pb0.57 V6 -","- Ca9.46 F1.8 O24.1 Pb0.54 V6 -","- Ca9.46 F1.8 O24.1 Pb0.54 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. II. Equilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","146","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","159191","2020-10-21","18:00:00",""
"2106797","9.8208","","9.8208","","7.0521","","90","","90","","120","","589.037","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb1.33 Ca8.67) (V O4)6 (F0.81 O0.095)2","","- Ca8.67 F1.62 O24.19 Pb1.33 V6 -","- Ca8.72 F1.62 O24.2 Pb1.28 V6 -","- Ca8.72 F1.62 O24.2 Pb1.28 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. II. Equilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","146","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","159192","2020-10-21","18:00:00",""
"2106798","9.9175","","9.9175","","7.1154","","90","","90","","120","","606.086","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb3.01 Ca6.99) (V O4)6 (F0.79 O0.105)2","","- Ca6.99 F1.58 O24.21 Pb3.01 V6 -","- Ca7 F1.58 O24.22 Pb3 V6 -","- Ca7 F1.58 O24.22 Pb3 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. II. Equilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","146","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","159193","2020-10-21","18:00:00",""
"2106799","9.9174","","9.9174","","7.1199","","90","","90","","120","","606.457","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb3.06 Ca6.94) (V O4)6 (F0.85 O0.075)2","","- Ca6.94 F1.7 O24.15 Pb3.06 V6 -","- Ca6.94 F1.7 O24.14 Pb3.06 V6 -","- Ca6.94 F1.7 O24.14 Pb3.06 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. II. Equilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","146","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","159194","2020-10-21","18:00:00",""
"2106800","9.8441","","9.8441","","7.0635","","90","","90","","120","","592.792","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb1.76 Ca8.24) (V O4)6 (F0.75 O0.125)2","","- Ca8.24 F1.5 O24.25 Pb1.76 V6 -","- Ca8.28 F1.5 O24.26 Pb1.72 V6 -","- Ca8.28 F1.5 O24.26 Pb1.72 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. II. Equilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","146","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","159195","2020-10-21","18:00:00",""
"2106801","9.9559","","9.9559","","7.1508","","90","","90","","120","","613.827","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb3.82 Ca6.18) (V O4)6 (F0.73 O0.135)2","","- Ca6.18 F1.46 O24.27 Pb3.82 V6 -","- Ca6.18 F1.46 O24.28 Pb3.82 V6 -","- Ca6.18 F1.46 O24.28 Pb3.82 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. II. Equilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","146","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","159196","2020-10-21","18:00:00",""
"2106802","9.9856","","9.9856","","7.1825","","90","","90","","120","","620.233","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb4.42 Ca5.58) (V O4)6 (F0.85 O0.075)2","","- Ca5.58 F1.7 O24.15 Pb4.42 V6 -","- Ca5.58 F1.7 O24.15 Pb4.42 V6 -","- Ca5.58 F1.7 O24.15 Pb4.42 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. II. Equilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","146","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","159197","2020-10-21","18:00:00",""
"2106803","10.0233","","10.0233","","7.241","","90","","90","","120","","630.015","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb5.55 Ca4.45) (V O4)6 (F0.68 O0.16)2","","- Ca4.45 F1.36 O24.32 Pb5.55 V6 -","- Ca4.44 F1.36 O24.32 Pb5.56 V6 -","- Ca4.44 F1.36 O24.32 Pb5.56 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. II. Equilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","146","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","159198","2020-10-21","18:00:00",""
"2106804","10.0531","","10.0531","","7.3033","","90","","90","","120","","639.219","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Pb7 Ca3) (V O4)6 (F0.53 O0.235)2","","- Ca3 F1.06 O24.47 Pb7 V6 -","- Ca3.04 F1.06 O24.46 Pb6.96 V6 -","- Ca3.04 F1.06 O24.46 Pb6.96 V6 -","1","0.0833333","","Dong Zhili; White, T.J.","Calcium-lead fluoro-vanadinite apatites. II. Equilibrium structures","Acta Crystallographica B (39,1983-)","2004","60","","146","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","159199","2020-10-21","18:00:00",""
"2106830","7.554","","7.554","","14.452","","90","","90","","120","","714.188","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","La (Fe (C N)6) (H2 O)5","","- C6 H10 Fe La N6 O5 -","- C6 Fe La N6 O5 -","- C12 Fe2 La2 N12 O10 -","2","0.166667","","Bailey, W.E.; Williams, R.J.; Milligan, W.O.","The crystal structure of La Fe (C N)6 (H2 O)5","Acta Crystallographica B (24,1968-38,1982)","1973","29","","1365","1368","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106882","6.422","","6.422","","3.742","","90","","90","","120","","133.652","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Nd (O H)3","","- H3 Nd O3 -","- Nd O3 -","- Nd2 O6 -","2","0.166667","","Beall, G.W.; Milligan, W.O.; Dillin, D.R.; Williams, R.; McCoy, J.","Refinement of neodymium trihydroxide","Acta Crystallographica B (24,1968-38,1982)","1976","32","","2227","2229","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106972","9.804","","9.804","","19.49","","90","","90","","120","","1622.37","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- In2.9 Mo15 Se19 -","- In2.87 Mo15 Se19 -","- In5.74 Mo30 Se38 -","2","0.166667","","Gruettner, A.; Yvon, K.; Chevrel, R.; Sergent, M.; Potel, M.; Seeber, B.","In3 Mo15 Se19, containing isolated Mo6 and Mo9 clusters","Acta Crystallographica B (24,1968-38,1982)","1979","35","","285","292","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106973","9.83","","9.83","","19.4","","90","","90","","120","","1623.45","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- In3.3 Mo15 Se19 -","- In3.32 Mo15 Se19 -","- In6.64 Mo30 Se38 -","2","0.166667","","Gruettner, A.; Potel, M.; Yvon, K.; Chevrel, R.; Sergent, M.; Seeber, B.","In3 Mo15 Se19, Containing Isolated Mo6 and Mo9 Clusters","Acta Crystallographica B (24,1968-38,1982)","1979","35","","285","292","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2107033","9.803","","9.803","","6.35","","90","","90","","120","","528.472","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Cd Th (Mo O4)3","","- Cd Mo3 O12 Th -","- Cd Mo3 O12 Th -","- Cd2 Mo6 O24 Th2 -","2","0.166667","","Launay, S.; Rimsky, A.","Structure du Tris(tetraoxomolybdate) de Cadmium et de Thorium","Acta Crystallographica B (24,1968-38,1982)","1980","36","","910","912","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107092","6.489","","6.489","","3.8061","","90","","90","","120","","138.793","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ce (O H)3","","- Ce H3 O3 -","- Ce O3 -","- Ce2 O6 -","2","0.166667","","Mullica, D.F.; Oliver, J.D.; Milligan, W.O.","Cerium Trihydroxide","Acta Crystallographica B (24,1968-38,1982)","1979","35","","2668","2670","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107115","5.16","","5.16","","13.811","","90","","90","","120","","318.46","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ba Fe4 O7 -","- Ba Fe4 O7 -","- Ba2 Fe8 O14 -","2","0.166667","","Okamoto, S.; Okamoto, S.I.; Ito, T.","The crystal structure of barium diferrite","Acta Crystallographica B (24,1968-38,1982)","1973","29","","832","838","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2107226","9.491","","9.491","","6.953","","90","","90","","120","","542.409","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ca3.93 Pb1.07 (P O4)3 (O H)","","- Ca3.93 H O13 P3 Pb1.07 -","- Ca3.9134 O13 P3 Pb1.0866 -","- Ca7.8268 O26 P6 Pb2.1732 -","2","0.166667","","Bigi, A.; Ripamonti, A.; Thomas, S.A.; Brueckner, S.; Roveri, N.; Gazzano, M.","Structure refinements of lead-substituted calcium hydroxyapatite by x-ray powder fitting","Acta Crystallographica B (39,1983-)","1989","45","","247","251","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107228","9.609","","9.609","","7.077","","90","","90","","120","","565.895","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ca2.79 Pb2.21 (P O4)3 (O H)","","- Ca2.79 H O13 P3 Pb2.21 -","- Ca2.7392 O13 P3 Pb2.2608 -","- Ca5.4784 O26 P6 Pb4.5216 -","2","0.166667","","Bigi, A.; Ripamonti, A.; Brueckner, S.; Gazzano, M.; Thomas, S.A.; Roveri, N.","Structure refinement of lead-substituted calcium hydroxyapatite by x-ray powder fitting","Acta Crystallographica B (39,1983-)","1989","45","","247","251","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107230","9.769","","9.769","","7.32","","90","","90","","120","","604.981","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ca.81 Pb4.19 (P O4)3 (O H)","","- Ca0.81 H O13 P3 Pb4.19 -","- Ca0.806 O13 P3 Pb4.194 -","- Ca1.612 O26 P6 Pb8.388 -","2","0.166667","","Bigi, A.; Brueckner, S.; Ripamonti, A.; Gazzano, M.; Roveri, N.; Thomas, S.A.","Structure refinement of lead-substituted calcium hydroxyapatite by x-ray powder fitting","Acta Crystallographica B (39,1983-)","1989","45","","247","251","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107233","9.375","","9.375","","6.8904","","90","","90","","120","","524.466","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ca5.14 Sb.092 (P O4.082)3 F.97","","- Ca5.14 F0.97 O12.246 P3 Sb0.092 -","- Ca5.143 F0.9666 O12.246 P3 Sb0.0969 -","- Ca10.286 F1.9332 O24.492 P6 Sb0.1938 -","2","0.166667","","de Boer, B.G.; Young, R.A.; Cagle, J.R.; Sakthivel, A.","Determination of the antimony substitution site in calcium fluorapatite from powder x-ray diffraction data","Acta Crystallographica B (39,1983-)","1991","47","","683","692","","","","","","","","","","","","","","","","","","","","","","has coordinates","168920","2020-10-21","18:00:00",""
"2107234","9.3713","","9.3713","","6.8866","","90","","90","","120","","523.763","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Ca5.17 Sb.14 (P O4.138)3 F1.04","","- Ca5.17 F1.04 O12.414 P3 Sb0.14 -","- Ca5.171 F1.042 O12.414 P3 Sb0.14 -","- Ca10.342 F2.084 O24.828 P6 Sb0.28 -","2","0.166667","","de Boer, B.G.; Sakthivel, A.; Cagle, J.R.; Young, R.A.","Determination of the antimony substitution site in calcium fluorapatite from powder x-ray diffraction data","Acta Crystallographica B (39,1983-)","1991","47","","683","692","","","","","","","","","","","","","","","","","","","","","","has coordinates","168922","2020-10-21","18:00:00",""
"2107272","15.5643","0.0006","15.5643","0.0006","8.0123","0.0005","90","","90","","120","","1680.92","0.14","150","2","150","2","","","","","","","","5","P 63/m","-P 6c","176","imidazolium lead iodide","","","- C3 H5 I3 N2 Pb -","- C3 H5 I3 N2 Pb -","- C18 H30 I18 N12 Pb6 -","6","0.5","","Weber, Oliver J.; Marshall, Kayleigh L.; Dyson, Lewis M.; Weller, Mark T.","Structural diversity in hybrid organic‒inorganic lead iodide materials","Acta Crystallographica Section B","2015","71","6","668","678","10.1107/S2052520615019885","","","0.71073","MoKα","","0.1182","0.0956","","","0.2107","0.2254","","","","","","1.121","","","","has coordinates,has Fobs","170697","2020-10-21","18:00:00",""
"2107364","10.49","","10.49","","21.24","","90","","90","","120","","2024.12","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","K Na22 (Cl (C O3)2 (S O4)9)","","- C2 Cl K Na22 O42 S9 -","- C2 Cl K Na22 O42 S9 -","- C4 Cl2 K2 Na44 O84 S18 -","2","0.166667","","Kato, K.; Saalfeld, H.","The crystal structure of hansakite, K Na22 (Cl (C O3)2 (S O4)9) and its relation to the K2 S O4 I structure type","Acta Crystallographica B (24,1968-38,1982)","1972","28","","3614","3617","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2108352","9.502","0","9.502","0","6.8356","0.0048","90","","90","","120","","534.5","0.4","","","295","","","","","","","","","5","P 63/m","-P 6c","176","","Chlorapatite","","- Ca5 Cl0.9 F0.1 O12 P3 -","- Ca5 Cl0.88 F0.12 O12 P3 -","- Ca10 Cl1.76 F0.24 O24 P6 -","2","0.166667","BM5088","Christoph, Staehli; Thuering, Juerg; Galea, Laetitia; Tadier, Solene; Bohner, Marc; Doebelin, Nicola","Hydrogen-substituted beta-tricalcium phosphate synthesized in organic media","Acta Crystallographica, Section B","2016","72","06","875","884","10.1107/S2052520616015675","powder diffraction","x-ray","1.5406","","","","","","","","","","","1.0638","","","","","","","has coordinates,has Fobs","213161","2020-10-21","18:00:00",""
"2108622","13.7828","0.0009","13.7828","0.0009","7.3148","0.0005","90","","90","","120","","1203.39","0.14","80","1","80","1","","","","","","","","6","P 63/m","-P 6c","176","","","","- C3 H18 F9 Gd O18 S3 -","- C3 H18 F9 Gd O18 S3 -","- C6 H36 F18 Gd2 O36 S6 -","2","0.166667","","Janicki, Rafał; Starynowicz, Przemysław","Analysis of charge density in nonaaquagadolinium(III) trifluoromethanesulfonate ‒ insight into Gd^III^—OH~2~ bonding","Acta Crystallographica Section B","2020","76","4","","","10.1107/S2052520620006903","","x-ray","0.71073","MoKα","","0.012","0.009","","","","0.023","","","","","","1.837","","","","has coordinates","254172","2020-10-21","18:00:00",""
"2109025","10.2722","0.0003","10.2722","0.0003","7.4537","0.0003","90","","90","","120","","681.13","0.04","393","2","393","2","","","","","","","","4","P 63/m","-P 6c","176","mimetite","","","- As3 Cl O12 Pb5 -","- As3 Cl O12 Pb5 -","- As6 Cl2 O24 Pb10 -","2","0.166667","","Cametti, Georgia; Nagashima, Mariko; Churakov, Sergey V.","Role of lone-pair electron localization in temperature-induced phase transitions in mimetite","Acta Crystallographica Section B","2022","78","4","","","10.1107/S2052520622006254","","","0.56087","AgKα","","0.0317","0.0265","","","0.0581","0.0594","","","","","","1.145","","","","has coordinates","276890","2022-07-23","03:48:16",""
"2109070","10.149","0.0013","10.149","0.0013","6.7957","0.0018","90","","90","","120","","606.19","0.19","294","","294","","","","","","","","synthetic","4","P 63/m","-P 6c","176","","","","- Ca5 Cl O12 V3 -","- Ca5 Cl O12 V3 -","- Ca10 Cl2 O24 V6 -","2","0.166667","","Matsuura, Mimiko; Okudera, Hiroki","Structures of Ca~5~(VO~4~)~3~Cl and Ca~4.78(1)~Na~0.22~(PO~4~)~3~Cl~0.78~: positions of channel anions and repulsion on the anion in apatite-type compounds","Acta Crystallographica Section B","2022","78","5","","","10.1107/S2052520622008095","powder diffraction","","0.71069","Mo-Kα","","","0.0188","","","","0.0178","","","","","","0.3924","","","","has coordinates,has Fobs","277758","2022-09-10","01:16:55",""
"2109071","9.5773","0.0005","9.5773","0.0005","6.8033","0.0006","90","","90","","120","","540.43","0.06","294","","294","","","","","","","","synthetic","5","P 63/m","-P 6c","176","","","","- Ca4.78 Cl0.78 Na0.22 O12 P3 -","- Ca4.78 Cl0.78 Na0.22 O12 P3 -","- Ca9.56 Cl1.56 Na0.44 O24 P6 -","2","0.166667","","Matsuura, Mimiko; Okudera, Hiroki","Structures of Ca~5~(VO~4~)~3~Cl and Ca~4.78(1)~Na~0.22~(PO~4~)~3~Cl~0.78~: positions of channel anions and repulsion on the anion in apatite-type compounds","Acta Crystallographica Section B","2022","78","5","","","10.1107/S2052520622008095","powder diffraction","","0.71069","Mo-Kα","","","0.0269","","","","0.0286","","","","","","0.8593","","","","has coordinates,has Fobs","277758","2022-09-10","01:16:55",""
"2201245","9.4959","0.001","9.4959","0.001","7.0361","0.0007","90","","90","","120","","549.46","0.1","295","2","295","2","","","","","","","","3","P 63/m","-P 6c","176","samarium orthosilicate oxyapatite","","","- O13 Si3 Sm5 -","- O13 Si3 Sm5 -","- O26 Si6 Sm10 -","2","0.166667","","Morgan, Mark G.; Wang, Meitian; Mar, Arthur","Samarium orthosilicate oxyapatite, Sm~5~(SiO~4~)~3~O","Acta Crystallographica, Section E","2002","58","","i70","i71","10.1107/S1600536802011868","","","","","","","","","","","","","","","","","","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2206572","10.5565","0.0001","10.5565","0.0001","7.7584","0.0001","90","","90","","120","","748.76","0.014","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","Barium vanadate chloride","Pentabarium tris(vanadate) chloride","","- Ba5 Cl O12 V3 -","- Ba5 Cl O12 V3 -","- Ba10 Cl2 O24 V6 -","2","0.166667","WM6071","Roh, Yun-Ho; Hong, Seung-Tae","Apatite-type Ba~5~(VO~4~)~3~Cl","Acta Crystallographica, Section E","2005","61","8","i140","i142","10.1107/S1600536805018854","","","0.71073","MoKα","","0.02","0.015","","0.0383","0.0344","0.0344","","","","","","0.4614","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2206647","10.2197","0.0004","10.2197","0.0004","28.3118","0.0014","90","","90","","120","","2560.79","0.19","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","Hexakis(1-oxido-1H-benzotriazol-3-ium-κO)iron(III) tris(perchlorate) acetonitrile disolvate","","- C40 H36 Cl3 Fe N20 O18 -","- C40 H36 Cl3 Fe N20 O18 -","- C80 H72 Cl6 Fe2 N40 O36 -","2","0.166667","BV6025","Zhang, Xian-Ming","Hexakis(1-oxido-1<i>H</i>-benzotriazol-3-ium-κ<i>O</i>)iron(III) tris(perchlorate) acetonitrile disolvate","Acta Crystallographica, Section E","2005","61","9","o1799","o1800","10.1107/S1600536805025882","","","0.71073","MoKα","","0.0558","0.0411","","","0.0965","0.1136","","","","","","1.142","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2207082","9.6366","0.0001","9.6366","0.0001","11.6119","0.0003","90","","90","","120","","933.86","0.03","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","silver caesium nonamolybdenum undecasulfide","","- Ag1.91 Cs1.16 Mo9 S11 -","- Ag1.908 Cs1.161 Mo9 S11 -","- Ag3.816 Cs2.322 Mo18 S22 -","2","0.166667","WM6090","Salloum, D.; Gougeon, P.; Potel, M.","Ag~1.91~Cs~1.16~Mo~9~S~11~: a novel quaternary reduced molybdenum sulfide containing Mo~9~ clusters","Acta Crystallographica Section E","2005","61","10","i213","i215","10.1107/S1600536805028205","","","0.71069","MoKα","","0.0262","0.0217","","","0.045","0.0457","","","","","","1.081","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2207368","19.4419","0.0003","19.4419","0.0003","6.5498","0.0001","90","","90","","120","","2144.06","0.06","120","2","120","2","","","","","","","","5","P 63/m","-P 6c","176","","8-Methyl-5-oxo-5,6-dihydrodipyrido[1,2-a:3',2'-e]pyrimidin-11-ium chloride trihydrate","","- C12 H16 Cl N3 O4 -","- C12 H16 Cl N3 O4 -","- C72 H96 Cl6 N18 O24 -","6","0.5","WK6062","Howie, R. Alan; de Lima Ferreira, Marcelle de; de Souza, Marcus V. N.; Vasconcelos, Thatyana R. A.; Wardell, Solange M.S.V.; Wardell, James L.","8-Methyl-5-oxo-5,6-dihydrodipyrido[1,2-<i>a</i>:3',2'-<i>e</i>]pyrimidin-11-ium chloride trihydrate 120 K","Acta Crystallographica Section E","2005","61","11","o3579","o3581","10.1107/S1600536805031521","","","0.71073","MoKα","","0.0365","0.0319","","","0.0872","0.0904","","","","","","1.148","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2208196","9.8888","0.0002","9.8888","0.0002","11.6398","0.0003","90","","90","","120","","985.74","0.04","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","Sodium caesium nonamolybdenum undecasulfide","","- Cs1.14 Mo9 Na2.54 S11 -","- Cs1.138 Mo9 Na2.535 S11 -","- Cs2.276 Mo18 Na5.07 S22 -","2","0.166667","WM6131","Salloum, D.; Gougeon, P.; Potel, M.","Na~2.54~Cs~1.14~Mo~9~S~11~, a quaternary reduced molybdenum sulfide containing Mo~9~ clusters.","Acta Crystallographica, Section E","2006","62","2","35","i37","10.1107/S1600536806002984","","","0.71069","MoKα","","0.0498","0.0288","","","0.0611","0.0665","","","","","","1.155","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2208743","9.7969","0.0001","9.7969","0.0001","19.3973","0.0004","90","","90","","120","","1612.31","0.04","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","holmium indium molybdenum selenide","","- Ho0.76 In1.68 Mo15 Se19 -","- Ho0.7659 In1.684 Mo15 Se19 -","- Ho1.5318 In3.368 Mo30 Se38 -","2","0.166667","WM2003","Salloum, D.; Gougeon, P.; Potel, M.","Ho~0.76~In~1.68~Mo~15~Se~19~","Acta Crystallographica Section E","2006","62","4","i83","i85","10.1107/S1600536806007446","","","0.71069","MoKα","","0.0771","0.0402","","","0.0768","0.0877","","","","","","1.067","","","","has coordinates","176774","2020-10-21","18:00:00",""
"2211964","9.8076","0.0001","9.8076","0.0001","19.6036","0.0003","90","","90","","120","","1633.02","0.03","293","","293","2","","","","","","","","4","P 63/m","-P 6c","176","","indium dipotassium pentadecamolybdate nonadecaselenide","","- In0.875 K2 Mo15 Se19 -","- In0.873 K2 Mo15 Se19 -","- In1.746 K4 Mo30 Se38 -","2","0.166667","WM2077","Salloum, D.; Gougeon, P.; Potel, M.","In~0.87~K~2~Mo~15~Se~19~: a quaternary selenide containing Mo~6~ and Mo~9~ clusters","Acta Crystallographica Section E","2007","63","1","i8","i10","10.1107/S1600536806052974","","","0.71069","MoKα","","0.0374","0.0374","","","0.0401","0.0401","","","","","","1.15","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2217592","13.446","0.0019","13.446","0.0019","11.528","0.002","90","","90","","120","","1805","0.5","113","2","113","2","","","","","","","","5","P 63/m","-P 6c","176","","4-Hydroxy-2,2,6,6-tetramethylpiperidinium chloride‒hydroxonium chloride (3/1)","","- C9 H21 Cl1.33 N O1.33 -","- C9 H21 Cl1.33333 N O1.33333 -","- C54 H126 Cl8 N6 O8 -","6","0.5","NC2088","Li Zhang; Peng-Wei Zhang; Xiao-Hui Wang; Li Chen; Qu-Fei Shen","4-Hydroxy-2,2,6,6-tetramethylpiperidinium chloride‒hydroxonium chloride (3/1)","Acta Crystallographica Section E","2008","64","2","o512","o512","10.1107/S1600536808002158","","","0.71073","MoKα","","0.0553","0.0505","","","0.1257","0.1297","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2219080","17.2989","0.0003","17.2989","0.0003","14.4545","0.0006","90","","90","","120","","3746.03","0.18","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","[μ~3~-2,2,4,4,6,6-Hexakis(3,5-dimethylpyrazol-1-yl)-2λ^5^,4λ^5^,6λ^5^- 1,3,5,2,4,6-triazatriphosphinine]tris[<i>cis</i>-dichloridopalladium(II)]","","- C30 H42 Cl6 N15 P3 Pd3 -","- C30 H42 Cl6 N15 P3 Pd3 -","- C60 H84 Cl12 N30 P6 Pd6 -","2","0.166667","KP2182","Yun, Sung Yol; Lee, Soon W.","[μ~3~-2,2,4,4,6,6-Hexakis(3,5-dimethylpyrazol-1-yl)-2λ^5^,4λ^5^,6λ^5^-1,3,5,2,4,6-triazatriphosphinine]tris[<i>cis</i>-dichloridopalladium(II)]","Acta Crystallographica Section E","2008","64","8","m1084","","10.1107/S1600536808023167","","","0.71073","MoKα","","0.0716","0.0346","","","0.0847","0.1083","","","","","","1.069","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2219456","10.557","0.0001","10.557","0.0001","7.73912","0.00008","90","","90","","120","","746.98","0.01","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","Barium As-apatite","pentabarium tris(arsenate(V)) chloride","","- As3 Ba5 Cl O12 -","- As3 Ba5 Cl O12 -","- As6 Ba10 Cl2 O24 -","2","0.166667","WM2188","Bell, Anthony M. T.; Henderson, C. Michael B.; Wendlandt, Richard F.; Harrison, Wendy J.","Rietveld refinement of Ba~5~(AsO~4~)~3~Cl from high-resolution synchrotron data","Acta Crystallographica Section E","2008","64","9","i63","i64","10.1107/S1600536808026901","","","0.998043","Synchrotron","","0.0898","","","","","","","","1.227","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2220994","10.1969","0.0001","10.1969","0.0001","7.28108","0.00009","90","","90","","120","","655.636","0.012","298","","298","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","Strontium As-apatite","pentastrontium tris[arsenate(V)] chloride","","- As3 Cl O12 Sr5 -","- As3 Cl O12 Sr5 -","- As6 Cl2 O24 Sr10 -","2","0.166667","BR2096","Bell, Anthony M. T.; Henderson, C. Michael B.; Wendlandt, Richard F.; Harrison, Wendy J.","Rietveld refinement of Sr~5~(AsO~4~)~3~Cl from high-resolution synchrotron data","Acta Crystallographica Section E","2009","65","3","i16","i17","10.1107/S1600536809005054","","","0.998043","Synchrotron","","","","","","","","","","1.998","","","","","","","has coordinates","282548","2023-04-10","20:38:56",""
"2221283","9.5974","0.0002","9.5974","0.0002","19.1668","0.0005","90","","90","","120","","1528.93","0.06","295","2","","","","","","","","","","4","P 63/m","-P 6c","176","","indium pentadecamolybdenum nonadeca(sulfide/selenide)","","- In4.07 Mo15 S11.87 Se7.13 -","- In4.076 Mo15 S11.872 Se7.128 -","- In8.152 Mo30 S23.744 Se14.256 -","2","0.166667","BR2099","Lee, You-Soon; Kang, Sung Kwon","The Chevrel phase In~4.07~Mo~15~S~11.87~Se~7.13~ with mixed chalcogenide occupancy","Acta Crystallographica Section E","2009","65","4","i26","","10.1107/S1600536809007351","","","0.71073","MoKα","","","0.0388","","","","0.09","","","","","","1.414","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2221592","9.3405","0.0001","9.3405","0.0001","6.7638","0.0001","90","","90","","120","","511.048","0.011","295","","300","","","","","","","","","4","P 63/m","-P 6c","176","Oxyapatite","Sodium holmium orthosilicate oxyapatite","","- Ho7.73 Na2.27 O24.72 Si6 -","- Ho7.73 Na2.27 O24.716 Si6 -","- Ho7.73 Na2.27 O24.716 Si6 -","1","0.0833333","BR2094","Rosales, Ivonne; Orozco, Eligio; Bucio, Lauro; Fuentes, Maria E.; Fuentes, Luis","A synchrotron study of Na~2.27~Ho~7.73~(SiO~4~)~6~O~0.72~","Acta Crystallographica Section E","2009","65","5","i33","","10.1107/S1600536809011866","","","1.03349","synchrotron","","","","","","","","","","1.27","","","","","","","has coordinates","176789","2020-10-21","18:00:00",""
"2224068","10.4868","0.0015","10.4868","0.0015","22.794","0.005","90","","90","","120","","2170.9","0.6","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","μ~3~-Oxido-hexa-μ~2~-pivalato-tri(methanol-<i>κO</i>) tricobalt(III) chloride","","- C33 H66 Cl Co3 O16 -","- C33 H66 Cl Co3 O16 -","- C66 H132 Cl2 Co6 O32 -","2","0.166667","XU2614","Sun, Yu; Zhu, Li-Li; Zhang, Huai-Hong","<i>{μ</i>}~3~-Oxido-hexa-<i>{μ</i>}~2~-pivalato-tris[(methanol-<i>{κ</i>O})cobalt(III)] chloride","Acta Crystallographica Section E","2009","65","11","m1402","m1403","10.1107/S1600536809041907","","","0.71073","MoKα","","0.0455","0.0374","","","0.0982","0.1018","","","","","","1.11","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2228054","8.0347","0.0008","8.0347","0.0008","7.4163","0.0013","90","","90","","120","","414.63","0.09","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","diiron(III) borotriphosphate","","- B Fe2 O12 P3 -","- B Fe2 O12 P3 -","- B2 Fe4 O24 P6 -","2","0.166667","WM2377","Li, Fei Fei; Zhang, Hui Ju; Zhang, Li Na","Redetermination of Fe~2~[BP~3~O~12~]","Acta Crystallographica Section E","2010","66","9","i63","","10.1107/S1600536810029818","","","0.71073","MoKα","","0.0363","0.0348","","","0.0707","0.0718","","","","","","1.073","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2228065","9.5999","0.0001","9.5999","0.0001","7.1388","0.0001","90","","90","","120","","569.756","0.012","296","2","296","2","","","","","","","","4","P 63/m","-P 6c","176","","Strontium tetrapraseodymium tri(silicate) oxide","","- O13 Pr4 Si3 Sr -","- O13 Pr3.9999 Si3 Sr0.9999 -","- O26 Pr7.9998 Si6 Sr1.9998 -","2","0.166667","WM2391","Sakakura, Terutoshi; Kamoshita, Minami; Iguchi, Hironaga; Wang, Jun; Ishizawa, Nobuo","Apatite-type SrPr~4~(SiO~4~)~3~O","Acta Crystallographica Section E","2010","66","9","i68","","10.1107/S1600536810033349","","","0.71073","MoKα","","0.0213","0.0177","","","0.0454","0.0468","","","","","","1.068","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2228073","9.7361","0.0001","9.7361","0.0001","19.309","0.0004","90","","90","","120","","1585.11","0.04","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","vanadium indium pentadecamolybdenum nonadecaselenide","","- In1.83 Mo15 Se19 V1.42 -","- In1.832 Mo15 Se19 V1.422 -","- In3.664 Mo30 Se38 V2.844 -","2","0.166667","WM2403","Gougeon, Patrick; Gall, Philippe; Salloum, Diala; Potel, Michel","V~1.42~In~1.83~Mo~15~Se~19~","Acta Crystallographica Section E","2010","66","10","i73","","10.1107/S1600536810036834","","","0.71069","MoKα","","0.0665","0.0366","","","0.0773","0.0868","","","","","","1.077","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2230093","7.9772","0.0004","7.9772","","10.2975","0.0006","90","","90","","120","","567.5","0.04","150","2","150","2","","","","","","","","3","P 63/m","-P 6c","176","","Tris(η^5^-cyclopentadienyl)hafnium(III)","","- C15 H15 Hf -","- C15 H15 Hf -","- C30 H30 Hf2 -","2","0.166667","NG5148","Burlakov, Vladimir V.; Arndt, Perdita; Spannenberg, Anke; Rosenthal, Uwe","Tris(η^5^-cyclopentadienyl)hafnium(III)","Acta Crystallographica Section E","2011","67","5","m629","","10.1107/S1600536811014516","","","0.71073","MoKα","","0.0382","0.0336","","","0.0737","0.0759","","","","","","1.217","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2238575","13.5059","0.0005","13.5059","0.0005","5.8903","0.0002","90","","90","","120","","930.5","0.06","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","Hexacopper(II) calcium/yttrium tris(arsenate/phosphate) hexahydroxide trihydrate","","- As2.48 Ca0.31 Cu5.7 H12 O21 P0.51 Y0.69 -","- As2.484 Ca0.31 Cu5.7 O20.9998 P0.516 Y0.69 -","- As4.968 Ca0.62 Cu11.4 O41.9996 P1.032 Y1.38 -","2","0.166667","WM2763","Morrison, Shaunna M.; Domanik, Kenneth J.; Origlieri, Marcus J.; Downs, Robert T.","Agardite-(Y), Cu^2+^~6~Y(AsO~4~)~3~(OH)~6~·3H~2~O","Acta Crystallographica Section E","2013","69","9","i61","i62","10.1107/S1600536813023477","","","0.71073","MoKα","","0.0416","0.032","","","0.0813","0.0858","","","","","","1.138","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2238670","9.8647","0.0001","9.8647","0.0001","19.5957","0.0003","90","","90","","120","","1651.43","0.03","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","Tetrasodium pentadecamolybdenum nonadecaselenide","","- Mo15 Na3.88 Se19 -","- Mo15 Na3.884 Se19 -","- Mo30 Na7.768 Se38 -","2","0.166667","RU2054","Salloum, Diala; Gougeon, Patrick; Gall, Philippe","Na~3.88~Mo~15~Se~19~: a novel ternary reduced molybdenum selenide containing Mo~6~ and Mo~9~ clusters","Acta Crystallographica Section E","2013","69","10","i67","i68","10.1107/S1600536813025907","","","0.71069","MoKα","","0.0427","0.0326","","","0.0787","0.0836","","","","","","1.056","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2239626","9.534","0.0001","9.534","0.0001","18.9803","0.0003","90","","90","","120","","1494.11","0.03","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","Tetrasodium pentadecamolybdenum nonadecasulfide","","- Mo15 Na4.25 S19 -","- Mo15 Na4.253 S19 -","- Mo30 Na8.506 S38 -","2","0.166667","RU2060","Salloum, D.; Gougeon, P.; Gall, P.","Na~4.25~Mo~15~S~19~: a novel ternary reduced molybdenum sulfide containing Mo~6~ and Mo~9~ clusters","Acta Crystallographica Section E","2014","70","6","i30","","10.1107/S160053681401201X","","","0.71069","MoKα","","0.0354","0.0304","","","0.0755","0.0787","","","","","","1.13","","","","has coordinates,has Fobs","176798","2020-10-21","18:00:00",""
"2240822","9.753","0.0002","9.753","0.0002","19.3977","0.0002","90","","90","","120","","1597.93","0.05","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","Scandium indium pentadecamolybdenum nonadecaselenide","","- In1.39 Mo15 Sc1.91 Se19 -","- In1.39 Mo15 Sc1.914 Se19 -","- In2.78 Mo30 Sc3.828 Se38 -","2","0.166667","WM5164","Gougeon, Patrick; Gall, Philippe; Salloum, Diala","Crystal structure of Sc~1.91~In~1.39~Mo~15~Se~19~, containing Mo~6~ and Mo~9~ clusters","Acta Crystallographica Section E","2015","71","7","760","762","10.1107/S2056989015010634","","","0.71069","MoKα","","0.0498","0.0309","","","0.0583","0.0633","","","","","","1.083","","","","has coordinates,has Fobs","139190","2020-10-21","18:00:00",""
"2241479","9.5507","0.0003","9.5507","0.0003","7.0513","0.0003","90","","90","","120","","557.02","0.03","298","2","298","2","","","","","","","","4","P 63/m","-P 6c","176","","Dicalcium octaneodymium hexakis(orthosilicate) dioxide","","- Ca2.49 Nd7.51 O25.75 Si6 -","- Ca2.494 Nd7.506 O25.76 Si6 -","- Ca2.494 Nd7.506 O25.76 Si6 -","1","0.0833333","RU2066","Le, Thu Hoai; Brooks, Neil R.; Binnemans, Koen; Blanpain, Bart; Guo, Muxing; Van Meervelt, Luc","Crystal structure of apatite type Ca~2.49~Nd~7.51~(SiO~4~)~6~O~1.75~","Acta Crystallographica Section E","2016","72","2","209","211","10.1107/S205698901600089X","","","0.71073","MoKα","","0.0215","0.0186","","","0.0339","0.0348","","","","","","1.108","","","","has coordinates,has disorder,has Fobs","174634","2020-10-21","18:00:00",""
"2242532","9.59912","0.00006","9.59912","0.00006","7.09284","0.00006","90","","90","","120","","565.996","0.007","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","","Dicalcium octacerium hexakis(silicate) dioxide","","- Ca2 Ce8 O26 Si6 -","- Ca2 Ce8 O26 Si6 -","- Ca2 Ce8 O26 Si6 -","1","0.0833333","","Massoni, Nicolas; Hegron, Ronan; Campayo, Lionel","Reinvestigation of the crystal structure of Ca~2~Ce~8~(SiO~4~)~6~O~2~ apatite by Rietveld refinement","Acta Crystallographica Section E","2018","74","7","955","959","10.1107/S2056989018008435","powder diffraction","","1.54176","CuKα~1~","","0.0458","0.0438","","0.0442","0.0438","","","","1.76","","","1.76","","","","has coordinates","208302","2020-10-21","18:00:00",""
"2300273","9.421","0.0001","9.421","0.0001","6.88","0.0001","90","","90","","120","","528.826","0.011","293","2","295","","","","","","","","","4","P 63/m","-P 6c","176","Calcium Tris(phosphate(V)) Hydroxide","hydroxyapatite","","- Ca5 H O13 P3 -","- Ca3.66667 O13 P3 -","- Ca7.33333 O26 P6 -","2","0.166667","KS5226","Veselinović, Ljiljana; Karanović, Ljiljana; Stojanović, Zoran; Bračko, Ines; Marković, Smilja; Ignjatović, Nenad; Uskoković, Dragan","Crystal structure of cobalt-substituted calcium hydroxyapatite nanopowders prepared by hydrothermal processing","Journal of Applied Crystallography","2010","43","2","320","327","10.1107/S0021889809051395","powder diffraction","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2300274","9.417","0.0003","9.417","0.0003","6.867","0.0002","90","","90","","120","","527.38","0.03","293","2","295","","","","","","","","","4","P 63/m","-P 6c","176","Calcium Tris(phosphate(V)) Hydroxide","cobalt exchanged hydroxyapatite","","?","- Ca4.86818 Co0.13182 O13 P3 -","- Ca9.73636 Co0.26364 O26 P6 -","2","0.166667","KS5226","Veselinović, Ljiljana; Karanović, Ljiljana; Stojanović, Zoran; Bračko, Ines; Marković, Smilja; Ignjatović, Nenad; Uskoković, Dragan","Crystal structure of cobalt-substituted calcium hydroxyapatite nanopowders prepared by hydrothermal processing","Journal of Applied Crystallography","2010","43","2","320","327","10.1107/S0021889809051395","powder diffraction","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300275","9.4039","0.0004","9.4039","0.0004","6.8526","0.0004","90","","90","","120","","524.81","0.04","293","2","295","","","","","","","","","4","P 63/m","-P 6c","176","Calcium Tris(phosphate(V)) Hydroxide","cobalt exchanged hydroxyapatite","","?","- Ca4.63254 Co0.36746 O13 P3 -","- Ca9.26508 Co0.73492 O26 P6 -","2","0.166667","KS5226","Veselinović, Ljiljana; Karanović, Ljiljana; Stojanović, Zoran; Bračko, Ines; Marković, Smilja; Ignjatović, Nenad; Uskoković, Dragan","Crystal structure of cobalt-substituted calcium hydroxyapatite nanopowders prepared by hydrothermal processing","Journal of Applied Crystallography","2010","43","2","320","327","10.1107/S0021889809051395","powder diffraction","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300276","9.4109","0.0004","9.4109","0.0004","6.8456","0.0004","90","","90","","120","","525.05","0.04","293","2","295","","","","","","","","","4","P 63/m","-P 6c","176","Calcium Tris(phosphate(V)) Hydroxide","cobalt exchanged hydroxyapatite","","?","- Ca4.60593 Co0.39607 O13 P3 -","- Ca9.21186 Co0.79214 O26 P6 -","2","0.166667","KS5226","Veselinović, Ljiljana; Karanović, Ljiljana; Stojanović, Zoran; Bračko, Ines; Marković, Smilja; Ignjatović, Nenad; Uskoković, Dragan","Crystal structure of cobalt-substituted calcium hydroxyapatite nanopowders prepared by hydrothermal processing","Journal of Applied Crystallography","2010","43","2","320","327","10.1107/S0021889809051395","powder diffraction","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300277","9.4072","0.0005","9.4072","0.0005","6.84","0.0002","90","","90","","120","","524.21","0.04","293","2","295","","","","","","","","","4","P 63/m","-P 6c","176","Calcium Tris(phosphate(V)) Hydroxide","cobalt exchanged hydroxyapatite","","?","- Ca4.59531 Co0.40469 O13 P3 -","- Ca9.19062 Co0.80938 O26 P6 -","2","0.166667","KS5226","Veselinović, Ljiljana; Karanović, Ljiljana; Stojanović, Zoran; Bračko, Ines; Marković, Smilja; Ignjatović, Nenad; Uskoković, Dragan","Crystal structure of cobalt-substituted calcium hydroxyapatite nanopowders prepared by hydrothermal processing","Journal of Applied Crystallography","2010","43","2","320","327","10.1107/S0021889809051395","powder diffraction","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:47",""
"2300587","9.3653","","9.3653","","6.8816","","90","","90","","120","","522.713","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Ca9.2 (P O4)5.55 F2","","- Ca9.2 O22.2 -","- Ca9.2 O22.2 -","- Ca9.2 O22.2 -","1","0.0833333","","Young, R.A.; Mackie, P.E.; von Dreele, R.B.","Application of the Pattern-Fitting Structure-Refinement Method to X-ray Powder Diffractometer Patterns","Journal of Applied Crystallography","1977","10","","262","269","","","","","","","","","","","","","","","","","","","","","","has coordinates","174336","2020-10-21","18:00:00",""
"2310013","8.07","","8.07","","4.69","","90","","90","","120","","264.515","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Actinium bromide","","- Ac Br3 -","- Ac Br3 -","- Ac2 Br6 -","2","0.166667","","Zachariasen, W.H.","Crystal chemical studies of the 5f-Series of elements. I. New structure types","Acta Crystallographica (1,1948-23,1967)","1948","1","","265","268","10.1107/S0365110X48000703","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2310015","7.63","","7.63","","4.56","","90","","90","","120","","229.903","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Actinium chloride","","- Ac Cl3 -","- Ac Cl3 -","- Ac2 Cl6 -","2","0.166667","","Zachariasen, W.H.","Crystal chemical studies of the 5f-Series of elements. I. New structure types","Acta Crystallographica (1,1948-23,1967)","1948","1","","265","268","10.1107/S0365110X48000703","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2310334","7.363","","7.363","","4.105","","90","","90","","120","","192.732","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Gd Cl3","","- Cl3 Gd -","- Cl3 Gd -","- Cl6 Gd2 -","2","0.166667","","Au, C.; Au, R.","The crystal structure of Gd Cl3","Acta Crystallographica (1,1948-23,1967)","1967","23","","1112","1112","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310643","7.528","","7.528","","6.253","","90","","90","","120","","306.887","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","(N H2 N H)3 C Cl","","- C H9 Cl N6 -","- C H9 Cl N6 -","- C2 H18 Cl2 N12 -","2","0.166667","","Okaya, Y.; Pepinsky, R.","Crystal Structure of Triaminoguanidium Chloride, (NH~2~.NH)~3~C.Cl","Acta Crystallographica (1,1948-23,1967)","1957","10","11","681","684","10.1107/S0365110X57002364","","","","","","","","","","","","","","","","","","","","","has coordinates","189486","2020-10-21","18:00:00",""
"2310663","10.671","","10.671","","3.6468","","90","","90","","120","","359.627","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Nb3 Te4 -","- Nb3 Te4 -","- Nb6 Te8 -","2","0.166667","","Selte, K.; Kjekshus, A.","The crystal structures of Nb3 Se4 and Nb3 Te4","Acta Crystallographica (1,1948-23,1967)","1964","17","","1568","1572","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310694","7.171","","7.171","","16.258","","90","","90","","120","","724.031","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","K3 (Cl3 (W Cl3)2)","","- Cl9 K3 W2 -","- Cl9 K3 W2 -","- Cl18 K6 W4 -","2","0.166667","","Watson, W.H.; Waser, J.","Refinement of the structure of tripotassium-ditungsten-enneachloride K3 W2 Cl9","Acta Crystallographica (1,1948-23,1967)","1958","11","","689","692","","","","","","","","","","","","","","","","","","","","","","has coordinates","151863","2020-10-21","18:00:00",""
"3000255","16.4089","0.0012","16.4089","0.0012","19.4155","0.0014","90","","90","","120","","4527.3","0.6","298","2","298","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C63 H90 La2 N42 O27 -","- C63 H90 La2 N42 O27 -","- C126 H180 La4 N84 O54 -","2","0.166667","","Esteban-Parra, Ginés M.; Moscoso, Inmaculada; Cepeda, Javier; García, Jose A.; Sánchez-Moreno, Manuel; Rodríguez-Diéguez, Antonio; Quirós, Miguel","Lanthanide(III) Based Complexes Containing 5,7-Dimethyl-1,2,4-triazolo[1,5-a ]pyrimidine as Long-Lived Photoluminescent Antiparasitic Agents","European Journal of Inorganic Chemistry","2020","2020","3","308","","10.1002/ejic.201901119","","","0.71073","MoKα","","0.0297","0.0278","","","0.0747","0.076","","","","","","1.095","","","","has coordinates,has Fobs","247120","2020-10-21","18:00:00",""
"3000267","10.41953","0.0002","10.41953","0.0002","7.84824","0.00019","90","","90","","120","","737.9","0.03","","","","","","","","","","","","4","P 63/m","","","","Decabarium Hexa(vanadate) Difluoride - Synthetic","","- Ba9.6824 F1.366 O24 V6 -","","","","","","Evgeny Bulanov","","To be published in Russian Journal of Inorganic Chemistry","","","","","","","","","","","","0.06965","","","","","","","","","","","","","","","","253246","2020-10-21","18:00:00","2020-11-18"
"3000268","10.53167","0.00015","10.53167","0.00015","7.77554","0.00014","90","","90","","120","","746.89","0.02","","","","","","","","","","","","4","P 63/m","","","","Decabarium Hexa(hypomanganate) Dibromide - Synthetic","","- Ba9.9104 Br0.91 Mn6 O24 -","","","","","","Evgeny Bulanov","","To be published in Russian Journal of Inorganic Chemistry","","","","","","","","","","","","0.05652","","","","","","","","","","","","","","","","253246","2020-10-21","18:00:00","2020-11-18"
"3000269","10.46073","0.00015","10.46073","0.00015","7.75627","0.00013","90","","90","","120","","735.034","0.019","","","","","","","","","","","","4","P 63/m","","","","Decabarium Hexa(hypomanganate) Dibromide - Synthetic","","- Ba9.9944 Cl1.988 Mn6 O24 -","","","","","","Evgeny Bulanov","","To be published in Journal of Organic Chemistry","","","","","","","","","","","","0.05895","","","","","","","","","","","","","","","","253236","2020-10-21","18:00:00","2020-11-18"
"3000270","10.33933","0.00016","10.33933","0.00016","7.86595","0.00014","90","","90","","120","","728.23","0.02","","","","","","","","","","","","4","P 63/m","","","","Decabarium Hexa(hypomanganate) Difluoride - Synthetic","","- Ba9.9586 F1.918 Mn6 O24 -","","","","","","Evgeny Bulanov","","To be published in Journal of Organic Chemistry","","","","","","","","","","","","0.05148","","","","","","","","","","","","","","","","253237","2020-10-21","18:00:00","2020-11-18"
"3000271","10.19198","0.00011","10.19198","0.00011","7.71122","0.0001","90","","90","","120","","693.699","0.014","","","","","","","","","","","","4","P 63/m","","","","Decabarium Hexa(phosphate) Dibromide - Synthetic","","- Ba9.2704 Br0.5408 O24 P6 -","","","","","","Evgeny Bulanov","","To be published in Journal of Organic Chemistry","","","","","","","","","","","","0.08157","","","","","","","","","","","","","","","","253238","2020-10-21","18:00:00","2020-11-18"
"3000272","10.18458","0.00018","10.18458","0.00018","7.71157","0.00015","90","","90","","120","","692.72","0.02","","","","","","","","","","","","4","P 63/m","","","","Decabarium Hexa(phosphate) Dichloride - Synthetic","","- Ba9.4766 Cl0.954 O24 P6 -","","","","","","Evgeny Bulanov","","To be published in Journal of Organic Chemistry","","","","","","","","","","","","0.08157","","","","","","","","","","","","","","","","253239","2020-10-21","18:00:00","2020-11-18"
"3000273","10.17203","0.00013","10.17203","0.00013","7.72261","0.00012","90","","90","","120","","692.006","0.016","","","","","","","","","","","","4","P 63/m","","","","Decabarium Hexa(phosphate) Difluoride - Synthetic","","- Ba10 F2 O24 P6 -","","","","","","Evgeny Bulanov","","To be published in Journal of Organic Chemistry","","","","","","","","","","","","0.07132","","","","","","","","","","","","","","","","253240","2020-10-21","18:00:00","2020-11-18"
"3000274","10.61381","0.00011","10.61381","0.00011","7.76645","0.0001","90","","90","","120","","757.697","0.015","","","","","","","","","","","","4","P 63/m","","","","Decabarium Hexa(vanadate) Dibromide - Synthetic","","- Ba9.9856 Br1.97 O24 V6 -","","","","","","Evgeny Bulanov","","To be published in Journal of Organic Chemistry","","","","","","","","","","","","0.05609","","","","","","","","","","","","","","","","253241","2020-10-21","18:00:00","2020-11-18"
"3000275","10.5438","0.00012","10.5438","0.00012","7.74506","0.00011","90","","90","","120","","745.675","0.016","","","","","","","","","","","","4","P 63/m","","","","Decabarium Hexa(vanadate) Dichloride - Synthetic","","- Ba9.9804 Cl1.966 O24 V6 -","","","","","","Evgeny Bulanov","","To be published in Journal of Organic Chemistry","","","","","","","","","","","","0.06966","","","","","","","","","","","","","","","","253242","2020-10-21","18:00:00","2020-11-18"
"4000078","9.208","0.0003","9.208","0.0003","3.3169","0.0002","90","","90","","120","","243.553","0.018","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ba S8 V6 -","- Ba0.4758 S8 V6 -","- Ba0.4758 S8 V6 -","1","0.0833333","","","","Chemistry of Materials","2001","","","","","","","","0.71073","MoKα","","0.0258","0.024","","","0.056","0.0567","","","","","","1.374","","","","has coordinates","130149","2020-10-21","18:00:00",""
"4000484","9.64","0.02","9.64","0.02","7.08","0.02","90","","90","","120","","571","2","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ce8.67 F0.67 Na1.33 O25.33 Si6 -","- Ce8.68 F0.68 Na1.32 O25.32 Si6 -","- Ce8.68 F0.68 Na1.32 O25.32 Si6 -","1","0.0833333","","","","Chemistry of Materials","2004","","","","","10.1021/cm048402j","","","0.71069","MoKα","","0.0509","0.0262","","","0.0576","0.0616","","","","","","1.126","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000553","9.8","0.001","9.8","0.001","7.3193","0.0008","90","","90","","120","","608.77","0.11","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- Ba4 F2 La6 Na0 O24 Si6 -","- Ba3.98 F2 La6.02 O24 Si6 -","- Ba3.98 F2 La6.02 O24 Si6 -","1","0.0833333","","","","Chemistry of Materials","2005","","","","","10.1021/cm048140l","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"4000556","16.009","0.004","16.009","0.004","21.785","0.009","90","","90","","120","","4835","2","296.1","","","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C12 Cr6 N4 O100 P2 W18 -","- C12 Cr6 N4.02 O100 P2 W18 -","- C24 Cr12 N8.04 O200 P4 W36 -","2","0.166667","","Uchida, Sayaka; Kawamoto, Ryosuke; Akatsuka, Takeo; Hikichi, Shiro; Mizuno, Noritaka","Structures and Sorption Properties of Ionic Crystals of Macrocation-Dawson-Type Polyoxometalates with Different Charges","Chemistry of Materials","2005","17","6","1367","1375","10.1021/cm047879s","","","0.7107","MoKα","","","0.042","","","","0.045","","","","","","1.128","","","","has coordinates","178241","2020-10-21","18:00:00",""
"4000765","11.0914","0.0008","11.0914","0.0008","26.577","0.003","90","","90","","120","","2831.5","0.4","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","Potassium Uranyl Fluoroborate","","","- B25 F22 K11 O51 U6 -","- B25 F22 K11 O51 U6 -","- B50 F44 K22 O102 U12 -","2","0.166667","","Wang, Shuao; Alekseev, Evgeny V.; Diwu, Juan; Miller, Hannah M.; Oliver, Allen G.; Liu, Guokui; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.","Functionalization of Borate Networks by the Incorporation of Fluoride: Syntheses, Crystal Structures, and Nonlinear Optical Properties of Novel Actinide Fluoroborates","Chemistry of Materials","2011","23","11","2931","","10.1021/cm2004984","","","0.71073","MoKα","","0.0487","0.0262","","","0.0457","0.0501","","","","","","0.916","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000793","9.955","0.003","9.955","0.003","4.228","0.003","90","","90","","120","","362.9","0.3","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cu1.76 K0.24 La0.67 Te2 -","- Cu1.758 K0.241333 La0.666667 Te2 -","- Cu5.274 K0.724 La2 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.0274","0.0268","","","0.0613","0.0617","","","","","","1.218","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000794","9.9649","0.0009","9.9649","0.0009","4.2042","0.0009","90","","90","","120","","361.54","0.09","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ce0.67 Cu1.76 K0.24 Te2 -","- Ce0.666667 Cu1.756 K0.243333 Te2 -","- Ce2 Cu5.268 K0.73 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.021","0.0203","","","0.0422","0.0426","","","","","","1.32","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000795","9.9598","0.0007","9.9598","0.0007","4.1763","0.0006","90","","90","","120","","358.78","0.06","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cu1.75 K0.25 Pr0.67 Te2 -","- Cu1.746 K0.254 Pr0.666667 Te2 -","- Cu5.238 K0.762 Pr2 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.0203","0.02","","","0.0438","0.0439","","","","","","1.259","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000796","9.9683","0.0006","9.9683","0.0006","4.159","0.0005","90","","90","","120","","357.9","0.05","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cu1.74 K0.26 Nd0.67 Te2 -","- Cu1.744 K0.255333 Nd0.666667 Te2 -","- Cu5.232 K0.766 Nd2 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.0147","0.0139","","","0.0305","0.0308","","","","","","1.246","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000797","10.0056","0.0008","10.0056","0.0008","4.2336","0.0006","90","","90","","120","","367.05","0.07","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cu1.76 La0.67 Rb0.24 Te2 -","- Cu1.762 La0.666667 Rb0.238667 Te2 -","- Cu5.286 La2 Rb0.716 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.024","0.0231","","","0.0498","0.0503","","","","","","1.244","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000798","10.0014","0.0008","10.0014","0.0008","4.1976","0.0006","90","","90","","120","","363.62","0.07","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ce0.67 Cu1.76 Rb0.24 Te2 -","- Ce0.666667 Cu1.764 Rb0.235333 Te2 -","- Ce2 Cu5.292 Rb0.706 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.0198","0.019","","","0.0414","0.0417","","","","","","1.311","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000799","9.9955","0.0006","9.9955","0.0006","4.1643","0.0005","90","","90","","120","","360.31","0.05","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cu1.78 Pr0.67 Rb0.22 Te2 -","- Cu1.782 Pr0.666667 Rb0.218 Te2 -","- Cu5.346 Pr2 Rb0.654 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.0209","0.0208","","","0.0456","0.0457","","","","","","1.259","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000800","9.9985","0.0008","9.9985","0.0008","4.1487","0.0006","90","","90","","120","","359.18","0.07","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cu1.77 Nd0.67 Rb0.23 Te2 -","- Cu1.768 Nd0.666667 Rb0.232 Te2 -","- Cu5.304 Nd2 Rb0.696 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.0212","0.0211","","","0.0507","0.0507","","","","","","1.277","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000801","10.0841","0.0006","10.0841","0.0006","4.2366","0.0006","90","","90","","120","","373.1","0.06","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cs0.25 Cu1.75 La0.67 Te2 -","- Cs0.251333 Cu1.7488 La0.666667 Te2 -","- Cs0.754 Cu5.2464 La2 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.021","0.0202","","","0.0386","0.0389","","","","","","1.216","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000802","10.0777","0.0007","10.0777","0.0007","4.1918","0.0005","90","","90","","120","","368.68","0.06","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ce0.67 Cs0.26 Cu1.74 Te2 -","- Ce0.666667 Cs0.256 Cu1.744 Te2 -","- Ce2 Cs0.768 Cu5.232 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.0207","0.0203","","","0.0437","0.0439","","","","","","1.248","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000803","10.0763","0.0008","10.0763","0.0008","4.1702","0.0005","90","","90","","120","","366.68","0.06","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cs0.24 Cu1.76 Pr0.67 Te2 -","- Cs0.244 Cu1.756 Pr0.666667 Te2 -","- Cs0.732 Cu5.268 Pr2 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.0189","0.0183","","","0.0408","0.0412","","","","","","1.201","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000804","10.0695","0.0009","10.0695","0.0009","4.1461","0.0008","90","","90","","120","","364.07","0.08","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cs0.25 Cu1.75 Nd0.67 Te2 -","- Cs0.249333 Cu1.75 Nd0.666667 Te2 -","- Cs0.748 Cu5.25 Nd2 Te6 -","3","0.25","","Meng, Chang-Yu; Chen, Hong; Wang, Peng; Chen, Ling","Syntheses, Structures, and Magnetic and Thermoelectric Properties of Double-Tunnel Tellurides: AxRE2Cu6‒xTe6(A = K‒Cs; RE = La‒Nd)","Chemistry of Materials","2011","23","22","4910","","10.1021/cm201574a","","","0.71073","MoKα","","0.0242","0.0235","","","0.0443","0.0446","","","","","","1.246","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000837","4.7652","0.001","4.7652","0.001","15.05","0.003","90","","90","","120","","295.96","0.11","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- B2 Be2 F K O6 Sr -","- B2 Be2 F K O6 Sr -","- B4 Be4 F2 K2 O12 Sr2 -","2","0.166667","","Huang, Hongwei; Yao, Jiyong; Lin, Zheshuai; Wang, Xiaoyang; He, Ran; Yao, Wenjiao; Zhai, Naixia; Chen, Chuangtian","Molecular Engineering Design to Resolve the Layering Habit and Polymorphism Problems in Deep UV NLO Crystals: New Structures in MM′Be2B2O6F (M═Na, M′═Ca; M═ K, M′═Ca, Sr)","Chemistry of Materials","2011","23","24","5457","","10.1021/cm202870q","","","0.71073","MoKα","","0.0392","0.0302","","","0.0603","0.0612","","","","","","2.203","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000949","6.18852","0.00023","6.18852","","16.1277","0.0009","90","","90","","120","","534.91","0.04","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ba4 O9 Ta2 -","- Ba4 O9 Ta2 -","- Ba8 O18 Ta4 -","2","0.166667","","Ling, Chris D.; Avdeev, Maxim; Kharton, Vladislav V.; Yaremchenko, Aleksey A.; Macquart, René B.; Hoelzel, Markus","Structures, Phase Transitions, Hydration, and Ionic Conductivity of Ba4Ta2O9","Chemistry of Materials","2010","22","2","532","","10.1021/cm903170t","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001001","9.1263","0.0002","9.1263","0.0002","2.9899","0.0001","90","","90","","120","","215.664","0.01","173","2","173","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Bi0.78 Li2 O12 Rh6 -","- Bi0.78 Li2 O12 Rh6 -","- Bi0.78 Li2 O12 Rh6 -","1","0.0833333","","Mizoguchi, Hiroshi; Zakharov, L. N.; Marshall, W. J.; Sleight, A. W.; Subramanian, M. A.","AA′2Rh6O12: A New Family of Rhodium Oxides Exhibiting High Thermopower Coupled with High Electrical Conductivity","Chemistry of Materials","2009","21","6","994","","10.1021/cm803345s","","","0.71073","MoKα","","0.0168","0.0153","","","0.0315","0.032","","","","","","1.193","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001002","9.202","0.003","9.202","0.003","2.987","0.002","90","","90","","120","","219.04","0.18","173","2","173","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Bi0.75 O12 Rh4.92 Sc2.18 -","- Bi0.748 O12 Rh4.926 Sc2.176 -","- Bi0.748 O12 Rh4.926 Sc2.176 -","1","0.0833333","","Mizoguchi, Hiroshi; Zakharov, L. N.; Marshall, W. J.; Sleight, A. W.; Subramanian, M. A.","AA′2Rh6O12: A New Family of Rhodium Oxides Exhibiting High Thermopower Coupled with High Electrical Conductivity","Chemistry of Materials","2009","21","6","994","","10.1021/cm803345s","","","0.71073","MoKα","","0.0212","0.0203","","","0.0527","0.054","","","","","","1.282","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001003","8.9927","0.0004","8.9927","0.0004","3.0604","0.0003","90","","90","","120","","214.33","0.02","173","2","173","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Be Bi0.34 O6 Rh3 -","- Be Bi0.341 O6 Rh3 -","- Be2 Bi0.682 O12 Rh6 -","2","0.166667","","Mizoguchi, Hiroshi; Zakharov, L. N.; Marshall, W. J.; Sleight, A. W.; Subramanian, M. A.","AA′2Rh6O12: A New Family of Rhodium Oxides Exhibiting High Thermopower Coupled with High Electrical Conductivity","Chemistry of Materials","2009","21","6","994","","10.1021/cm803345s","","","0.71073","MoKα","","0.0188","0.0186","","","0.0573","0.0574","","","","","","1.032","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001004","9.129","0.004","9.129","0.004","2.985","0.003","90","","90","","120","","215.4","0.3","173","2","173","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Li2 O12 Pb0.76 Rh6 -","- Li2 O12 Pb0.76 Rh6 -","- Li2 O12 Pb0.76 Rh6 -","1","0.0833333","","Mizoguchi, Hiroshi; Zakharov, L. N.; Marshall, W. J.; Sleight, A. W.; Subramanian, M. A.","AA′2Rh6O12: A New Family of Rhodium Oxides Exhibiting High Thermopower Coupled with High Electrical Conductivity","Chemistry of Materials","2009","21","6","994","","10.1021/cm803345s","","","0.71073","MoKα","","0.0255","0.0197","","","0.0396","0.0413","","","","","","1.111","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001102","18.8","0.003","18.8","0.003","14.147","0.003","90","","90","","120","","4330.2","1.3","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C27 H100.5 F4.5 Ge21 N15 Ni2 O51.5 -","- C27 H60 F4.758 Ge21 N15 Ni2 O51.798 -","- C54 H120 F9.516 Ge42 N30 Ni4 O103.596 -","2","0.166667","","Pan, Qinhe; Li, Jiyang; Ren, Xiaoyan; Wang, Zhuopeng; Li, Guanghua; Yu, Jihong; Xu, Ruren","[Ni(1,2-PDA)3]2(HOCH2CH2CH2NH3)3(H3O)2[Ge7O14X3]3(X= F, OH): A New 1D Germanate with 12-Ring Hexagonal Tubular Channels","Chemistry of Materials","2008","20","2","370","","10.1021/cm702439v","","","0.71073","MoKα","","0.058","0.0459","","","0.1167","0.1228","","","","","","1.036","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001166","11.7433","0.0001","11.7433","0.0001","4.1857","0.0001","90","","90","","120","","499.895","0.013","293","","293","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Gd6 Ni1.667 Si3 -","- Gd6 Ni1.668 Si3 -","- Gd12 Ni3.336 Si6 -","2","0.166667","","Gaudin, Etienne; Tencé, Sophie; Weill, François; Rodriguez Fernandez, Jesus; Chevalier, Bernard","Structural and Magnetocaloric Properties of the New Ternary Silicides Gd6M5/3Si3with M = Co and Ni","Chemistry of Materials","2008","20","9","2972","","10.1021/cm8000859","","","0.71069","MoKα","","0.0466","0.0324","","","0.0686","0.0745","","","","1.07","1.07","1.06","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001167","11.7123","0.0004","11.7123","0.0004","4.1705","0.0002","90","","90","","120","","495.45","0.03","120","","120","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Gd6 Ni1.667 Si3 -","- Gd6 Ni1.666 Si3 -","- Gd12 Ni3.332 Si6 -","2","0.166667","","Gaudin, Etienne; Tencé, Sophie; Weill, François; Rodriguez Fernandez, Jesus; Chevalier, Bernard","Structural and Magnetocaloric Properties of the New Ternary Silicides Gd6M5/3Si3with M = Co and Ni","Chemistry of Materials","2008","20","9","2972","","10.1021/cm8000859","","","0.71069","MoKα","","0.0378","0.0262","","","0.0583","0.0617","","","","1.04","1.04","1.02","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001379","6.244","0.004","6.244","0.004","18.479","0.019","90","","90","","120","","623.9","0.9","175","5","175","5","","","","","","","","4","P 63/m","-P 6c","176","Nickel Chromium Phosphorus Sulfide","","","- Cr2 Ni3 P2 Se9 -","- Cr2 Ni3.0001 P2 Se9 -","- Cr4 Ni6.0002 P4 Se18 -","2","0.166667","","McGuire, Michael A.; DiSalvo, Francis J.","Ni3Cr2P2Q9(Q = S, Se): New Quaternary Transition Metal Chalcogenides with a Unique Layered Structure","Chemistry of Materials","2007","19","18","4600","","10.1021/cm070849f","","","0.71073","MoKα","","0.042","0.0235","","","0.0342","0.0356","","","","","","0.805","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001499","7.8762","0.0011","7.8762","0.0011","7.1237","0.0014","90","","90","","120","","382.71","0.11","291","2","291","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Al4 H6 O18 P6 -","- Al4 H6 O18 P6 -","- Al4 H6 O18 P6 -","1","0.0833333","","Li, Niu; Ma, Yanfeng; Xiang, Shouhe; Guan, Naijia","Capturing an Aluminophosphite Intermediate in the New Route of Synthesizing Zeolite-like Aluminophosphates","Chemistry of Materials","2006","18","4","975","","10.1021/cm052327a","","","0.71073","MoKα","","0.0504","0.0444","","","0.1159","0.1207","","","","","","1.15","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001671","9.7508","0.0002","9.7508","0.0002","7.2153","0.0001","90","","90","","120","","594.108","0.019","296","2","296","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge0.77 La9.33 O26 Si5.23 -","- Ge0.768 La9.3302 O26 Si5.232 -","- Ge0.768 La9.3302 O26 Si5.232 -","1","0.0833333","","Fukuda, Koichiro; Asaka, Toru; Ishizawa, Nobuo; Mino, Hiroki; Urushihara, Daisuke; Berghout, Abid; Béchade, Emilie; Masson, Olivier; Julien, Isabelle; Thomas, Philippe","Combined Effect of Germanium Doping and Grain Alignment on Oxide-Ion Conductivity of Apatite-Type Lanthanum Silicate Polycrystal","Chemistry of Materials","2012","24","13","2611","","10.1021/cm301484q","","","0.71073","MoKα","","0.0154","0.0121","","","0.0183","0.0189","","","","1.38","1.38","1.35","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001711","9.721","0.0001","9.721","0.0001","7.1867","0.0001","90","","90","","120","","588.142","0.012","293","","293","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La9.33 O26 Si6 -","- La9.3336 O26 Si6 -","- La9.3336 O26 Si6 -","1","0.0833333","","Fukuda, Koichiro; Asaka, Toru; Oyabu, Masayuki; Urushihara, Daisuke; Berghout, Abid; Béchade, Emilie; Masson, Olivier; Julien, Isabelle; Thomas, Philippe","Crystal Structure and Oxide-Ion Conductivity alongc-Axis of Apatite-Type Lanthanum Silicate with Excess Oxide Ions","Chemistry of Materials","2012","24","23","4623","","10.1021/cm3034643","","","0.71073","MoKα","","0.0145","0.0126","","","0.0186","0.0192","","","","1.26","1.26","1.24","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001712","9.7136","0.0001","9.7136","0.0001","7.1814","0.0001","90","","90","","120","","586.814","0.012","293","","293","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La9.5 O26.26 Si6 -","- La9.5044 O26.2568 Si6 -","- La9.5044 O26.2568 Si6 -","1","0.0833333","","Fukuda, Koichiro; Asaka, Toru; Oyabu, Masayuki; Urushihara, Daisuke; Berghout, Abid; Béchade, Emilie; Masson, Olivier; Julien, Isabelle; Thomas, Philippe","Crystal Structure and Oxide-Ion Conductivity alongc-Axis of Apatite-Type Lanthanum Silicate with Excess Oxide Ions","Chemistry of Materials","2012","24","23","4623","","10.1021/cm3034643","","","0.71073","MoKα","","0.0412","0.0204","","","0.0202","0.0226","","","","1.09","1.09","1.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001760","9.5507","","9.5507","","7.0155","","90","","90","","120","","554.191","","100","","100","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Nd9.468 O26 Si6 -","- Nd9.468 O26 Si6 -","- Nd9.468 O26 Si6 -","1","0.0833333","","An, Tao; Baikie, Tom; Wei, Fengxia; Pramana, Stevin S.; Schreyer, Martin K.; Piltz, Ross O.; Shin, J. Felix; Wei, Jun; Slater, Peter R.; White, Tim J.","Crystallographic Correlations with Anisotropic Oxide Ion Conduction in Aluminum-Doped Neodymium Silicate Apatite Electrolytes","Chemistry of Materials","2013","25","7","1109","","10.1021/cm4000685","","","0.71069","MoKα","","0.0222","0.0213","","","0.058","0.0588","","","","1.83","1.83","1.82","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001761","9.5567","","9.5567","","7.0563","","90","","90","","120","","558.115","","100","","100","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Al0.5 Nd9.772 O26 Si5.5 -","- Al0.4998 Nd9.772 O26 Si5.5002 -","- Al0.4998 Nd9.772 O26 Si5.5002 -","1","0.0833333","","An, Tao; Baikie, Tom; Wei, Fengxia; Pramana, Stevin S.; Schreyer, Martin K.; Piltz, Ross O.; Shin, J. Felix; Wei, Jun; Slater, Peter R.; White, Tim J.","Crystallographic Correlations with Anisotropic Oxide Ion Conduction in Aluminum-Doped Neodymium Silicate Apatite Electrolytes","Chemistry of Materials","2013","25","7","1109","","10.1021/cm4000685","","","0.71069","MoKα","","0.0483","0.047","","","0.1217","0.1222","","","","3.27","3.27","3.22","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001762","9.5537","","9.5537","","7.0528","","90","","90","","120","","557.488","","100","","100","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Al Nd9.782 O26 Si5 -","- Al1.0002 Nd9.78 O26 Si4.9998 -","- Al1.0002 Nd9.78 O26 Si4.9998 -","1","0.0833333","","An, Tao; Baikie, Tom; Wei, Fengxia; Pramana, Stevin S.; Schreyer, Martin K.; Piltz, Ross O.; Shin, J. Felix; Wei, Jun; Slater, Peter R.; White, Tim J.","Crystallographic Correlations with Anisotropic Oxide Ion Conduction in Aluminum-Doped Neodymium Silicate Apatite Electrolytes","Chemistry of Materials","2013","25","7","1109","","10.1021/cm4000685","","","0.71069","MoKα","","0.0372","0.0364","","","0.107","0.1072","","","","3.22","3.22","3.2","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001763","9.5604","","9.5604","","7.0622","","90","","90","","120","","559.014","","100","","100","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Al1.5 Nd9.924 O26 Si4.5 -","- Al1.5 Nd9.924 O26 Si4.5 -","- Al1.5 Nd9.924 O26 Si4.5 -","1","0.0833333","","An, Tao; Baikie, Tom; Wei, Fengxia; Pramana, Stevin S.; Schreyer, Martin K.; Piltz, Ross O.; Shin, J. Felix; Wei, Jun; Slater, Peter R.; White, Tim J.","Crystallographic Correlations with Anisotropic Oxide Ion Conduction in Aluminum-Doped Neodymium Silicate Apatite Electrolytes","Chemistry of Materials","2013","25","7","1109","","10.1021/cm4000685","","","0.71069","MoKα","","0.0276","0.0272","","","0.0873","0.0875","","","","3.05","3.05","3.04","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001764","9.5567","0.0001","9.5567","0.0001","7.0189","0.0001","90","","90","","120","","555.157","0.011","293","","293","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Nd9.348 O26 Si6 -","- Nd9.348 O26 Si6 -","- Nd9.348 O26 Si6 -","1","0.0833333","","An, Tao; Baikie, Tom; Wei, Fengxia; Pramana, Stevin S.; Schreyer, Martin K.; Piltz, Ross O.; Shin, J. Felix; Wei, Jun; Slater, Peter R.; White, Tim J.","Crystallographic Correlations with Anisotropic Oxide Ion Conduction in Aluminum-Doped Neodymium Silicate Apatite Electrolytes","Chemistry of Materials","2013","25","7","1109","","10.1021/cm4000685","","","0.71073","MoKα","","0.0259","0.0253","","","0.0699","0.0702","","","","1.87","1.87","1.86","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001765","9.5516","0.0002","9.5516","0.0002","7.0288","0.0002","90","","90","","120","","555.35","0.02","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Al0.5 Nd9.508 O26 Si5.5 -","- Al0.5004 Nd9.508 O26 Si5.4996 -","- Al0.5004 Nd9.508 O26 Si5.4996 -","1","0.0833333","","An, Tao; Baikie, Tom; Wei, Fengxia; Pramana, Stevin S.; Schreyer, Martin K.; Piltz, Ross O.; Shin, J. Felix; Wei, Jun; Slater, Peter R.; White, Tim J.","Crystallographic Correlations with Anisotropic Oxide Ion Conduction in Aluminum-Doped Neodymium Silicate Apatite Electrolytes","Chemistry of Materials","2013","25","7","1109","","10.1021/cm4000685","","","0.71073","MoKα","","0.0233","0.0221","","","0.0703","0.0707","","","","2.32","2.32","2.3","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001779","9.7094","0.0001","9.7094","0.0001","7.1816","0.0001","90","","90","","120","","586.323","0.012","293","","293","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La9.5 O26 Si5.87 -","- La9.5024 O26 Si5.8728 -","- La9.5024 O26 Si5.8728 -","1","0.0833333","","Fukuda, Koichiro; Asaka, Toru; Hara, Shinji; Oyabu, Masayuki; Berghout, Abid; Béchade, Emilie; Masson, Olivier; Julien, Isabelle; Thomas, Philippe","Crystal Structure and Oxide-Ion Conductivity alongc-Axis of Si-Deficient Apatite-Type Lanthanum Silicate","Chemistry of Materials","2013","25","10","2154","","10.1021/cm400892p","","","0.71073","MoKα","","0.0267","0.0156","","","0.0173","0.0185","","","","1.04","1.04","0.98","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002182","9.5475","0.0003","9.5475","0.0003","7.1019","0.0005","90","","90","","120","","560.64","0.05","100","","100","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Nd8 O26 Si6 Sr2 -","- Nd8 O26 Si6 Sr2 -","- Nd8 O26 Si6 Sr2 -","1","0.0833333","","An, Tao; Baikie, Tom; Weyland, Matthew; Shin, J. Felix; Slater, Peter R.; Wei, Jun; White, Tim J.","Crystal Chemical Analysis of Nd9.33Si6O26and Nd8Sr2Si6O26Apatite Electrolytes Using Aberration-Corrected Scanning Transmission Electron Microscopy and Impedance Spectroscopy","Chemistry of Materials","2015","27","4","1217","","10.1021/cm504009d","","x-ray","0.71069","MoKα","","0.031","0.0304","","","0.0477","0.0479","","","","3.29","3.29","3.29","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002313","8.5712","","8.5712","","9.98","","90","","90","","120","","634.957","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Cs2 Na (H S O4)3","","- Cs2 H3 Na O12 S3 -","- Cs2 H3 Na O12 S3 -","- Cs4 H6 Na2 O24 S6 -","2","0.166667","","Chisholm, C.R.I.; Cowan, L.A.; Haile, S.M.; Klooster, W.T.","Synthesis, structure and properties of compounds in the Na H S O4 -Cs H S O4 system. 1. Crystal structures of Cs2 Na (H S O4)3 and Cs Na2 (H S O4)3","Chemistry of Materials (1,1989-)","2001","13","","2574","2583","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002340","26.157","","26.157","","4.3245","","90","","90","","120","","2562.37","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ba1.073 Bi2 Se4 -","- Ba1.07267 Bi2 Se4 -","- Ba12.872 Bi24 Se48 -","12","1","","Iordanidis, L.; Brazis, P.W.; Kyratsi, T.; Kanatzidis, M.G.; Ireland, J.; Hogan, T.; Lane, M.; Kannewurf, C.R.; Chen, W.; Ghelani, N.; Dyck, J.S.; Uher, C.","A2 Bi8 Se13 (A = Rb, Cs), Cs Bi3.67 Se6 and Ba Bi2 Se4: new ternary semiconducting bismuth selenides","Chemistry of Materials (1,1989-)","2001","13","","622","633","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002379","9.4812","","9.4812","","6.9139","","90","","90","","120","","538.245","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","(Eu8.18 Na1.08) (Si O4)6 (O H)1.62","","- Eu8.18 H1.62 Na1.08 O25.62 Si6 -","- Eu8.18 Na1.08 O25.62 Si6 -","- Eu8.18 Na1.08 O25.62 Si6 -","1","0.0833333","","Ferdov, S.; Sa Ferreira, R.A.; Lin Zhi","Hydrothermal synthesis, structural investigation, photoluminescence features, and emission quantum yield of Eu and Eu-Gd silicates with apatite-type structure","Chemistry of Materials (1,1989-)","2006","18","","5958","5964","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002380","9.494","","9.494","","6.8975","","90","","90","","120","","538.42","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Eu2.46 Gd2.46 Na1.2) (Eu1.5 Gd1.5) (Si O4)6 (O H)1.86","","- Eu3.96 Gd3.96 H1.86 Na1.2 O25.86 Si6 -","- Eu3.96 Gd3.96 Na1.2 O25.86 Si6 -","- Eu3.96 Gd3.96 Na1.2 O25.86 Si6 -","1","0.0833333","","Ferdov, S.; Sa Ferreira, R.A.; Lin Zhi","Hydrothermal synthesis, structural investigation, photoluminescence features, and emission quantum yield of Eu and Eu-Gd silicates with apatite-type structure","Chemistry of Materials (1,1989-)","2006","18","","5958","5964","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002922","7.3957","0.0003","7.3957","0.0003","7.5452","0.0003","90","","90","","120","","357.4","0.02","296","","296","","","","","","","","","3","P 63/m","-P 6c","176","","","","- F2.667 Fe O0.55 -","- F2.66666 Fe O0.54874 -","- F16 Fe6 O3.29244 -","6","0.5","","Lemoine, Kévin; Zhang, Leiting; Dambournet, Damien; Grenèche, Jean-Marc; Hémon-Ribaud, Annie; Leblanc, Marc; Borkiewicz, Olaf J.; Tarascon, Jean-Marie; Maisonneuve, Vincent; Lhoste, Jérôme","Synthesis by Thermal Decomposition of Two Iron Hydroxyfluorides: Structural Effects of Li Insertion","Chemistry of Materials","2019","31","11","4246","","10.1021/acs.chemmater.9b01252","powder diffraction","","1.78901","CoKα","","","","","","","","","6.8247","1.8818","","","","","","","has coordinates","223187","2020-10-21","18:00:00",""
"4003840","9.90381","0.00009","9.90381","0.00009","7.44188","0.00009","90","","90","","120","","632.147","0.011","300","","300","","","","","","","","","5","P 63/m","-P 6c","176","","","","- F0.9 H0.1 Mn3 O12.1 Sr5 -","- F0.9 H0.102 Mn3 O12.102 Sr5 -","- F1.8 H0.204 Mn6 O24.204 Sr10 -","2","0.166667","","Varela, Aurea; Gómez-Recio, Isabel; Serrador, Laura; Hernando, María; Matesanz, Emilio; Torres-Pardo, Almudena; Fernández-Díaz, María Teresa; Martínez, Jose L.; Gonell, Francisco; Rousse, Gwenaelle; Sanchez, Clément; Laberty-Robert, Christel; Portehault, David; González-Calbet, José M.; Parras, Marina","Hydroxyapatites as Versatile Inorganic Hosts of Unusual Pentavalent Manganese Cations","Chemistry of Materials","2020","32","24","10584","10593","10.1021/acs.chemmater.0c03673","powder diffraction","","1.594","neutron","","","","","","","","","2.041","2.2","","","","","","","has coordinates","260420","2021-01-04","03:08:07",""
"4003841","9.90213","0.00011","9.90213","0.00011","7.44471","0.0001","90","","90","","120","","632.173","0.013","300","","300","","","","","","","","","5","P 63/m","-P 6c","176","","","","- F0.83 Mn2.826 O12 Si0.174 Sr5 -","- F0.825 Mn2.826 O12 Si0.174 Sr5 -","- F1.65 Mn5.652 O24 Si0.348 Sr10 -","2","0.166667","","Varela, Aurea; Gómez-Recio, Isabel; Serrador, Laura; Hernando, María; Matesanz, Emilio; Torres-Pardo, Almudena; Fernández-Díaz, María Teresa; Martínez, Jose L.; Gonell, Francisco; Rousse, Gwenaelle; Sanchez, Clément; Laberty-Robert, Christel; Portehault, David; González-Calbet, José M.; Parras, Marina","Hydroxyapatites as Versatile Inorganic Hosts of Unusual Pentavalent Manganese Cations","Chemistry of Materials","2020","32","24","10584","10593","10.1021/acs.chemmater.0c03673","powder diffraction","","1.594","neutron","","","","","","","","","2.3994","2","","","","","","","has coordinates","260420","2021-01-04","03:08:12",""
"4003842","9.95283","0.00009","9.95283","0.00009","7.45254","0.00009","90","","90","","120","","639.334","0.011","300","","300","","","","","","","","","4","P 63/m","-P 6c","176","","","","- H Mn3 O13 Sr5 -","- H Mn3 O13 Sr5 -","- H2 Mn6 O26 Sr10 -","2","0.166667","","Varela, Aurea; Gómez-Recio, Isabel; Serrador, Laura; Hernando, María; Matesanz, Emilio; Torres-Pardo, Almudena; Fernández-Díaz, María Teresa; Martínez, Jose L.; Gonell, Francisco; Rousse, Gwenaelle; Sanchez, Clément; Laberty-Robert, Christel; Portehault, David; González-Calbet, José M.; Parras, Marina","Hydroxyapatites as Versatile Inorganic Hosts of Unusual Pentavalent Manganese Cations","Chemistry of Materials","2020","32","24","10584","10593","10.1021/acs.chemmater.0c03673","powder diffraction","","1.594","neutron","","","","","","","","","2.9519","2","","","","","","","has coordinates","260420","2021-01-04","03:08:15",""
"4003843","9.9572","0.00016","9.9572","0.00016","7.44779","0.00016","90","","90","","120","","639.49","0.02","300","","300","","","","","","","","","5","P 63/m","-P 6c","176","","","","- H0.84 Mn2.841 O12.84 Si0.159 Sr5 -","- H0.842 Mn2.841 O12.842 Si0.159 Sr5 -","- H1.684 Mn5.682 O25.684 Si0.318 Sr10 -","2","0.166667","","Varela, Aurea; Gómez-Recio, Isabel; Serrador, Laura; Hernando, María; Matesanz, Emilio; Torres-Pardo, Almudena; Fernández-Díaz, María Teresa; Martínez, Jose L.; Gonell, Francisco; Rousse, Gwenaelle; Sanchez, Clément; Laberty-Robert, Christel; Portehault, David; González-Calbet, José M.; Parras, Marina","Hydroxyapatites as Versatile Inorganic Hosts of Unusual Pentavalent Manganese Cations","Chemistry of Materials","2020","32","24","10584","10593","10.1021/acs.chemmater.0c03673","powder diffraction","","1.594","neutron","","","","","","","","","2.731","1.6","","","","","","","has coordinates","260420","2021-01-04","03:08:15",""
"4030706","10.584","0.00006","10.584","0.00006","3.72776","0.00003","90","","90","","120","","361.641","0.004","","","293","","","","","","","","","3","P 63/m","-P 6c","176","","","","- H1.1 Mo O3.55 -","- Mo0.876 O3.104 -","- Mo5.256 O18.624 -","6","0.5","","Guo, Jingdong; Zavalij, P.; Whittingham, M. S.","Preparation and characterization of a MoO3 with hexagonal structure","European Journal of Solid State and Inorganic Chemistry","1994","31","","833","842","","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","","0.039","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4030747","12.979","0.001","12.979","0.001","7.755","0.002","90","","90","","120","","1131.3","0.3","","","293","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C3 H18 F9 O18 S3 Sc -","- C3 F9 O18 S3 Sc -","- C6 F18 O36 S6 Sc2 -","2","0.166667","","Bisi Castellani, C.; Carugo, O.; Giusti, M.; Sardone, N.","Crystal structure of scandium(III) triflate enneahydrated","European Journal of Solid State and Inorganic Chemistry","1995","32","","1089","1099","","","x-ray","1.54184","CuKα","","","0.079","","","0.074","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4031195","7.379","","7.379","","4.09","","90","","90","","120","","192.863","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Cf Cl3 -","- Cf Cl3 -","- Cf2 Cl6 -","2","0.166667","","Burns, J.H.; Peterson, J.R.; Baybarz, R.D.","Hexagonal and orthorhombic crystal structures of californium trichloride","Journal of Inorganic and Nuclear Chemistry","1973","35","","1171","1177","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4031381","6.547","","6.547","","3.854","","90","","90","","120","","143.063","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","La (O H)3","","- H3 La O3 -","- La O3 -","- La2 O6 -","2","0.166667","","Beall, G.W.; Milligan, W.O.; Wolcott, H.A.","Structural trends in the lanthanide trihydroxides","Journal of Inorganic and Nuclear Chemistry","1977","39","","65","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031382","6.368","","6.368","","3.683","","90","","90","","120","","129.342","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sm (O H)3","","- H3 O3 Sm -","- O3 Sm -","- O6 Sm2 -","2","0.166667","","Beall, G.W.; Wolcott, H.A.; Milligan, W.O.","Structural trends in the lanthanide trihydroxides","Journal of Inorganic and Nuclear Chemistry","1977","39","","65","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031383","6.329","","6.329","","3.631","","90","","90","","120","","125.958","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Gd (O H)3","","- Gd H3 O3 -","- Gd H3 O3 -","- Gd2 H6 O6 -","2","0.166667","","Beall, G.W.; Wolcott, H.A.; Milligan, W.O.","Structural trends in the lanthanide trihydroxides","Journal of Inorganic and Nuclear Chemistry","1977","39","","65","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031384","6.315","","6.315","","3.603","","90","","90","","120","","124.435","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tb (O H)3","","- H3 O3 Tb -","- O3 Tb -","- O6 Tb2 -","2","0.166667","","Beall, G.W.; Milligan, W.O.; Wolcott, H.A.","Structural trends in the lanthanide trihydroxides","Journal of Inorganic and Nuclear Chemistry","1977","39","","65","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031385","6.286","","6.286","","3.577","","90","","90","","120","","122.405","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Dy (O H)3","","- Dy H3 O3 -","- Dy H3 O3 -","- Dy2 H6 O6 -","2","0.166667","","Beall, G.W.; Milligan, W.O.; Wolcott, H.A.","Structural trends in the lanthanide trihydroxides","Journal of Inorganic and Nuclear Chemistry","1977","39","","65","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031386","6.266","","6.266","","3.553","","90","","90","","120","","120.811","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Ho (O H)3","","- H3 Ho O3 -","- H3 Ho O3 -","- H6 Ho2 O6 -","2","0.166667","","Beall, G.W.; Milligan, W.O.; Wolcott, H.A.","Structural trends in the lanthanide trihydroxides","Journal of Inorganic and Nuclear Chemistry","1977","39","","65","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031387","6.243","","6.243","","3.527","","90","","90","","120","","119.048","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Er (O H)3","","- Er H3 O3 -","- Er H3 O3 -","- Er2 H6 O6 -","2","0.166667","","Beall, G.W.; Milligan, W.O.; Wolcott, H.A.","Structural trends in the lanthanide trihydroxides","Journal of Inorganic and Nuclear Chemistry","1977","39","","65","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031388","6.261","","6.261","","3.544","","90","","90","","120","","120.313","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Y (O H)3","","- H3 O3 Y -","- H3 O3 Y -","- H6 O6 Y2 -","2","0.166667","","Beall, G.W.; Milligan, W.O.; Wolcott, H.A.","Structural trends in the lanthanide trihydroxides","Journal of Inorganic and Nuclear Chemistry","1977","39","","65","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031475","6.456","","6.456","","3.769","","90","","90","","120","","136.045","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Pr (O H)3","","- H3 O3 Pr -","- O3 Pr -","- O6 Pr2 -","2","0.166667","","Mullica, D.F.; Milligan, W.O.; Beall, G.W.","Crystal structures of Pr (O H)3, Eu (O H)3 and Tm (O H)3","Journal of Inorganic and Nuclear Chemistry","1979","41","","525","532","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031476","6.352","","6.352","","3.653","","90","","90","","120","","127.644","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Eu (O H)3","","- Eu H3 O3 -","- Eu O3 -","- Eu2 O6 -","2","0.166667","","Mullica, D.F.; Beall, G.W.; Milligan, W.O.","Crystal structures of Pr (O H)3, Eu (O H)3 and Tm (O H)3","Journal of Inorganic and Nuclear Chemistry","1979","41","","525","532","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031477","6.221","","6.221","","3.503","","90","","90","","120","","117.406","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Tm (O H)3","","- H3 O3 Tm -","- O3 Tm -","- O6 Tm2 -","2","0.166667","","Mullica, D.F.; Milligan, W.O.; Beall, G.W.","Crystal structures of Pr (O H)3, Eu (O H)3 and Tm (O H)3","Journal of Inorganic and Nuclear Chemistry","1979","41","","525","532","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031478","7.507","","7.507","","14.343","","90","","90","","120","","700.009","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","La Co (C N)6 (H2 O)5","","- C6 H10 Co La N6 O5 -","- C6 Co La N6 O5 -","- C12 Co2 La2 N12 O10 -","2","0.166667","","Mullica, D.F.; Milligan, W.O.; Kouba, W.T.","Structural refinement of La Co (C N)6 (H2 O)5","Journal of Inorganic and Nuclear Chemistry","1979","41","","967","973","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031518","7.3743","","7.3743","","4.185","","90","","90","","120","","197.091","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Cm Cl3","","- Cl3 Cm -","- Cl3 Cm -","- Cl6 Cm2 -","2","0.166667","","Peterson, J.R.; Burns, J.H.","Single Crystal and Powder diffraction studies of Curium-248 Trichloride","Journal of Inorganic and Nuclear Chemistry","1973","35","","1525","1530","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4061286","16.7659","0.0005","16.7659","0.0005","45.705","0.003","90","","90","","120","","11126.3","0.8","223","2","223","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C25.67 H41.5 Br F6 N2.83 P Ru S2 -","- C25.6667 H41.99 Br F6 N2.83333 P Ru S2 -","- C308 H503.88 Br12 F72 N34 P12 Ru12 S24 -","12","1","","Shin, Richard Y. C.; Tan, Geok Kheng; Koh, Lip Lin; Goh, Lai Yoong","Syntheses and Single Crystal X-Ray Diffraction Studies of Acyclic and Macrocyclic Aza-dithiolate (NS~2~) Complexes of (Arene)ruthenium(II). Base-Promoted Formation of Tethered Arene and Thiolate-alkylation Derivatives.","Organometallics","2004","23","26","6293","6298","10.1021/om049445c","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4061712","8.5187","0.0008","8.5187","0.0008","10.819","0.002","90","","90","","120","","679.93","0.15","210","2","210","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C12 H27 B -","- C12 H27 B -","- C24 H54 B2 -","2","0.166667","","","","Organometallics","2005","","","","","10.1021/om050572y","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"4062841","12.943","0.003","12.943","0.003","22.537","0.006","90","","90","","120","","3269.6","1.2","90","2","90","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C72 H75 Cl4.53 Ga2 Ge3 -","- C72 H75 Cl2.412 Ga2 Ge3 I0.588 -","- C144 H150 Cl4.824 Ga4 Ge6 I1.176 -","2","0.166667","","","","Organometallics","2004","","","","","10.1021/om0497137","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"4062842","13.0931","0.0013","13.0931","0.0013","22.405","0.003","90","","90","","120","","3326.4","0.7","90","2","90","2","","","","","","","","5","P 63/m","-P 6c","176","Jeff*3Sn3Ge2Cl3","","","- C72 H75 Cl3 Ge2 Sn3 -","- C72 H75 Cl3 Ge2 Sn3 -","- C144 H150 Cl6 Ge4 Sn6 -","2","0.166667","","","","Organometallics","2004","","","","","10.1021/om0497137","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"4063104","9.8373","0.0011","9.8373","0.0011","16.029","0.004","90","","90","","120","","1343.4","0.4","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","sym-[CpRu(mue-S-t-Bu)3RuCp]PF6","","","- C22 H37 F6 P Ru2 S3 -","- C21.9 H36.9 F6.1 P Ru2 S3 -","- C43.8 H73.8 F12.2 P2 Ru4 S6 -","2","0.166667","","Eva Becker; Kurt Mereiter; Roland Schmid; Karl Kirchner","Facile S-S Bond Activation of Alkyl and Aryl Disulfides by [RuCp(CH3CN)3]+ - Formation of Dinuclear Ru(III)-Ru(III) Complexes with Bridging Thiolate Ligands","Organometallics","2004","","","","","10.1021/om0498854","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"4067154","26.4554","0.0011","26.4554","0.0011","11.6852","0.0005","90","","90","","120","","7082.6","0.5","173","1","173","1","","","","","","","","8","P 63/m","-P 6c","176","","","","- C42.5 H50 F6 Fe O7 P Ru S4 -","- C40 H43 F6 Fe O6 P Ru S4 -","- C240 H258 F36 Fe6 O36 P6 Ru6 S24 -","6","0.5","","Yuki, Masahiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki","Preparation of Thiolate-Bridged Dinuclear Ruthenium Complexes Bearing a Phosphine Ligand and Application to Propargylic Reduction of Propargylic Alcohols with 2-Propanol","Organometallics","2010","29","22","5994","","10.1021/om100852x","","","0.71069","MoKα","","0.1055","0.061","","","0.1402","0.1583","","","","","","1.041","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4069036","18.1572","0.0009","18.1572","0.0009","15.8174","0.0016","90","","90","","120","","4516.1","0.6","163","2","163","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C87 H129 La3 N6 Si3 -","- C87.19 H123 La3 N5.79 Si3 -","- C174.38 H246 La6 N11.58 Si6 -","2","0.166667","","Evans, William J.; Montalvo, Elizabeth; Champagne, Timothy M.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Synthetic Diversity in the Formation of Triazoles from Nitriles and Diazo Compounds Using Metallocenes of Electropositive Metals","Organometallics","2009","28","9","2897","","10.1021/om8012103","","","0.71073","MoKα","","0.0315","0.0246","","","0.066","0.0724","","","","","","1.112","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4069037","19.6995","0.0012","19.6995","0.0012","14.4043","0.0018","90","","90","","120","","4841","0.7","208","2","208","2","","","","","","","","5","P 63/m","-P 6c","176","em3","","","- C26 H41 La N2 Si -","- C26 H41 La N2 Si -","- C156 H246 La6 N12 Si6 -","6","0.5","","Evans, William J.; Montalvo, Elizabeth; Champagne, Timothy M.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Synthetic Diversity in the Formation of Triazoles from Nitriles and Diazo Compounds Using Metallocenes of Electropositive Metals","Organometallics","2009","28","9","2897","","10.1021/om8012103","","","0.71073","MoKα","","0.0579","0.0469","","","0.1336","0.1395","","","","","","1.109","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4073041","11.279","0.003","11.279","0.003","16.137","0.005","90","","90","","120","","1777.8","0.9","298","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C32 H54 Ru3 Zn2 -","- C32 H51 Ru3 Zn2 -","- C64 H102 Ru6 Zn4 -","2","0.166667","","Ohashi, Masato; Matsubara, Kouki; Suzuki, Hiroharu","Ruthenium Polyhydrido Clusters Having a Bridging Alkylzinc Group, [(η5-C5Me5)Ru(μ-H)]3(μ3-ZnR)n(μ3-H)2-nand [(η5-C5Me5)Ru]2(μ-ZnR)n(μ-H)4-n(R = Me and Et;n= 1 and 2)","Organometallics","2007","26","9","2330","","10.1021/om070024f","","","0.71069","MoKα","","0.0595","0.0519","","","0.0761","0.0793","","","","","","1.123","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073218","20.3157","0.0008","20.3157","0.0008","14.2464","0.0009","90","","90","","120","","5092.1","0.4","163","2","163","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C99 H141 N6 Sm3 -","- C99 H138 N6 Sm3 -","- C198 H276 N12 Sm6 -","2","0.166667","","Evans, William J.; Montalvo, Elizabeth; Foster, Samuel E.; Harada, Kimberly A.; Ziller, Joseph W.","Reactivity of (C5Me5)2Sm(THF)2with Nitriles: C−C Bond Cleavage To Form Cyanide Complexes","Organometallics","2007","26","11","2904","","10.1021/om070176a","","","0.71073","MoKα","","0.0939","0.0651","","","0.1781","0.2046","","","","","","1.164","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4075869","10.0075","0.0012","10.0075","0.0012","15.452","0.004","90","","90","","120","","1340.2","0.4","161","2","161","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C31 H48 U -","- C31 H48 U -","- C62 H96 U2 -","2","0.166667","","Evans, William J.; Kozimor, Stosh A.; Ziller, Joseph W.","Facile Triphenylborane-Based Syntheses of the Sterically Crowded Tris(pentamethylcyclopentadienyl) Complexes (C5Me5)3UMe and (C5Me5)3UCl","Organometallics","2005","24","14","3407","","10.1021/om050230s","","","0.71073","MoKα","","0.0451","0.0294","","","0.0603","0.0719","","","","","","1.263","","","","has coordinates","178647","2020-10-21","18:00:00",""
"4075990","10.0705","0.0004","10.0705","0.0004","15.5383","0.0008","90","","90","","120","","1364.7","0.1","178","2","178","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C30 H45 Ce -","- C30 H45 Ce -","- C60 H90 Ce2 -","2","0.166667","","Evans, William J.; Perotti, Jeremy M.; Kozimor, Stosh A.; Champagne, Timothy M.; Davis, Benjamin L.; Nyce, Gregory W.; Fujimoto, Cy H.; Clark, Robert D.; Johnston, Matthew A.; Ziller, Joseph W.","Synthesis and Comparative η1-Alkyl and Sterically Induced Reduction Reactivity of (C5Me5)3Ln Complexes of La, Ce, Pr, Nd, and Sm","Organometallics","2005","24","16","3916","","10.1021/om050402l","","","0.71073","MoKα","","0.0196","0.0163","","","0.0408","0.0422","","","","","","1.166","","","","has coordinates","178648","2020-10-21","18:00:00",""
"4075991","10.031","0.0004","10.031","0.0004","15.5223","0.0007","90","","90","","120","","1352.62","0.1","158","2","158","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C30 H45 Pr -","- C30 H45 Pr -","- C60 H90 Pr2 -","2","0.166667","","Evans, William J.; Perotti, Jeremy M.; Kozimor, Stosh A.; Champagne, Timothy M.; Davis, Benjamin L.; Nyce, Gregory W.; Fujimoto, Cy H.; Clark, Robert D.; Johnston, Matthew A.; Ziller, Joseph W.","Synthesis and Comparative η1-Alkyl and Sterically Induced Reduction Reactivity of (C5Me5)3Ln Complexes of La, Ce, Pr, Nd, and Sm","Organometallics","2005","24","16","3916","","10.1021/om050402l","","","0.71073","MoKα","","0.0235","0.0217","","","0.0619","0.0631","","","","","","1.137","","","","has coordinates","178648","2020-10-21","18:00:00",""
"4077065","7.2142","0.001","7.2142","0.001","11.802","0.002","90","","90","","120","","531.94","0.14","100","2","100","2","","","","","","","","3","P 63/m","-P 6c","176","[Mo(butadiene)3]","","","- C12 H18 Mo -","- C12 H18 Mo -","- C24 H36 Mo2 -","2","0.166667","","Kaupp, Martin; Kopf, Thomas; Murso, Alexander; Stalke, Dietmar; Strohmann, Carsten; Hanks, John R.; Cloke, F. Geoffrey N.; Hitchcock, Peter B.","Trigonal Prismatic Structure of Tris(butadiene)molybdenum and Related Complexes Revisited: Diolefin or Metallacyclopentene Coordination?","Organometallics","2002","21","23","5021","","10.1021/om020525v","","","0.71073","MoKα","","0.0214","0.019","","","0.0436","0.0444","","","","","","1.053","","","","has coordinates,has disorder","178659","2020-10-21","18:00:00",""
"4077413","10.0378","0.0002","10.0378","0.0002","15.4285","0.0005","90","","90","","120","","1346.27","0.06","163","2","163","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C30 H46 Th -","- C30 H46 Th -","- C60 H92 Th2 -","2","0.166667","","Evans, William J.; Nyce, Gregory W.; Ziller, Joseph W.","Synthesis of the First Tris(pentamethylcyclopentadienyl) Hydride Complex, (C5Me5)3ThH","Organometallics","2001","20","25","5489","","10.1021/om010596e","","","0.71073","MoKα","","0.0146","0.014","","","0.0318","0.0321","","","","","","1.174","","","","has coordinates","178663","2020-10-21","18:00:00",""
"4078003","24.153","0.0006","24.153","0.0006","16.6932","0.0008","90","","90","","120","","8433.6","0.5","100","2","100","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C43 H63 Au Cl2 F6 N2 P3 Sb -","- C43 H63 Au Cl2 F6 N2 P3 Sb -","- C258 H378 Au6 Cl12 F36 N12 P18 Sb6 -","6","0.5","","Townsend, Nell S.; Green, Michael; Russell, Christopher A.","Cationic Gold(I) Complexes of 2,4,6-Tri-tert-butyl-1,3,5-triphosphabenzene","Organometallics","2012","31","7","2543","","10.1021/om201265n","","","0.71073","MoKα","","0.0972","0.0646","","","0.1738","0.1976","","","","","","1.063","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4081085","14.2605","0.0003","14.2605","0.0003","13.0444","0.0007","90","","90","","120","","2297.33","0.14","173","2","173","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C27 H69.5 N3 O9.25 Sn6 -","- C27 H69 N3 O9.26 Sn6 -","- C54 H138 N6 O18.52 Sn12 -","2","0.166667","","Gock, Michael; Wiedemann, Bianca; Dietz, Christina; Bai, Chenyu; Lutter, Michael; Abeyawarathan, Vinusuya; Jurkschat, Klaus","Simplicity Meets Beauty. Trapping Molecular Dimethyltin Oxide in the Novel Organotinoxo Cluster [MeN(CH2CH2O)2SnMe2.Me2SnO]3","Organometallics","2013","32","15","4262","","10.1021/om400432k","","","0.71073","MoKα","","0.0284","0.0198","","","0.0371","0.0381","","","","","","0.926","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4082994","18.964","0.003","18.964","0.003","17.9495","0.0014","90","","90","","120","","5590.4","1.3","173","","173","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C39 H54 Cl Ir N2 O2 -","- C39 H54 Cl Ir N2 O2 -","- C234 H324 Cl6 Ir6 N12 O12 -","6","0.5","","Nelson, David J.; Collado, Alba; Manzini, Simone; Meiries, Sebastien; Slawin, Alexandra M. Z.; Cordes, David B.; Nolan, Steven P.","Methoxy-FunctionalizedN-Heterocyclic Carbenes","Organometallics","2014","33","8","2048","","10.1021/om5001919","","","0.71075","MoKα","","","0.0273","","","","0.0569","","","","","","1.095","","","","has coordinates","178718","2020-10-21","18:00:00",""
"4083030","13.117","0.0003","13.117","0.0003","27.3137","0.0008","90","","90","","120","","4069.87","0.18","90","2","90","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C50 H66 Cl3 Fe2 Si6 -","- C50 H66 Cl3 Fe2 Si6 -","- C100 H132 Cl6 Fe4 Si12 -","2","0.166667","","Zhao, Pei; Brown, Zachary; Fettinger, James C.; Grandjean, Fernande; Long, Gary J.; Power, Philip P.","Synthesis and Structural Characterization of a Dimeric Cobalt(I) Homoleptic Alkyl and an Iron(II) Alkyl Halide Complex","Organometallics","2014","33","8","1917","","10.1021/om500180u","","","1.54178","CuKα","","0.0442","0.0427","","","0.107","0.1078","","","","","","1.155","","","","has coordinates","178719","2020-10-21","18:00:00",""
"4088015","20.5293","0.0006","20.5293","0.0006","24.4165","0.001","90","","90","","120","","8911.7","0.5","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C150 H186 B6 F24 N54 Rh6 -","- C120 H141 B6 F24.002 N39 Rh6 -","- C240 H282 B12 F48.004 N78 Rh12 -","2","0.166667","","Buck, Dominik M.; Kunz, Doris","Triazine Annelated NHC Featuring Unprecedented Coordination Versatility","Organometallics","2015","34","21","5335","","10.1021/acs.organomet.5b00805","","","0.71073","MoKα","","0.1125","0.0686","","","0.1727","0.1984","","","","","","1.093","","","","has coordinates,has disorder","237212","2020-10-21","18:00:00",""
"4101218","11.9064","0.0015","11.9064","0.0015","25.724","0.007","90","","90","","120","","3158.1","1","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C44 H80 Ge9 K2 N4 Ni2 O13 -","- C43.99 H81.96 Ge9 K2 N4 Ni2 O13 -","- C87.98 H163.92 Ge18 K4 N8 Ni4 O26 -","2","0.166667","","","","Journal of the American Chemical Society","2006","","","","","10.1021/ja058652g","","","","","","","","","","","","","","","","","","","","","has coordinates","277856","2022-09-14","23:31:28",""
"4101307","9.1287","0.0003","9.1287","0.0003","6.4903","0.0005","90","","90","","120","","468.4","0.04","293","","293","","","","210000","","","","","5","P 63/m","-P 6c","176","","","","- C4 H12 Cl3 Mn N -","- C4 Cl3 Mn N -","- C8 Cl6 Mn2 N2 -","2","0.166667","","Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil","Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure.","Journal of the American Chemical Society","2006","128","28","9205","9210","10.1021/ja061923i","","","0.6984","MoKα","","0.0554","0.0458","","0.0602","0.0581","0.0581","","","","","","1.1296","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101308","9.0893","0.0004","9.0893","0.0004","6.4724","0.0007","90","","90","","120","","463.08","0.06","293","","293","","","","380000","","","","","5","P 63/m","-P 6c","176","","","","- C4 H12 Cl3 Mn N -","- C4 Cl3 Mn N -","- C8 Cl6 Mn2 N2 -","2","0.166667","","Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil","Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure.","Journal of the American Chemical Society","2006","128","28","9205","9210","10.1021/ja061923i","","","0.6984","MoKα","","0.0623","0.052","","0.0609","0.0563","0.0563","","","","","","1.1458","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101309","8.9326","0.0002","8.9326","0.0002","6.401","0.0004","90","","90","","120","","442.32","0.03","293","","293","","","","1220000","","","","","5","P 63/m","-P 6c","176","","","","- C4 H12 Cl3 Mn N -","- C4 Cl3 Mn N -","- C8 Cl6 Mn2 N2 -","2","0.166667","","Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil","Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure.","Journal of the American Chemical Society","2006","128","28","9205","9210","10.1021/ja061923i","","","0.71073","MoKα","","0.0591","0.0456","","0.0584","0.0524","0.0524","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101310","8.8728","0.0008","8.8728","0.0008","6.362","0.0014","90","","90","","120","","433.76","0.11","293","","293","","","","1700000","","","","","5","P 63/m","-P 6c","176","","","","- C4 H12 Cl3 Mn N -","- C4 Cl3 Mn N -","- C8 Cl6 Mn2 N2 -","2","0.166667","","Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil","Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure.","Journal of the American Chemical Society","2006","128","28","9205","9210","10.1021/ja061923i","","","0.6984","MoKα","","0.1112","0.0696","","0.1104","0.0891","0.0891","","","","","","1.1377","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101311","9.0215","0.0006","9.0215","0.0006","6.4395","0.001","90","","90","","120","","453.88","0.08","293","","293","","","","680000","","","","","5","P 63/m","-P 6c","176","","","","- C4 H12 Cl3 Mn N -","- C4 Cl3 Mn N -","- C8 Cl6 Mn2 N2 -","2","0.166667","","Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil","Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure.","Journal of the American Chemical Society","2006","128","28","9205","9210","10.1021/ja061923i","","","0.6984","MoKα","","0.068","0.0557","","0.0715","0.059","0.059","","","","","","1.1506","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101312","9.188","0.0013","9.188","0.0013","6.523","0.0013","90","","90","","120","","476.89","0.13","293","","293","","","","","","","","","5","P 63/m","-P 6c","176","","","","- C4 H12 Cl3 Mn N -","- C4 Cl3 Mn N -","- C8 Cl6 Mn2 N2 -","2","0.166667","","Tancharakorn, Somchai; Fabbiani, Francesca P A; Allan, David R; Kamenev, Konstantin V; Robertson, Neil","Combined magnetic and single-crystal X-ray structural study of the linear chain antiferromagnet [(CH3)4N][MnCl3] under varying pressure.","Journal of the American Chemical Society","2006","128","28","9205","9210","10.1021/ja061923i","","","0.6984","MoKα","","0.0516","0.0433","","0.0583","0.0563","0.0567","","","","","","1.0572","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103667","25.807","0.002","25.807","0.002","29.78","0.005","90","","90","","120","","17176","3","110","2","110","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C156 H96 Mo6 O42 -","- C156 H96 Mo6 O42 -","- C312 H192 Mo12 O84 -","2","0.166667","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.354","0.0975","","","0.1645","0.1997","","","","","","1.02","","","","has coordinates","178782","2020-10-21","18:00:00",""
"4103673","33.052","0.002","33.052","0.002","33.833","0.004","90","","90","","120","","32009","5","110","2","110","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C288 H144 Mo24 O120 -","- C288 H144 Mo24 O120 -","- C576 H288 Mo48 O240 -","2","0.166667","","Jian-Rong Li; Andrey A. Yakovenko; Weigang Lu; Daren J. Timmons; Wenjuan Zhuang; Daqiang Yuan; Hong-Cai Zhou","Ligand Bridging-Angle-Driven Assembly of Molecular Architectures Based on Quadruply Bonded Mo-Mo Dimers","Journal of the American Chemical Society","2010","132","","17599","17610","10.1021/ja1080794","","","0.71073","MoKα","","0.143","0.0768","","","0.1507","0.166","","","","","","1.018","","","","has coordinates,has disorder","178782","2020-10-21","18:00:00",""
"4103969","14.3116","0.0016","14.3116","0.0016","13.612","0.002","90","","90","","120","","2414.5","0.5","183","2","183","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C48 H66 Ca2 O6 -","- C48 H66 Ca2 O6 -","- C96 H132 Ca4 O12 -","2","0.166667","","Sven Krieck; Helmar Görls; Lian Yu; Markus Reiher; Matthias Westerhausen","Stable ""Inverse"" Sandwich Complex with Unprecedented Organocalcium(I): Crystal Structures of [(thf)2Mg(Br)-C6H2-2,4,6-Ph3] and [(thf)3Ca{μ-C6H3-1,3,5-Ph3}Ca(thf)3]","Journal of the American Chemical Society","2009","131","","2977","2985","10.1021/ja808524y","","","0.71073","MoKα","","0.1435","0.1057","","","0.2877","0.3328","","","","","","1.07","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4104098","42.1589","0.0008","42.1589","0.0008","52.5682","0.001","90","","90","","120","","80916","3","95","2","95","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C132 H66 O39 S6 Zn12 -","- C130.928 H66 O39 S7.072 Zn12 -","- C785.568 H396 O234 S42.432 Zn72 -","6","0.5","","Kyoungmoo Koh; Antek G. Wong-Foy; Adam J. Matzger","A Porous Coordination Copolymer with over 5000 m2/g BET Surface Area","Journal of the American Chemical Society","2009","131","","4184","4185","10.1021/ja809985t","","","1.54187","CuKα","","0.132","0.0773","","","0.1899","0.2136","","","","","","0.979","","","","has coordinates,has disorder","178786","2020-10-21","18:00:00",""
"4105319","12.778","0.003","12.778","0.003","6.697","0.0014","90","","90","","120","","947","0.4","173","2","173","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C18 H33 B -","- C18 H33 B -","- C36 H66 B2 -","2","0.166667","","Matthias Scheibitz; Haiyan Li; Jan Schnorr; Alejandro Sánchez Perucha; Michael Bolte; Hans-Wolfram Lerner; Frieder Jäkle; Matthias Wagner","Ferrocenylhydridoborates: Synthesis, Structural Characterization, and Application to the Preparation of Ferrocenylborane Polymers","Journal of the American Chemical Society","2009","131","","16319","16329","10.1021/ja906575s","","","0.71073","MoKα","","0.1477","0.1134","","","0.3059","0.3449","","","","","","1.075","","","","has coordinates","178799","2020-10-21","18:00:00",""
"4105673","20.1775","0.0006","20.1775","0.0006","21.9148","0.0007","90","","90","","120","","7726.9","0.4","149","2","150","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C81.5 H219.5 Ge14 Li3 O7 Si25 -","- C81.48 H219.57 Ge14 Li3 O6.99 Si25 -","- C162.96 H439.14 Ge28 Li6 O13.98 Si50 -","2","0.166667","","Christian Schenk; Andreas Kracke; Karin Fink; Adam Kubas; Wim Klopper; Marco Neumaier; Hansgeorg Schnöckel; Andreas Schnepf","The Formal Combination of Three Singlet Biradicaloid Entities to a Singlet Hexaradicaloid Metalloid Ge14[Si(SiMe3)3]5[Li(THF)2]3 Cluster","Journal of the American Chemical Society","2011","133","","2518","2524","10.1021/ja107446z","","","0.8","synchrotron","","0.0471","0.0427","","","0.0953","0.0975","","","","","","1.154","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4107313","26.564","0.002","26.564","0.002","10.8869","0.0009","90","","90","","120","","6653.1","0.9","100","2","100","2","","","","","","","","3","P 63/m","-P 6c","176","La2@C78Ad","La2@C78Ad","","- C90 H18.67 La2 -","- C90.3594 H19.4 La2 -","- C542.156 H116.4 La12 -","6","0.5","","Baopeng Cao; Hidefumi Nikawa; Tsukasa Nakahodo; Takahiro Tsuchiya; Yutaka Maeda; Takeshi Akasaka; Hiroshi Sawa; Zdenek Slanina; Naomi Mizorogi; Shigeru Nagase","Addition of Adamantylidene to La2@C78: Isolation and Single-Crystal X-ray Structural Determination of the Monoadducts","Journal of the American Chemical Society","2008","130","","983","989","10.1021/ja076462v","","x-ray","0.6887","synchrotron","","0.1175","0.0711","","","0.2221","0.2349","","","","","","1.022","","","","has coordinates,has disorder","178819","2020-10-21","18:00:00",""
"4107514","9.1056","0.0003","9.1056","0.0003","15.955","0.0012","90","","90","","120","","1145.63","0.1","100","2","100","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C8 H4 Cu O4.11 -","- C8 H4 Cu O4.11 -","- C48 H24 Cu6 O24.66 -","6","0.5","","Emily A. Nytko; Joel S. Helton; Peter Müller; Daniel G. Nocera","A Structurally Perfect S=1/2 Metal-Organic Hybrid Kagomé Antiferromagnet","Journal of the American Chemical Society","2008","130","","2922","2923","10.1021/ja709991u","","","0.71073","MoKα","","0.0235","0.0217","","","0.0621","0.0637","","","","","","1.101","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4107516","9.1081","0.0002","9.1081","0.0002","15.9432","0.0005","90","","90","","120","","1145.41","0.05","100","2","100","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C8 H4 Cu O4 -","- C8 H4 Cu O4 -","- C48 H24 Cu6 O24 -","6","0.5","","Emily A. Nytko; Joel S. Helton; Peter Müller; Daniel G. Nocera","A Structurally Perfect S=1/2 Metal-Organic Hybrid Kagomé Antiferromagnet","Journal of the American Chemical Society","2008","130","","2922","2923","10.1021/ja709991u","","","0.71073","MoKα","","0.0217","0.0212","","","0.0667","0.0674","","","","","","1.098","","","","has coordinates","178821","2020-10-21","18:00:00",""
"4109987","18.5176","0.0002","18.5176","0.0002","16.4848","0.0003","90","","90","","120","","4895.35","0.12","273","2","273","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C81 H111 O9 P3 Pt3 Ru3 Sn3 -","- C81 H111 O9 P3 Pt3 Ru3 Sn3 -","- C162 H222 O18 P6 Pt6 Ru6 Sn6 -","2","0.166667","","Richard D. Adams; Burjor Captain; Michael B. Hall; Eszter Trufan; Xinzheng Yang","Synthesis, Characterization, and Electronic Structures of a Series of Two-Dimensional Trimetallic Cluster Complexes, Ru3(CO)9(μ-SnPh2)3[Pt(PBut3)]x, x = 0-3","Journal of the American Chemical Society","2007","129","","12328","12340","10.1021/ja074527o","","","0.71073","MoKα","","0.052","0.0366","","","0.1263","0.1428","","","","","","1.187","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4110391","12.2527","0.0003","12.2527","0.0003","14.5191","0.0007","90","","90","","120","","1887.7","0.11","123","2","123","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C12 H21 Y -","- C12 H21 Y -","- C72 H126 Y6 -","6","0.5","","H. Martin Dietrich; Hilde Grove; Karl W. Törnroos; Reiner Anwander","Multiple C-H Bond Activation in Group 3 Chemistry: Synthesis and Structural Characterization of an Yttrium-Aluminum-Methine Cluster","Journal of the American Chemical Society","2006","128","","1458","1459","10.1021/ja057618z","","","0.71073","MoKα","","0.0484","0.0395","","","0.1003","0.1087","","","","","","1.061","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4111487","16.214","0.014","16.214","0.014","17.23","0.02","90","","90","","120","","3923","7","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C57 H99 N3 O18 S6 Sn3 -","- C57 H81 N3 O18 S6 Sn3 -","- C114 H162 N6 O36 S12 Sn6 -","2","0.166667","","Reyes García-Zarracino; Herbert Höpfl","Self-Assembly of Diorganotin(IV) Oxides (R = Me,nBu, Ph) and 2,5-Pyridinedicarboxylic Acid to Polymeric and Trinuclear Macrocyclic Hybrids with Porous Solid-State Structures: Influence of Substituents and Solvent on the Supramolecular Structure","Journal of the American Chemical Society","2005","127","","3120","3130","10.1021/ja0437095","","","0.71073","MoKα","","0.0944","0.0611","","","0.1782","0.2012","","","","","","1.098","","","","has coordinates","178885","2020-10-21","18:00:00",""
"4111871","15.7641","0.0008","15.7641","0.0008","35.775","0.002","90","","90","","120","","7699.3","0.7","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C145 H151 Cl3 I6 O36 Sn6 -","- C145 H139 Cl3 I6 O36 Sn6 -","- C290 H278 Cl6 I12 O72 Sn12 -","2","0.166667","","Vadapalli Chandrasekhar; Pakkirisamy Thilagar; James F. Bickley; Alexander Steiner","Alternating Hydrophilic and Hydrophobic Pockets in the Channel Structures of Organostannoxane Prismanes: Preferential Confinement of Guest Molecules","Journal of the American Chemical Society","2005","127","","11556","11557","10.1021/ja052776b","","","0.71073","MoKα","","0.039","0.0337","","","0.0793","0.0819","","","","","","1.071","","","","has coordinates,has disorder","178889","2020-10-21","18:00:00",""
"4112155","11.576","0.0002","11.576","0.0002","21.389","0.0002","90","","90","","120","","2482.21","0.06","150","2","150","2","","","","","","","","5","P 63/m","-P 6c","176","Compound 5","","","- C49 H66 Ag B11 P2 -","- C48 H66 Ag B12 P2 -","- C96 H132 Ag2 B24 P4 -","2","0.166667","","Adam J. Clarke; Michael J. Ingleson; Gabriele Kociok-Köhn; Mary F. Mahon; Nathan J. Patmore; Jonathan P. Rourke; Giuseppe D. Ruggiero; Andrew S. Weller","Silver-Phosphine Complexes of the Highly Methylated Carborane Monoanion [closo-1-H-CB11Me11]-","Journal of the American Chemical Society","2004","126","","1503","1517","10.1021/ja038173m","","","0.71073","MoKα","","0.0569","0.0364","","","0.0918","0.1017","","","","","","1.036","","","","has coordinates,has disorder","178892","2020-10-21","18:00:00",""
"4112540","10.2163","0.001","10.2163","0.001","5.9707","0.0006","90","","90","","120","","539.69","0.09","190","2","190","2","","","","","","","","2","P 63/m","-P 6c","176","","","","- C6 N16 -","- C6 N16 -","- C12 N32 -","2","0.166667","","Dale R. Miller; Dale C. Swenson; Edward G. Gillan","Synthesis and Structure of 2,5,8-Triazido-s-Heptazine: An Energetic and Luminescent Precursor to Nitrogen-Rich Carbon Nitrides","Journal of the American Chemical Society","2004","126","","5372","5373","10.1021/ja048939y","","","0.71073","MoKα","","0.0368","0.035","","","0.1052","0.1078","","","","","","1.191","","","","has coordinates","178896","2020-10-21","18:00:00",""
"4112626","19.139","0.003","19.139","0.003","18.5941","0.0013","90","","90","","120","","5898.5","1.4","170","2","170","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C66 H126 N6 O42 U3 -","- C66 H108 N6 O42 U3 -","- C132 H216 N12 O84 U6 -","2","0.166667","","Pierre Thuéry; Claude Villiers; Joël Jaud; Michel Ephritikhine; Bernardo Masci","Uranyl-Based Metallamacrocycles: Tri- and Tetranuclear Complexes with (2R,3R,4S,5S)-Tetrahydrofurantetracarboxylic Acid","Journal of the American Chemical Society","2004","126","","6838","6839","10.1021/ja0485964","","","0.71073","MoKα","","0.1258","0.0644","","","0.1645","0.1998","","","","","","1.06","","","","has coordinates","178897","2020-10-21","18:00:00",""
"4112786","23.2344","0.0002","23.2344","0.0002","20.7222","0.0003","90","","90","","120","","9687.89","0.18","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- H47 Mo10 O47.5 P3 Rb3 S10 -","- Mo10 O45.38 P3 Rb3.00333 S10 -","- Mo60 O272.28 P18 Rb18.02 S60 -","6","0.5","","Emmanuel Cadot; Marie-José Pouet; Chantal Robert-Labarre; Charlotte du Peloux; Jérôme Marrot; Francis Sécheresse","Polyphosphate Ions Encapsulated in Oxothiomolybdate Rings: Synthesis, Structure, and Behavior in Solution","Journal of the American Chemical Society","2004","126","","9127","9134","10.1021/ja048746a","","","0.71073","MoKα","","0.058","0.039","","","0.1092","0.1263","","","","","","1.155","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4113895","14.0129","0.0013","14.0129","0.0013","23.119","0.003","90","","90","","120","","3931.5","0.7","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C80 H78 Ag2 F6 N12 O6 S2 -","- C79.99 H78 Ag2 F5.97 N12 O5.99 S1.99 -","- C159.98 H156 Ag4 F11.94 N24 O11.98 S3.98 -","2","0.166667","","Cheng-Yong Su; Yue-Peng Cai; Chun-Long Chen; Mark D. Smith; Wolfgang Kaim; Hans-Conrad zur Loye","Ligand-Directed Molecular Architectures: Self-Assembly of Two-Dimensional Rectangular Metallacycles and Three-Dimensional Trigonal or Tetragonal Prisms","Journal of the American Chemical Society","2003","125","","8595","8613","10.1021/ja034267k","","","0.71073","MoKα","","0.1245","0.0716","","","0.1935","0.2409","","","","","","1.05","","","","has coordinates","178909","2020-10-21","18:00:00",""
"4114335","10.0322","0.0002","10.0322","0.0002","15.514","0.0005","90","","90","","120","","1352.22","0.06","173","2","173","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C31 H45 O U -","- C31 H45 O U -","- C62 H90 O2 U2 -","2","0.166667","","William J. Evans; Stosh A. Kozimor; Gregory W. Nyce; Joseph W. Ziller","Comparative Reactivity of Sterically Crowded nf3 (C5Me5)3Nd and (C5Me5)3U Complexes with CO: Formation of a Nonclassical Carbonium Ion versus an f Element Metal Carbonyl Complex","Journal of the American Chemical Society","2003","125","","13831","13835","10.1021/ja036631l","","","0.71073","MoKα","","0.0174","0.0161","","","0.0419","0.0425","","","","","","1.148","","","","has coordinates","178914","2020-10-21","18:00:00",""
"4114653","26.7074","0.0001","26.7074","0.0001","23.3649","0.0002","90","","90","","120","","14433","0.15","188","2","188","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C162 H378 N102 O159 Pt3 -","- C162 H180 N99 O150 Pt3 -","- C324 H360 N198 O300 Pt6 -","2","0.166667","","Ki-Min Park; Soo-Young Kim; Jungseok Heo; Dongmok Whang; Shigeru Sakamoto; Kentaro Yamaguchi; Kimoon Kim","Designed Self-Assembly of Molecular Necklaces","Journal of the American Chemical Society","2002","124","","2140","2147","10.1021/ja011654q","","","0.71073","MoKα","","0.1174","0.0957","","0.277","0.2523","","","","1.066","1.121","1.121","","","","","has coordinates","178917","2020-10-21","18:00:00",""
"4114993","22.9958","0.0007","22.9958","0.0007","31.3192","0.0017","90","","90","","120","","14342.9","1","223","2","223","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C221 H150 Eu7 F27 N46 O51 S9 -","- C218.07 H120 Eu7 F15 N46.05 O45.02 S8.97 -","- C436.14 H240 Eu14 F30 N92.1 O90.04 S17.94 -","2","0.166667","","Yann Bretonnière; Marinella Mazzanti; Jacques Pécaut; Marilyn M. Olmstead","Cation-Controlled Self-Assembly of a Hexameric Europium Wheel","Journal of the American Chemical Society","2002","124","","9012","9013","10.1021/ja012177e","","","0.71073","MoKα","","0.1466","0.0607","","","0.1934","0.2288","","","","","","1.005","","","","has coordinates,has disorder","178920","2020-10-21","18:00:00",""
"4115179","16.142","0.0009","16.142","0.0009","11.8364","0.0009","90","","90","","120","","2670.9","0.3","120","2","120","2","","","","","","","synthetic","7","P 63/m","-P 6c","176","","","","- C45 H76 Br Cr3 Cs N9 O2 -","- C45 H63 Br Cr3 Cs N9 O2 -","- C90 H126 Br2 Cr6 Cs2 N18 O4 -","2","0.166667","","Louise A. Berben; Jeffrey R. Long","Synthesis and Alkali Metal Ion-Binding Properties of a Chromium(III) Triacetylide Complex","Journal of the American Chemical Society","2002","124","","11588","11589","10.1021/ja027309y","","","0.71073","MoKα","","0.0641","0.0481","","0.1356","0.1238","","","","1.078","1.112","1.112","","","","","has coordinates","178922","2020-10-21","18:00:00",""
"4116259","9.9903","0.0003","9.9903","0.0003","15.3902","0.0006","90","","90","","120","","1330.25","0.08","158","2","158","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C30 H45 Cl U -","- C30 H45 Cl U -","- C60 H90 Cl2 U2 -","2","0.166667","","William J. Evans; Gregory W. Nyce; Matthew A. Johnston; Joseph W. Ziller","How Much Steric Crowding Is Possible in Tris(η5-pentamethylcyclopentadienyl) Complexes? Synthesis and Structure of (C5Me5)3UCl and (C5Me5)3UF1","Journal of the American Chemical Society","2000","122","","12019","12020","10.1021/ja002486p","","","0.71073","MoKα","","0.056","0.05","","","0.1215","0.1247","","","","","","1.398","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116260","9.9804","0.0005","9.9804","0.0005","15.4529","0.0011","90","","90","","120","","1333.02","0.13","153","2","153","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C30 H45 F U -","- C30 H45 F2 U -","- C60 H90 F4 U2 -","2","0.166667","","William J. Evans; Gregory W. Nyce; Matthew A. Johnston; Joseph W. Ziller","How Much Steric Crowding Is Possible in Tris(η5-pentamethylcyclopentadienyl) Complexes? Synthesis and Structure of (C5Me5)3UCl and (C5Me5)3UF1","Journal of the American Chemical Society","2000","122","","12019","12020","10.1021/ja002486p","","","0.71073","MoKα","","0.0609","0.0434","","","0.108","0.127","","","","","","1.18","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4118533","29.688","0.005","29.688","0.005","30.488","0.005","90","0.005","90","0.005","120","0.005","23271","7","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- H97 K Na2 Nb24 O110 -","- K Na2.00667 Nb24 O82 -","- K6 Na12.04 Nb144 O492 -","6","0.5","","Peng Huang; Chao Qin; Zhong-Min Su; Yan Xing; Xin-Long Wang; Kui-Zhan Shao; Ya-Qian Lan; En-Bo Wang","Self-Assembly and Photocatalytic Properties of Polyoxoniobates: {Nb24O72}, {Nb32O96}, and {K12Nb96O288} Clusters","Journal of the American Chemical Society","2012","134","","14004","14010","10.1021/ja303723u","","","0.71073","MoKα","","0.06","0.0435","","","0.1223","0.1289","","","","","","1.093","","","","has coordinates","178956","2020-10-21","18:00:00",""
"4121007","10.5117","0.0007","10.5117","0.0007","23.576","0.002","90","","90","","120","","2256","0.3","240","2","240","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30 H30 Cl2 Fe N24 O8 -","- C30 H30 Cl2 Fe N24 O8 -","- C60 H60 Cl4 Fe2 N48 O16 -","2","0.166667","","Eugenio Coronado; Mónica Giménez-Marqués; Guillermo Mínguez Espallargas; Fernando Rey; Iñigo J. Vitórica-Yrezábal","Spin-Crossover Modification through Selective CO2 Sorption","Journal of the American Chemical Society","2013","135","","15986","15989","10.1021/ja407135k","","","0.71073","MoKα","","0.2033","0.0984","","","0.2367","0.2975","","","","","","1.009","","","","has coordinates,has disorder","179012","2020-10-21","18:00:00",""
"4121008","10.3668","0.0004","10.3668","0.0004","23.1504","0.0017","90","","90","","120","","2154.7","0.2","120","2","120","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30 H30 Cl2 Fe N24 O8 -","- C30 H30 Cl2 Fe N24 O8 -","- C60 H60 Cl4 Fe2 N48 O16 -","2","0.166667","","Eugenio Coronado; Mónica Giménez-Marqués; Guillermo Mínguez Espallargas; Fernando Rey; Iñigo J. Vitórica-Yrezábal","Spin-Crossover Modification through Selective CO2 Sorption","Journal of the American Chemical Society","2013","135","","15986","15989","10.1021/ja407135k","","","0.71073","MoKα","","0.1206","0.0669","","","0.1678","0.1943","","","","","","1.062","","","","has coordinates,has disorder","179012","2020-10-21","18:00:00",""
"4121009","10.514099","0.000041","10.514099","0.000041","23.58029","0.00019","90","","90","","120","","2257.48","0.02","298","","298","","","","","","","","see text","6","P 63/m","-P 6c","176","","","","- C30.93 H30 Cl2 Fe N24 O9.86 -","- C30.93 H30 Cl2 Fe N24 O9.86 -","- C61.86 H60 Cl4 Fe2 N48 O19.72 -","2","0.166667","","Eugenio Coronado; Mónica Giménez-Marqués; Guillermo Mínguez Espallargas; Fernando Rey; Iñigo J. Vitórica-Yrezábal","Spin-Crossover Modification through Selective CO2 Sorption","Journal of the American Chemical Society","2013","135","","15986","15989","10.1021/ja407135k","powder diffraction","x-ray","0.826179","synchrotron","","","","","","","","","","1.63","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4122738","24.7255","0.0018","24.7255","0.0018","20.3293","0.0011","90","","90","","120","","10763.2","1.3","110","2","110","2","","","","","","","","8","P 63/m","-P 6c","176","","di(tris(isonicotinoyl)-cyclotriguaiacylene} tri[1,1'-methylenebis(3-(naphthalen-2-ylmethyl)- imidazol-2-ylidene)]tripalladium(II) tetrafluoroborate iodine clathrate","","- C171 H138 B6 F24 I2 N18 O18 Pd3 -","- C171 H138 B6.01 F24.04 I2.01 N18 O18 Pd3 -","- C342 H276 B12.02 F48.08 I4.02 N36 O36 Pd6 -","2","0.166667","","Henkelis, James J.; Carruthers, Christopher J.; Chambers, Scott E.; Clowes, Rob; Cooper, Andrew I.; Fisher, Julie; Hardie, Michaele J.","Metallo-cryptophanes decorated with bis-N-heterocyclic carbene ligands: self-assembly and guest uptake into a nonporous crystalline lattice.","Journal of the American Chemical Society","2014","136","41","14393","14396","10.1021/ja508502u","","","1.54184","CuKα","","0.1598","0.1292","","","0.367","0.3991","","","","","","1.687","","","","has coordinates","179029","2020-10-21","18:00:00",""
"4122739","25.21","0.0012","25.21","0.0012","20.5293","0.0007","90","","90","","120","","11299.3","0.9","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","di(tris(2-methyl-isonicotinoyl)-cyclotriguaiacylene} tri[1,1'-methylenebis(3-(naphthalen-2-ylmethyl)- imidazol-2-ylidene)]tripalladium(II) tetrafluoroborate","","- C185 H174 B6 F24 N26 O34 Pd3 -","- C177 H150 B6.01 F24.01 N18 O18 Pd3 -","- C354 H300 B12.02 F48.02 N36 O36 Pd6 -","2","0.166667","","Henkelis, James J.; Carruthers, Christopher J.; Chambers, Scott E.; Clowes, Rob; Cooper, Andrew I.; Fisher, Julie; Hardie, Michaele J.","Metallo-cryptophanes decorated with bis-N-heterocyclic carbene ligands: self-assembly and guest uptake into a nonporous crystalline lattice.","Journal of the American Chemical Society","2014","136","41","14393","14396","10.1021/ja508502u","","","0.6889","synchrotron","","0.1835","0.1417","","","0.3436","0.3647","","","","","","1.927","","","","has coordinates,has disorder","179029","2020-10-21","18:00:00",""
"4122740","24.736","0.0008","24.736","0.0008","20.0595","0.0007","90","","90","","120","","10629.4","0.6","100","2","100","2","","","","","","","","8","P 63/m","-P 6c","176","","di(tris(isonicotinoyl)-tris(propyl)-cyclotricatechylene} tri[1,1'-methylenebis(3-(naphthalen-2-ylmethyl)- imidazol-2-ylidene)]tripalladium(II) tetrafluoroborate 1,2-dichlorobenzene nitromethane clathrate","","- C206 H189 B6 Cl6 F24 N23 O28 Pd3 -","- C201.99 H177.06 B6.01 Cl6 F24.04 N19 O20.01 Pd3 -","- C403.98 H354.12 B12.02 Cl12 F48.08 N38 O40.02 Pd6 -","2","0.166667","","Henkelis, James J.; Carruthers, Christopher J.; Chambers, Scott E.; Clowes, Rob; Cooper, Andrew I.; Fisher, Julie; Hardie, Michaele J.","Metallo-cryptophanes decorated with bis-N-heterocyclic carbene ligands: self-assembly and guest uptake into a nonporous crystalline lattice.","Journal of the American Chemical Society","2014","136","41","14393","14396","10.1021/ja508502u","","","0.6889","synchrotron","","0.1348","0.1233","","","0.3418","0.3488","","","","","","2.594","","","","has coordinates,has disorder","179029","2020-10-21","18:00:00",""
"4122741","24.6118","0.0019","24.6118","0.0019","20.272","0.003","90","","90","","120","","10634","2","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","di(tris(isonicotinoyl)-tris(propyl)-cyclotricatechylene} tri[1,1'-methylenebis(3-(naphthalen-2-ylmethyl)- imidazol-2-ylidene)]tripalladium(II) tetrafluoroborate nitromethane clathrate","","- C191 H186 B6 F24 N26 O34 Pd3 -","- C186.99 H174.03 B6.01 F24.04 N22 O26.01 Pd3 -","- C373.98 H348.06 B12.02 F48.08 N44 O52.02 Pd6 -","2","0.166667","","Henkelis, James J.; Carruthers, Christopher J.; Chambers, Scott E.; Clowes, Rob; Cooper, Andrew I.; Fisher, Julie; Hardie, Michaele J.","Metallo-cryptophanes decorated with bis-N-heterocyclic carbene ligands: self-assembly and guest uptake into a nonporous crystalline lattice.","Journal of the American Chemical Society","2014","136","41","14393","14396","10.1021/ja508502u","","","1.54184","CuKα","","0.1162","0.096","","","0.2723","0.2935","","","","","","1.186","","","","has coordinates,has disorder","179029","2020-10-21","18:00:00",""
"4122743","24.6185","0.0014","24.6185","0.0014","20.3337","0.0012","90","","90","","120","","10672.6","1.1","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","di(tris(isonicotinoyl)-cyclotriguaiacylene} tri[1,1'-methylenebis(3-(naphthalen-2-ylmethyl)- imidazol-2-ylidene)]tripalladium(II) tetrafluoroborate nitromethane clathrate","","- C179 H162 B6 F24 N26 O34 Pd3 -","- C174.99 H150.03 B6.01 F24.04 N22 O26.01 Pd3 -","- C349.98 H300.06 B12.02 F48.08 N44 O52.02 Pd6 -","2","0.166667","","Henkelis, James J.; Carruthers, Christopher J.; Chambers, Scott E.; Clowes, Rob; Cooper, Andrew I.; Fisher, Julie; Hardie, Michaele J.","Metallo-cryptophanes decorated with bis-N-heterocyclic carbene ligands: self-assembly and guest uptake into a nonporous crystalline lattice.","Journal of the American Chemical Society","2014","136","41","14393","14396","10.1021/ja508502u","","","0.6889","synchrotron","","0.1269","0.1082","","","0.3142","0.3312","","","","","","1.373","","","","has coordinates,has disorder","179029","2020-10-21","18:00:00",""
"4122744","24.7016","0.0008","24.7016","0.0008","20.3905","0.0007","90","","90","","120","","10774.8","0.6","100","2","100","2","","","","","","","","8","P 63/m","-P 6c","176","","di(tris(isonicotinoyl)-cyclotriguaiacylene} tri[1,1'-methylenebis(3-(naphthalen-2-ylmethyl)- imidazol-2-ylidene)]tripalladium(II) tetrafluoroborate iodine clathrate","","- C171 H147 B6 F24 I6 N18 O22.5 Pd3 -","- C171 H138 B6.01 F24.04 I6.07 N18 O22.5 Pd3 -","- C342 H276 B12.02 F48.08 I12.14 N36 O45 Pd6 -","2","0.166667","","Henkelis, James J.; Carruthers, Christopher J.; Chambers, Scott E.; Clowes, Rob; Cooper, Andrew I.; Fisher, Julie; Hardie, Michaele J.","Metallo-cryptophanes decorated with bis-N-heterocyclic carbene ligands: self-assembly and guest uptake into a nonporous crystalline lattice.","Journal of the American Chemical Society","2014","136","41","14393","14396","10.1021/ja508502u","","","1.54184","CuKα","","0.1843","0.1468","","","0.3884","0.4234","","","","","","1.761","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4122971","23.6641","0.0018","23.6641","0.0018","31.78","0.002","90","","90","","120","","15412.2","1.9","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C180 H180 N90 O54 -","- C180 H179.76 N90 O54 -","- C360 H359.52 N180 O108 -","2","0.166667","","Chen, Kai; Kang, Yan-Shang; Zhao, Yue; Yang, Ji-Min; Lu, Yi; Sun, Wei-Yin","Cucurbit[6]uril-Based Supramolecular Assemblies: Possible Application in Radioactive Cesium Cation Capture.","Journal of the American Chemical Society","2014","","","141119145920008","","10.1021/ja5098836","","","0.71073","MoKα","","0.2055","0.1159","","","0.2343","0.2503","","","","","","1.197","","","","has coordinates","179031","2020-10-21","18:00:00",""
"4124195","16.51","0.004","16.51","0.004","16.634","0.004","90","","90","","120","","3926.6","1.6","173.15","","173.15","","","","","","","","","4","P 63/m","-P 6c","176","","","","- C80 H50 N6 O24 -","- C80 H50 N6 O24 -","- C160 H100 N12 O48 -","2","0.166667","","Meng, Zheng; Han, Ying; Wang, Li-Na; Xiang, Jun-Feng; He, Sheng-Gui; Chen, Chuan-Feng","Stepwise Motion in a Multivalent [2](3)Catenane.","Journal of the American Chemical Society","2015","137","30","9739","9745","10.1021/jacs.5b05758","","","0.71073","MoKα","","0.1359","0.1328","","","0.3589","0.3617","","","","","","1.198","","","","has coordinates","154631","2020-10-21","18:00:00",""
"4125055","9.5507","","9.5507","","7.0155","","90","","90","","120","","554.191","","300","","300","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Nd9.553 O25.776 Si6 -","- Nd9.552 O25.776 Si6 -","- Nd9.552 O25.776 Si6 -","1","0.0833333","","An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J.","Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes.","Journal of the American Chemical Society","2016","138","13","4468","4483","10.1021/jacs.5b13409","","neutron","0.71069","neutron","","0.0655","0.0376","","","0.0366","0.0386","","","","1.9","1.9","1.74","","","","has coordinates","182469","2020-10-21","18:00:00",""
"4125056","9.5507","","9.5507","","7.0155","","90","","90","","120","","554.191","","573","","573","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Nd9.606 O25.924 Si6 -","- Nd9.608 O25.924 Si6 -","- Nd9.608 O25.924 Si6 -","1","0.0833333","","An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J.","Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes.","Journal of the American Chemical Society","2016","138","13","4468","4483","10.1021/jacs.5b13409","","neutron","0.71069","neutron","","0.1243","0.0625","","","0.0515","0.0556","","","","2.24","2.24","1.99","","","","has coordinates","182470","2020-10-21","18:00:00",""
"4125057","9.5611","","9.5611","","7.0607","","90","","90","","120","","558.977","","100","","100","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Al1.5 Nd9.959 O26 Si4.5 -","- Al1.5 Nd9.96 O26 Si4.5 -","- Al1.5 Nd9.96 O26 Si4.5 -","1","0.0833333","","An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J.","Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes.","Journal of the American Chemical Society","2016","138","13","4468","4483","10.1021/jacs.5b13409","","neutron","0.71069","neutron","","0.0639","0.0361","","","0.0668","0.0702","","","","1.99","1.99","1.83","","","","has coordinates","182471","2020-10-21","18:00:00",""
"4125058","9.5507","","9.5507","","7.0155","","90","","90","","120","","554.191","","4","","4","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Nd9.605 O25.789 Si6 -","- Nd9.604 O25.79 Si6 -","- Nd9.604 O25.79 Si6 -","1","0.0833333","","An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J.","Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes.","Journal of the American Chemical Society","2016","138","13","4468","4483","10.1021/jacs.5b13409","","neutron","0.71069","neutron","","0.0572","0.0391","","","0.0772","0.08","","","","2.08","2.08","1.95","","","","has coordinates","182472","2020-10-21","18:00:00",""
"4125059","9.5507","","9.5507","","7.0155","","90","","90","","120","","554.191","","100","","100","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Nd9.58 O25.84 Si6 -","- Nd9.58 O25.84 Si6 -","- Nd9.58 O25.84 Si6 -","1","0.0833333","","An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J.","Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes.","Journal of the American Chemical Society","2016","138","13","4468","4483","10.1021/jacs.5b13409","","neutron","0.71069","neutron","","0.0667","0.0405","","","0.0434","0.0453","","","","2.19","2.19","2.02","","","","has coordinates","182473","2020-10-21","18:00:00",""
"4125060","9.553","","9.553","","7.0496","","90","","90","","120","","557.153","","100","","100","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Al Nd9.906 O26 Si5 -","- Al0.9996 Nd9.908 O26 Si5.0004 -","- Al0.9996 Nd9.908 O26 Si5.0004 -","1","0.0833333","","An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J.","Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes.","Journal of the American Chemical Society","2016","138","13","4468","4483","10.1021/jacs.5b13409","","neutron","0.71069","neutron","","0.0605","0.0437","","","0.0842","0.0863","","","","2.32","2.32","2.17","","","","has coordinates","182474","2020-10-21","18:00:00",""
"4125061","9.5515","","9.5515","","7.042","","90","","90","","120","","556.378","","100","","100","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Al0.5 Nd9.652 O26 Si5.5 -","- Al0.4998 Nd9.652 O26 Si5.5002 -","- Al0.4998 Nd9.652 O26 Si5.5002 -","1","0.0833333","","An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J.","Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes.","Journal of the American Chemical Society","2016","138","13","4468","4483","10.1021/jacs.5b13409","","neutron","0.71069","neutron","","0.0917","0.0435","","","0.0448","0.0493","","","","1.93","1.93","1.76","","","","has coordinates","182475","2020-10-21","18:00:00",""
"4125062","9.5507","","9.5507","","7.0155","","90","","90","","120","","554.191","","773","","773","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Nd9.569 O25.905 Si6 -","- Nd9.568 O25.904 Si6 -","- Nd9.568 O25.904 Si6 -","1","0.0833333","","An, Tao; Baikie, Tom; Orera, Alodia; Piltz, Ross O.; Meven, Martin; Slater, Peter R.; Wei, Jun; Sanjuán, María L; White, T. J.","Interstitial Oxide Ion Distribution and Transport Mechanism in Aluminum-Doped Neodymium Silicate Apatite Electrolytes.","Journal of the American Chemical Society","2016","138","13","4468","4483","10.1021/jacs.5b13409","","neutron","0.71069","neutron","","0.1287","0.0579","","","0.0498","0.0544","","","","2.23","2.23","1.94","","","","has coordinates","182476","2020-10-21","18:00:00",""
"4125469","10.017","0.002","10.017","0.002","15.418","0.003","90","","90","","120","","1339.8","0.5","88","2","88","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C30 H45 Th -","- C30 H45 Th -","- C60 H90 Th2 -","2","0.166667","","Langeslay, Ryan R.; Chen, Guo P.; Windorff, Cory J.; Chan, Alan K.; Ziller, Joseph W.; Furche, Filipp; Evans, William J.","Synthesis, Structure, and Reactivity of the Sterically Crowded Th(3+) Complex (C5Me5)3Th Including Formation of the Thorium Carbonyl, [(C5Me5)3Th(CO)][BPh4].","Journal of the American Chemical Society","2017","139","9","3387","3398","10.1021/jacs.6b10826","","","0.71073","MoKα","","0.0146","0.013","","","0.0328","0.0333","","","","","","1.117","","","","has coordinates","194838","2020-10-21","18:00:00",""
"4125470","10.0524","0.0009","10.0524","0.0009","15.4433","0.0015","90","","90","","120","","1351.5","0.2","143","2","143","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C31 H48 Th -","- C31 H48.0006 Th -","- C62 H96.0012 Th2 -","2","0.166667","","Langeslay, Ryan R.; Chen, Guo P.; Windorff, Cory J.; Chan, Alan K.; Ziller, Joseph W.; Furche, Filipp; Evans, William J.","Synthesis, Structure, and Reactivity of the Sterically Crowded Th(3+) Complex (C5Me5)3Th Including Formation of the Thorium Carbonyl, [(C5Me5)3Th(CO)][BPh4].","Journal of the American Chemical Society","2017","139","9","3387","3398","10.1021/jacs.6b10826","","","0.71073","MoKα","","0.0469","0.0333","","","0.069","0.084","","","","","","1.178","","","","has coordinates","194838","2020-10-21","18:00:00",""
"4126194","38.3063","0.0006","38.3063","0.0006","47.3759","0.0017","90","","90","","120","","60204","3","258","2","258","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C144 H72 Cu24 N46 O91 Zn24 -","- C144 H72 Cu24 N46 O91 Zn24 -","- C432 H216 Cu72 N138 O273 Zn72 -","3","0.25","","Tu, Binbin; Pang, Qingqing; Xu, Huoshu; Li, Xiaomin; Wang, Yulin; Ma, Zhen; Weng, Linhong; Li, Qiaowei","Reversible Redox Activity in Multicomponent Metal-Organic Frameworks Constructed from Trinuclear Copper Pyrazolate Building Blocks.","Journal of the American Chemical Society","2017","139","23","7998","8007","10.1021/jacs.7b03578","","","1.54178","CuKα","","0.1322","0.0779","","","0.1519","0.1603","","","","","","1.034","","","","has coordinates","200672","2020-10-21","18:00:00",""
"4127432","8.2708","0.0012","8.2708","0.0012","24.919","0.004","90","","90","","120","","1476.2","0.4","296","2","296.15","","","","","","","","","5","P 63/m","-P 6c","176","","","","- B20 Eu9 Mg O41 S2 -","- B20 Eu9 Mg O41 S2 -","- B40 Eu18 Mg2 O82 S4 -","2","0.166667","","Chi, Yang; Xu, Jing; Xue, Huai-Guo; Zhang, Yueping; Chen, Xiaolong; Whangbo, Myung-Hwan; Guo, Sheng-Ping; Deng, Shuiquan","Triple-Kagomé-Layer Slabs of Mixed-Valence Rare-Earth Ions Exhibiting Quantum Spin Liquid Behaviors: Synthesis and Characterization of Eu<sub>9</sub>MgS<sub>2</sub>B<sub>20</sub>O<sub>41</sub>.","Journal of the American Chemical Society","2019","141","24","9533","9536","10.1021/jacs.9b04627","","","0.71073","MoKα","","0.0248","0.0244","","","0.05","0.0502","","","","","","1.014","","","","has coordinates","220705","2020-10-21","18:00:00",""
"4127504","15.2801","0.0003","15.2801","0.0003","6.7272","0.0002","90","","90","","120","","1360.25","0.06","373","2","373","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C12 H33 Cd2 Cl7 F3 N3 -","- C12 H33 Cd2 Cl7 F3 N3 -","- C24 H66 Cd4 Cl14 F6 N6 -","2","0.166667","","Wang, Zhong-Xia; Zhang, Yi; Tang, Yuan-Yuan; Li, Peng-Fei; Xiong, Ren-Gen","Fluoridation Achieved Antiperovskite Molecular Ferroelectric in [(CH<sub>3</sub>)<sub>2</sub>(F-CH<sub>2</sub>CH<sub>2</sub>)NH]<sub>3</sub>(CdCl<sub>3</sub>)(CdCl<sub>4</sub>).","Journal of the American Chemical Society","2019","141","10","4372","4378","10.1021/jacs.8b13109","","","0.71073","MoKα","","0.1427","0.139","","","0.4192","0.4201","","","","","","1.146","","","","has coordinates","220766","2020-10-21","18:00:00",""
"4129064","7.01246","0.000016","7.01246","","11.67347","0.00006","90","","90","","120","","497.132","0.003","260","2","260","2","","","","","","","","4","P 63/m","-P 6c","176","Me-AZADO_radical","","","- C20 H32.01 N2 O2 -","- C20.004 H32.0064 N2.0004 O2.0004 -","- C20.004 H32.0064 N2.0004 O2.0004 -","1","0.0833333","","Dragulescu-Andrasi, Alina; Filatov, Alexander S.; Oakley, Richard T.; Li, Xiang; Lekin, Kristina; Huq, Ashfia; Pak, Chongin; Greer, Samuel M.; McKay, Johannes; Jo, Minyoung; Lengyel, Jeff; Hung, Ivan; Maradzike, Elvis; DePrince, A. Eugene; Stoian, Sebastian A.; Hill, Stephen; Hu, Yan-Yan; Shatruk, Michael","Radical Dimerization in Plastic Organic Crystal Leads to Structural and Magnetic Bistability with Wide Thermal Hysteresis.","Journal of the American Chemical Society","2019","","","","","10.1021/jacs.9b09533","powder diffraction","x-ray","0.414561","synchrotron","","","","","","","","0.27526","","1.77","","","","","","","has coordinates","223255","2020-10-21","18:00:00",""
"4130071","7.7196","0.0005","7.7196","0.0005","6.2784","0.0006","90","","90","","120","","324.02","0.04","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","","GT-Br","","- C H6 Br N6 -","- C H6 Br N6 -","- C2 H12 Br2 N12 -","2","0.166667","","Mitra, Shouvik; Kandambeth, Sharath; Biswal, Bishnu P.; Khayum M, Abdul; Choudhury, Chandan K.; Mehta, Mihir; Kaur, Gagandeep; Banerjee, Subhrashis; Prabhune, Asmita; Verma, Sandeep; Roy, Sudip; Kharul, Ulhas K.; Banerjee, Rahul","Self-Exfoliated Guanidinium-Based Ionic Covalent Organic Nanosheets (iCONs).","Journal of the American Chemical Society","2016","138","8","2823","2828","10.1021/jacs.5b13533","","x-ray","0.71073","MoKα","","0.0607","0.0506","","","0.124","0.1369","","","","","","1.087","","","","has coordinates","240657","2020-10-21","18:00:00",""
"4130317","16.348","0.009","16.348","0.009","14.922","0.012","90","","90","","120","","3454","4","120","2","120","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C54 H72 Co3 O30 P6 S3 -","- C48 H54 Co3 O28.119 P6 S1.506 -","- C96 H108 Co6 O56.238 P12 S3.012 -","2","0.166667","","Pili, Simona; Argent, Stephen P.; Morris, Christopher G.; Rought, Peter; García-Sakai, Victoria; Silverwood, Ian P.; Easun, Timothy L.; Li, Ming; Warren, Mark R.; Murray, Claire A.; Tang, Chiu C.; Yang, Sihai; Schröder, Martin","Proton Conduction in a Phosphonate-Based Metal-Organic Framework Mediated by Intrinsic ""Free Diffusion inside a Sphere"".","Journal of the American Chemical Society","2016","138","20","6352","6355","10.1021/jacs.6b02194","","x-ray","0.6889","","","0.1141","0.0864","","","0.2494","0.2803","","","","","","1.086","","","","has coordinates,has disorder","240795","2020-10-21","18:00:00",""
"4130318","16.323","0.006","16.323","0.006","14.933","0.008","90","","90","","120","","3446","3","120","2","120","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C54 H72 N0 Ni3 O30 P6 S3 -","- C49.902 H35.706 Ni3 O29.856 P6 S1.263 -","- C99.804 H71.412 Ni6 O59.712 P12 S2.526 -","2","0.166667","","Pili, Simona; Argent, Stephen P.; Morris, Christopher G.; Rought, Peter; García-Sakai, Victoria; Silverwood, Ian P.; Easun, Timothy L.; Li, Ming; Warren, Mark R.; Murray, Claire A.; Tang, Chiu C.; Yang, Sihai; Schröder, Martin","Proton Conduction in a Phosphonate-Based Metal-Organic Framework Mediated by Intrinsic ""Free Diffusion inside a Sphere"".","Journal of the American Chemical Society","2016","138","20","6352","6355","10.1021/jacs.6b02194","","x-ray","0.6889","","","0.1068","0.0839","","","0.2414","0.2629","","","","","","0.967","","","","has coordinates,has disorder","240796","2020-10-21","18:00:00",""
"4131301","11.9018","0.0003","11.9018","0.0003","32.8715","0.0009","90","","90","","120","","4032.51","0.18","100","","100","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30 H90 I10 Na4 O15 S15 -","- C30 H90 I10 Na3.999 O15 S15 -","- C60 H180 I20 Na7.998 O30 S30 -","2","0.166667","","Plata, R. Erik; Hill, David E.; Haines, Brandon E.; Musaev, Djamaladdin G.; Chu, Ling; Hickey, David P.; Sigman, Matthew S.; Yu, Jin-Quan; Blackmond, Donna G.","A Role for Pd(IV) in Catalytic Enantioselective C-H Functionalization with Monoprotected Amino Acid Ligands under Mild Conditions.","Journal of the American Chemical Society","2017","139","27","9238","9245","10.1021/jacs.7b03716","","x-ray","0.71073","MoKα","","0.0561","0.0445","","","0.0813","0.0854","","","","","","1.229","","","","has coordinates,has disorder","241534","2020-10-21","18:00:00",""
"4131665","44.192","0.006","44.192","0.006","54.961","0.011","90","","90","","120","","92955","3","298.15","","298.15","","","","","","","","","5","P 63/m","-P 6c","176","","","","- C132 H78 N24 O39 Zn12 -","- C133 H78 N21 O39 Zn12 -","- C798 H468 N126 O234 Zn72 -","6","0.5","","Liang, Cong-Cong; Shi, Zhao-Lin; He, Chun-Ting; Tan, Jing; Zhou, Hu-Die; Zhou, Hao-Long; Lee, Yongjin; Zhang, Yue-Biao","Engineering of Pore Geometry for Ultrahigh Capacity Methane Storage in Mesoporous Metal-Organic Frameworks.","Journal of the American Chemical Society","2017","139","38","13300","13303","10.1021/jacs.7b08347","","","0.7293","","","0.1208","0.1108","","","0.3684","0.39","","","","","","1.778","","","","has coordinates,has disorder","241838","2020-10-21","18:00:00",""
"4132902","37.421","0.003","37.421","0.003","20.6962","0.0017","90","","90","","120","","25099","4","120","2","120","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C9 H3 Fe12 In48 N0 O15 S93 -","- C9 H3 Fe12 In48 O15 S93 -","- C18 H6 Fe24 In96 O30 S186 -","2","0.166667","","Yang, Huajun; Zhang, Jiaxu; Luo, Min; Wang, Wei; Lin, Haiping; Li, Youyong; Li, Dongsheng; Feng, Pingyun; Wu, Tao","The Largest Supertetrahedral Oxychalcogenide Nanocluster and Its Unique Assembly.","Journal of the American Chemical Society","2018","140","36","11189","11192","10.1021/jacs.8b07349","","","0.71073","MoKα","","0.1218","0.0792","","","0.2103","0.2286","","","","","","1.156","","","","has coordinates","242777","2020-10-21","18:00:00",""
"4133056","9.8401","0.0003","9.8401","0.0003","7.9506","0.0003","90","","90","","120","","666.7","0.04","298","2","298","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C4 H11 F I3 N Pb -","- C4.0002 H11.001 F1.0002 I3 N Pb -","- C8.0004 H22.002 F2.0004 I6 N2 Pb2 -","2","0.166667","","Hua, Xiu-Ni; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Zhao, Dewei; Xiong, Ren-Gen","A Room-Temperature Hybrid Lead Iodide Perovskite Ferroelectric.","Journal of the American Chemical Society","2018","140","38","12296","12302","10.1021/jacs.8b08286","","","0.71073","MoKα","","0.0292","0.0276","","","0.0748","0.0759","","","","","","1.063","","","","has coordinates","242903","2020-10-21","18:00:00",""
"4133057","9.8122","0.0002","9.8122","0.0002","7.9417","0.0002","90","","90","","120","","662.18","0.03","298","2","298","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C4 H12 I3 N Pb -","- C4.0002 H12.0006 I3 N Pb -","- C8.0004 H24.0012 I6 N2 Pb2 -","2","0.166667","","Hua, Xiu-Ni; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Zhao, Dewei; Xiong, Ren-Gen","A Room-Temperature Hybrid Lead Iodide Perovskite Ferroelectric.","Journal of the American Chemical Society","2018","140","38","12296","12302","10.1021/jacs.8b08286","","","0.71073","MoKα","","0.0302","0.0258","","","0.0804","0.0819","","","","","","1.013","","","","has coordinates","242904","2020-10-21","18:00:00",""
"4133794","23.951","0.001","23.951","0.001","32.354","0.002","90","","90","","120","","16073.3","1.4","100","0.1","100","0.1","","","","","","","","5","P 63/m","-P 6c","176","","","","- C138 H130 N3 O53 Y9 -","- C132 H78 O53 Y9 -","- C264 H156 O106 Y18 -","2","0.166667","","Chen, Zhijie; Thiam, Zeynabou; Shkurenko, Aleksander; Weselinski, Lukasz J.; Adil, Karim; Jiang, Hao; Alezi, Dalal; Assen, Ayalew H.; O'Keeffe, Michael; Eddaoudi, Mohamed","Enriching the Reticular Chemistry Repertoire with Minimal Edge-Transitive Related Nets: Access to Highly Coordinated Metal-Organic Frameworks Based on Double Six-Membered Rings as Net-Coded Building Units.","Journal of the American Chemical Society","2019","141","51","20480","20489","10.1021/jacs.9b11260","","","1.54178","CuKα","","0.1182","0.0865","","","0.2652","0.3016","","","","","","1.13","","","","has coordinates,has disorder","246550","2020-10-21","18:00:00",""
"4133795","23.7931","0.0003","23.7931","0.0003","32.3652","0.0005","90","","90","","120","","15867.6","0.4","100","0.1","100","0.1","","","","","","","","5","P 63/m","-P 6c","176","","","","- C138 H130 N3 O53 Tb9 -","- C132 H78 O53 Tb9 -","- C264 H156 O106 Tb18 -","2","0.166667","","Chen, Zhijie; Thiam, Zeynabou; Shkurenko, Aleksander; Weselinski, Lukasz J.; Adil, Karim; Jiang, Hao; Alezi, Dalal; Assen, Ayalew H.; O'Keeffe, Michael; Eddaoudi, Mohamed","Enriching the Reticular Chemistry Repertoire with Minimal Edge-Transitive Related Nets: Access to Highly Coordinated Metal-Organic Frameworks Based on Double Six-Membered Rings as Net-Coded Building Units.","Journal of the American Chemical Society","2019","141","51","20480","20489","10.1021/jacs.9b11260","","","1.54178","CuKα","","0.1191","0.0922","","","0.2928","0.3184","","","","","","1.312","","","","has coordinates,has disorder","246550","2020-10-21","18:00:00",""
"4300781","19.8754","0.0017","19.8754","0.0017","22.344","0.004","90","","90","","120","","7644","1.7","200","2","473","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- Cl2 Co15 H155 Na5 O172 Si3 W24 -","- Cl2 Co15 Na3 O176 Si3 W24 -","- Cl4 Co30 Na6 O352 Si6 W48 -","2","0.166667","","Bassil, Bassem S.; Nellutla, Saritha; Kortz, Ulrich; Stowe, Ashley C.; van Tol, Johan; Dalal, Naresh S.; Keita, Bineta; Nadjo, Louis","The Satellite-Shaped Co-15 Polyoxotungstate [Co~6~(H~2~O)~30~{Co~9~Cl~2~(OH)~3~(H~2~O)~9~(SiW~8~O~31~)~3~}]^5-^","Inorganic Chemistry","2005","44","8","2659","2665","10.1021/ic048269x","","","0.71073","MoKα","","0.0854","0.0805","","","0.1496","0.1517","","","","","","1.349","","","","has coordinates","209986","2020-10-21","18:00:00",""
"4301147","41.2685","0.001","41.2685","0.001","17.5342","0.0011","90","","90","","120","","25861.5","1.8","200","2","200","2","","","","","","","","5","P 63/m","-P 6c","176","UMCM-3-AM5","","","- C49.5 H34.3 N O13.9 Zn4 -","- C42 O13 Zn4 -","- C252 O78 Zn24 -","6","0.5","","Zhenqiang Wang; Kristine K. Tanabe; Seth M. Cohen","Accessing Postsynthetic Modification in a Series of Metal-Organic Frameworks and the Influence of Framework Topology on Reactivity","Inorganic Chemistry","2009","48","","296","306","10.1021/ic801837t","","","1.54178","CuKα","","0.1369","0.0711","","","0.1471","0.1643","","","","","","0.786","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4301148","41.2555","0.0008","41.2555","0.0008","17.5091","0.0009","90","","90","","120","","25808.2","1.5","200","2","200","2","","","","","","","","5","P 63/m","-P 6c","176","UMCM-3","","","- C44 H25 N O13 Zn4 -","- C42 O13 Zn4 -","- C252 O78 Zn24 -","6","0.5","","Zhenqiang Wang; Kristine K. Tanabe; Seth M. Cohen","Accessing Postsynthetic Modification in a Series of Metal-Organic Frameworks and the Influence of Framework Topology on Reactivity","Inorganic Chemistry","2009","48","","296","306","10.1021/ic801837t","","","1.54178","CuKα","","0.0677","0.0584","","","0.1587","0.1648","","","","","","0.995","","","","has coordinates,has disorder","179049","2020-10-21","18:00:00",""
"4303068","11.1669","0.0016","11.1669","0.0016","6.0347","0.0012","90","","90","","120","","651.71","0.19","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- As3 La Mn3 Na3 O15 -","- As3 La Mn3 Na3 O15 -","- As6 La2 Mn6 Na6 O30 -","2","0.166667","","J. Palmer West; Shiou-Jyh Hwu; Wendy L. Queen","Synthesis, Structure, and Magnetic Properties of Na3LnMn3O3(AsO4)3 (Ln = La, Sm, and Gd): A New 3d-4f Series Exhibiting One-Dimensional Manganese(III) Oxide Chains Connected via LnO9 Units","Inorganic Chemistry","2009","48","","8439","8444","10.1021/ic901043g","","","0.71073","MoKα","","0.0827","0.0767","","","0.2021","0.2083","","","","","","1.214","","","","has coordinates","179068","2020-10-21","18:00:00",""
"4303069","11.0814","0.0016","11.0814","0.0016","6.0198","0.0012","90","","90","","120","","640.18","0.18","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- As3 Mn3 Na3 O15 Sm -","- As3 Mn3 Na3 O15 Sm -","- As6 Mn6 Na6 O30 Sm2 -","2","0.166667","","J. Palmer West; Shiou-Jyh Hwu; Wendy L. Queen","Synthesis, Structure, and Magnetic Properties of Na3LnMn3O3(AsO4)3 (Ln = La, Sm, and Gd): A New 3d-4f Series Exhibiting One-Dimensional Manganese(III) Oxide Chains Connected via LnO9 Units","Inorganic Chemistry","2009","48","","8439","8444","10.1021/ic901043g","","","0.71073","MoKα","","0.0943","0.0878","","","0.2409","0.2483","","","","","","1.173","","","","has coordinates","179068","2020-10-21","18:00:00",""
"4303070","11.0906","0.0016","11.0906","0.0016","5.954","0.0012","90","","90","","120","","634.23","0.18","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- As3 Gd Mn3 Na3 O15 -","- As3 Gd Mn3 Na3 O15 -","- As6 Gd2 Mn6 Na6 O30 -","2","0.166667","","J. Palmer West; Shiou-Jyh Hwu; Wendy L. Queen","Synthesis, Structure, and Magnetic Properties of Na3LnMn3O3(AsO4)3 (Ln = La, Sm, and Gd): A New 3d-4f Series Exhibiting One-Dimensional Manganese(III) Oxide Chains Connected via LnO9 Units","Inorganic Chemistry","2009","48","","8439","8444","10.1021/ic901043g","","","0.71073","MoKα","","0.0571","0.0466","","","0.1318","0.1411","","","","","","1.101","","","","has coordinates","179068","2020-10-21","18:00:00",""
"4304497","12.8786","0.0006","12.8786","0.0006","11.7792","0.0012","90","","90","","120","","1691.9","0.2","100","","100","","","","","","","","","2","P 63/m","-P 6c","176","","","","- In9 Se14 -","- In9 Se14 -","- In18 Se28 -","2","0.166667","","Paz Vaqueiro","A Three-Dimensional Open-Framework Indium Selenide: [C7H10N][In9Se14]","Inorganic Chemistry","2008","47","","20","22","10.1021/ic701995p","","","0.71073","MoKα","","0.0316","0.0202","","0.027","0.0223","0.0223","","","","","","0.9867","","","","has coordinates","179082","2020-10-21","18:00:00",""
"4304552","21.6766","0.0014","21.6766","0.0014","36.176","0.005","90","","90","","120","","14721","2","223","2","223","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C102 H249 N39 Ni21 O246 Pr20 -","- C102 H120 N39 Ni21 O246 Pr20 -","- C204 H240 N78 Ni42 O492 Pr40 -","2","0.166667","","Xiang-Jian Kong; Yan-Ping Ren; La-Sheng Long; Zhiping Zheng; Gary Nichol; Rong-Bin Huang; Lan-Sun Zheng","Dual Shell-like Magnetic Clusters Containing NiII and LnIII (Ln = La, Pr, and Nd) Ions","Inorganic Chemistry","2008","47","","2728","2739","10.1021/ic702079e","","","0.71073","MoKα","","0.1246","0.098","","","0.2057","0.2229","","","","","","1.179","","","","has coordinates","179083","2020-10-21","18:00:00",""
"4305163","8.9953","0.0004","8.9953","0.0004","27.457","0.003","90","","90","","120","","1924","0.2","100","2","100","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C38 H60 N8 O6 -","- C38 H60 N8 O6 -","- C76 H120 N16 O12 -","2","0.166667","","I. Ravikumar; P. S. Lakshminarayanan; E. Suresh; Pradyut Ghosh","Spherical versus Linear Anion Encapsulation in the Cavity of a Protonated Azacryptand","Inorganic Chemistry","2008","47","","7992","7999","10.1021/ic702056y","","","0.71073","MoKα","","0.0724","0.0584","","","0.1531","0.1718","","","","","","1.035","","","","has coordinates","288193","2023-12-08","17:12:23",""
"4305756","22.3917","0.0006","22.3917","0.0006","40.726","0.0017","90","","90","","120","","17683.8","1","223","2","223","2","","","","","","","","10","P 63/m","-P 6c","176","","","","- C273 H216 Cl36 F27 N6 Na3 O56 P12 Pt6 S9 -","- C273 H216 Cl36 F27 N6 Na3 O56 P12 Pt6 S9 -","- C546 H432 Cl72 F54 N12 Na6 O112 P24 Pt12 S18 -","2","0.166667","","Peili Teo; L. L. Koh; T. S. Andy Hor","Oligo- and Polymeric PdII and PtII Using Pyridyl Carboxylate Spacers for Topology Control","Inorganic Chemistry","2008","47","","6464","6474","10.1021/ic8007238","","","0.71073","MoKα","","0.1249","0.0529","","","0.1342","0.1539","","","","","","0.87","","","","has coordinates","286259","2023-09-07","06:04:45",""
"4307267","13.86","0.002","13.86","0.002","7.33","0.0015","90","","90","","120","","1219.4","0.4","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C3 H18 Cm F9 O18 S3 -","- C3 H18 Cm F9 O18 S3 -","- C6 H36 Cm2 F18 O36 S6 -","2","0.166667","","S. Skanthakumar; Mark R. Antonio; Richard E. Wilson; L. Soderholm","The Curium Aqua Ion","Inorganic Chemistry","2007","46","","3485","3491","10.1021/ic061798b","","","0.71073","MoKα","","0.0115","0.0112","","","0.0286","0.0286","","","","","","1.157","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307271","22.417","0.003","22.417","0.003","30.021","0.007","90","","90","","120","","13065","4","193","2","193","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C211 H135 F27 N41 Nd7 O51 S9 -","- C210.96 H120 F19.95 N40.98 Nd7 O43.97 S8.98 -","- C421.92 H240 F39.9 N81.96 Nd14 O87.94 S17.96 -","2","0.166667","","Xiao-Yan Chen; Yann Bretonnière; Jacques Pécaut; Daniel Imbert; Jean-Claude Bünzli; Marinella Mazzanti","Selective Self-Assembly of Hexameric Homo- and Heteropolymetallic Lanthanide Wheels: Synthesis, Structure, and Photophysical Studies","Inorganic Chemistry","2007","46","","625","637","10.1021/ic061806o","","","0.71073","MoKα","","0.1388","0.1246","","","0.2751","0.2822","","","","","","1.403","","","","has coordinates,has disorder","179110","2020-10-21","18:00:00",""
"4307272","22.9958","0.0007","22.9958","0.0007","31.3192","0.0017","90","","90","","120","","14342.9","1","223","2","223","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C221 H150 F27 Gd7 N46 O51 S9 -","- C218.07 H120 F15 Gd7 N46.05 O45.02 S8.97 -","- C436.14 H240 F30 Gd14 N92.1 O90.04 S17.94 -","2","0.166667","","Xiao-Yan Chen; Yann Bretonnière; Jacques Pécaut; Daniel Imbert; Jean-Claude Bünzli; Marinella Mazzanti","Selective Self-Assembly of Hexameric Homo- and Heteropolymetallic Lanthanide Wheels: Synthesis, Structure, and Photophysical Studies","Inorganic Chemistry","2007","46","","625","637","10.1021/ic061806o","","","0.71073","MoKα","","0.222","0.0695","","","0.1947","0.2535","","","","","","0.836","","","","has coordinates,has disorder","179110","2020-10-21","18:00:00",""
"4307273","22.368","0.004","22.368","0.004","30.072","0.011","90","","90","","120","","13030","6","193","2","193","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C218 H156 Eu6 F27 Lu N42 O55 S9 -","- C217.98 H150.96 Eu6 F27.06 Lu N42 O55.04 S9.02 -","- C435.96 H301.92 Eu12 F54.12 Lu2 N84 O110.08 S18.04 -","2","0.166667","","Xiao-Yan Chen; Yann Bretonnière; Jacques Pécaut; Daniel Imbert; Jean-Claude Bünzli; Marinella Mazzanti","Selective Self-Assembly of Hexameric Homo- and Heteropolymetallic Lanthanide Wheels: Synthesis, Structure, and Photophysical Studies","Inorganic Chemistry","2007","46","","625","637","10.1021/ic061806o","","","0.71073","MoKα","","0.0858","0.0748","","","0.1757","0.1809","","","","","","1.301","","","","has coordinates,has disorder","179110","2020-10-21","18:00:00",""
"4308523","20.8033","0.0006","20.8033","0.0006","18.1398","0.0008","90","","90","","120","","6798.7","0.4","120","2","120","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C10 H0.67 Cs4.26 N10 Na1.74 Nb4 O5.33 S11 -","- C10 Cs4.26 N10 Na1.74 Nb4 O5.33333 S11 -","- C60 Cs25.56 N60 Na10.44 Nb24 O32 S66 -","6","0.5","","Bee-Lean Ooi; Inger Søtofte; Maja F. Bendtsen; Astrid Munch; Loa C. Nielsen; Jonas Henriksen","An Unprecedented Tetranuclear Niobium Aqua Ion with a Capping μ4-Sulfido Ligand","Inorganic Chemistry","2005","44","","480","482","10.1021/ic048659j","","","0.71073","MoKα","","0.088","0.0696","","","0.1878","0.202","","","","","","1.071","","","","has coordinates","179123","2020-10-21","18:00:00",""
"4309790","12.548","0.002","12.548","0.002","20.391","0.007","90","","90","","120","","2780.5","1.1","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C6 H10 Cl1.17 N1.33 O1.81 -","- C6 H10 Cl1.16667 N1.33333 O1.81333 -","- C72 H120 Cl14 N16 O21.76 -","12","1","","P. S. Lakshminarayanan; D. Krishna Kumar; Pradyut Ghosh","Counteranion-Controlled Water Cluster Recognition in a Protonated Octaamino Cryptand","Inorganic Chemistry","2005","44","","7540","7546","10.1021/ic051191f","","","0.71073","MoKα","","0.106","0.0826","","","0.1792","0.1969","","","","","","1.226","","","","has coordinates","179135","2020-10-21","18:00:00",""
"4311986","17.8474","0.0004","17.8474","0.0004","18.0638","0.0004","90","","90","","120","","4982.99","0.19","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","Compound gc461y","","","- C42 H114 Fe6 N6 Na12 O81 -","- C42 H24 Fe6 N6 Na6 O87.01 -","- C84 H48 Fe12 N12 Na12 O174.02 -","2","0.166667","","Geoffrey J. T. Cooper; Hamera Abbas; Paul Kögerler; De-Liang Long; Leroy Cronin","Pentadecadentate Chelating Ligands as Building Blocks for a {Fe6} Cage with 12 Exo-Coordinated Sodium Cations","Inorganic Chemistry","2004","43","","7266","7268","10.1021/ic049068w","","","0.71073","MoKα","","0.0764","0.0633","","","0.1718","0.1807","","","","","","1.082","","","","has coordinates,has disorder","179158","2020-10-21","18:00:00",""
"4312301","7.1761","0.0006","7.1761","0.0006","16.966","0.002","90","","90","","120","","756.64","0.13","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- B9 Ba3 O18 Y -","- B9 Ba3 O18 Y -","- B18 Ba6 O36 Y2 -","2","0.166667","","X. Z. Li; C. Wang; X. L. Chen; H. Li; L. S. Jia; L. Wu; Y. X. Du; Y. P. Xu","Syntheses, Thermal Stability, and Structure Determination of the Novel Isostructural RBa3B9O18 (R = Y, Pr, Nd, Sm, Eu, Gd, Tb, Dy, Ho, Er, Tm, Yb)","Inorganic Chemistry","2004","43","","8555","8560","10.1021/ic049710m","","","0.71073","MoKα","","0.0568","0.0513","","","0.1297","0.1328","","","","","","1.169","","","","has coordinates","179162","2020-10-21","18:00:00",""
"4313275","7.584","0.002","7.584","0.002","5.41","0.003","90","","90","","120","","269.48","0.18","235","2","235","2","","","","","","","","3","P 63/m","-P 6c","176","strontium three gallium trinitride","","","- Ga N3 Sr3 -","- Ga N3 Sr3 -","- Ga2 N6 Sr6 -","2","0.166667","","Dong Gon Park; Zoltán A. Gál; Francis J. DiSalvo","Synthesis and Structure of Sr3GaN3 and Sr6GaN5: Strontium Gallium Nitrides with Isolated Planar [GaN3]6- Anions","Inorganic Chemistry","2003","42","","1779","1785","10.1021/ic025874w","","","0.71073","MoKα","","0.0363","0.0326","","","0.0807","0.0818","","","","","","1.274","","","","has coordinates","179188","2020-10-21","18:00:00",""
"4313354","13.6458","0.0012","13.6458","0.0012","29.446","0.006","90","","90","","120","","4748.5","1.1","298","2","298","2","","","","","","","","7","P 63/m","-P 6c","176","4","","","- C85 H66 Au2 Cl2 I2 N6 P6 -","- C84.99 H66 Au2 Cl2.01 I2 N6 P6 -","- C169.98 H132 Au4 Cl4.02 I4 N12 P12 -","2","0.166667","","Vincent J. Catalano; Mark A. Malwitz; Stephen J. Horner; John Vasquez","Three- and Four-Coordinate Gold(I) Complexes of 3,6-Bis(diphenylphosphino)pyridazine: Monomers, Polymers, and a Metallocryptand Cage","Inorganic Chemistry","2003","42","","2141","2148","10.1021/ic020601m","","","0.71073","MoKα","","0.1473","0.0706","","","0.1742","0.1979","","","","","","0.995","","","","has coordinates","179191","2020-10-21","18:00:00",""
"4315471","13.33","0.01","13.33","0.01","23.32","0.01","90","","90","","120","0.01","3589","4","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","hexakis(dmpu)lanthanum(III) iodide","hexakis[1,3-dimethyltetrahydropyrimidin-2(1H)-one-κO]lanthanum(III) iodide","","- C54 H108 I3 La N18 O9 -","- C54 H108 I3 La N18 O9 -","- C108 H216 I6 La2 N36 O18 -","2","0.166667","","Daniel Lundberg; Ingmar Persson; Lars Eriksson; Paola D'Angelo; Simone de Panfilis","Structural Study of the N,N'-Dimethylpropyleneurea Solvated Lanthanoid(III) Ions in Solution and Solid State with an Analysis of the Ionic Radii of Lanthanoid(III) Ions","Inorganic Chemistry","2010","49","","4420","4432","10.1021/ic100034q","","x-ray","1.087","synchrotron","","0.06","0.0551","","","0.1343","0.1375","","","","","","1.083","","","","has coordinates","179234","2020-10-21","18:00:00",""
"4315472","13.2345","0.0005","13.2345","0.0005","23.2798","0.0012","90","","90","","120","","3531.2","0.3","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","hexakis(dmpu)praseodymium(III) iodide","hexakis[1,3-dimethyltetrahydropyrimidin-2(1H)-one-κO]praseodymium(III) iodide","","- C54 H108 I3 N18 O9 Pr -","- C54 H108 I3 N18 O9 Pr -","- C108 H216 I6 N36 O18 Pr2 -","2","0.166667","","Daniel Lundberg; Ingmar Persson; Lars Eriksson; Paola D'Angelo; Simone de Panfilis","Structural Study of the N,N'-Dimethylpropyleneurea Solvated Lanthanoid(III) Ions in Solution and Solid State with an Analysis of the Ionic Radii of Lanthanoid(III) Ions","Inorganic Chemistry","2010","49","","4420","4432","10.1021/ic100034q","","x-ray","0.71073","MoKα","","0.1146","0.0404","","","0.0535","0.0618","","","","","","0.761","","","","has coordinates","179234","2020-10-21","18:00:00",""
"4315473","13.2344","0.0003","13.2344","0.0003","23.2595","0.0003","90","","90","","120","","3528.09","0.12","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","hexakis(dmpu)neodymium(III) iodide","hexakis[1,3-dimethyltetrahydropyrimidin-2(1H)-one-κO]neodymium(III) iodide","","- C54 H108 I3 N18 Nd O9 -","- C54 H108 I3 N18 Nd O9 -","- C108 H216 I6 N36 Nd2 O18 -","2","0.166667","","Daniel Lundberg; Ingmar Persson; Lars Eriksson; Paola D'Angelo; Simone de Panfilis","Structural Study of the N,N'-Dimethylpropyleneurea Solvated Lanthanoid(III) Ions in Solution and Solid State with an Analysis of the Ionic Radii of Lanthanoid(III) Ions","Inorganic Chemistry","2010","49","","4420","4432","10.1021/ic100034q","","x-ray","0.71073","MoKα","","0.0349","0.0287","","","0.0735","0.0752","","","","","","1.177","","","","has coordinates","179234","2020-10-21","18:00:00",""
"4316101","41.3685","0.0012","41.3685","0.0012","17.5097","0.0011","90","","90","","120","","25950.7","1.9","200","2","200","2","","","","","","","","6","P 63/m","-P 6c","176","UMCM-1-AMInpz","","","- C47 H26 In0.4 N2 O14.5 Zn4 -","- C44 N0.5 O13 Zn4 -","- C264 N3 O78 Zn24 -","6","0.5","","Kristine K. Tanabe; Seth M. Cohen","Modular, Active, and Robust Lewis Acid Catalysts Supported on a Metal-Organic Framework","Inorganic Chemistry","2010","49","","6766","6774","10.1021/ic101125m","","","0.71073","MoKα","","0.0769","0.0368","","","0.0744","0.0801","","","","","","0.89","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4316777","10.527","0.001","10.527","0.001","3.7245","0.0007","90","","90","","120","","357.44","0.08","173","2","173","2","","","","","","","","4","P 63/m","-P 6c","176","hexagonal Molybdenum Oxide","","","- H7.38 Mo5.16 N0.78 O18 -","- Mo5.136 N0.86 O18.54 -","- Mo5.136 N0.86 O18.54 -","1","0.0833333","","Hans-Joachim Lunk; Hans Hartl; Monika A. Hartl; Martin J. G. Fait; Ilya G. Shenderovich; Michael Feist; Timothy A. Frisk; Luke L. Daemen; Daniel Mauder; Reinhard Eckelt; Andrey A. Gurinov","""Hexagonal Molybdenum Trioxide""-Known for 100 Years and Still a Fount of New Discoveries","Inorganic Chemistry","2010","49","","9400","9408","10.1021/ic101103g","","","0.71073","MoKα","","0.0238","0.0203","","","0.0511","0.0526","","","","","","1.243","","","","has coordinates","179247","2020-10-21","18:00:00",""
"4316924","11.4342","0.0007","11.4342","0.0007","16.131","0.002","90","","90","","120","","1826.4","0.3","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C38 H33 As0.915 N S6 Sb1.085 -","- C36 H30 As0.916 S6 Sb1.084 -","- C72 H60 As1.832 S12 Sb2.168 -","2","0.166667","","Virginia M. Cangelosi; Timothy G. Carter; Justin L. Crossland; Lev N. Zakharov; Darren W. Johnson","Self-Assembled E2L3 Cryptands (E = P, As, Sb, Bi): Transmetalation, Homo- and Heterometallic Assemblies, and Conformational Isomerism","Inorganic Chemistry","2010","49","","9985","9992","10.1021/ic1012186","","","0.71073","MoKα","","0.0399","0.0318","","","0.0722","0.0761","","","","","","1.108","","","","has coordinates","179249","2020-10-21","18:00:00",""
"4316926","11.383","0.0006","11.383","0.0006","16.1453","0.0018","90","","90","","120","","1811.7","0.2","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C38 H33 N P S6 Sb -","- C36 H30 P S6 Sb -","- C72 H60 P2 S12 Sb2 -","2","0.166667","","Virginia M. Cangelosi; Timothy G. Carter; Justin L. Crossland; Lev N. Zakharov; Darren W. Johnson","Self-Assembled E2L3 Cryptands (E = P, As, Sb, Bi): Transmetalation, Homo- and Heterometallic Assemblies, and Conformational Isomerism","Inorganic Chemistry","2010","49","","9985","9992","10.1021/ic1012186","","","0.71073","MoKα","","0.0405","0.0334","","","0.081","0.0849","","","","","","1.114","","","","has coordinates","179249","2020-10-21","18:00:00",""
"4317043","9.41898","0.00019","9.41898","0.00019","6.88119","0.00017","90","","90","","120","","528.69","0.02","296","","296","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca10 H2 O26 P6 -","- Ca10 O26 P6 -","- Ca10 O26 P6 -","1","0.0833333","","Lyudmyla I. Ardanova; Evgeni I. Get'man; Stanislav N. Loboda; Vadim V. Prisedsky; Tatiana V. Tkachenko; Valeriy I. Marchenko; Valeriy P. Antonovich; Nataliya A. Chivireva; Konstantin A. Chebishev; Alexandra S. Lyashenko","Isomorphous Substitutions of Rare Earth Elements for Calcium in Synthetic Hydroxyapatites","Inorganic Chemistry","2010","49","","10687","10693","10.1021/ic1015127","powder diffraction","","1.5418","CuKα","","","","","","","","","7.7502","1.1644","","","","","","","has coordinates","179250","2020-10-21","18:00:00",""
"4317044","9.40558","0.00019","9.40558","0.00019","6.8641","0.00015","90","","90","","120","","525.878","0.019","296","","296","","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ca9.6 H1.6 O26 P6 Tm0.4 -","- Ca9.6 O26 P6 Tm0.4 -","- Ca9.6 O26 P6 Tm0.4 -","1","0.0833333","","Lyudmyla I. Ardanova; Evgeni I. Get'man; Stanislav N. Loboda; Vadim V. Prisedsky; Tatiana V. Tkachenko; Valeriy I. Marchenko; Valeriy P. Antonovich; Nataliya A. Chivireva; Konstantin A. Chebishev; Alexandra S. Lyashenko","Isomorphous Substitutions of Rare Earth Elements for Calcium in Synthetic Hydroxyapatites","Inorganic Chemistry","2010","49","","10687","10693","10.1021/ic1015127","powder diffraction","","1.5418","CuKα","","","","","","","","","7.9917","1.3831","","","","","","","has coordinates","179250","2020-10-21","18:00:00",""
"4317045","9.40876","0.00018","9.40876","0.00018","6.87124","0.00015","90","","90","","120","","526.782","0.018","296","","296","","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ca9.8 H1.8 O26 P6 Tm0.2 -","- Ca9.7992 O26 P6 Tm0.2008 -","- Ca9.7992 O26 P6 Tm0.2008 -","1","0.0833333","","Lyudmyla I. Ardanova; Evgeni I. Get'man; Stanislav N. Loboda; Vadim V. Prisedsky; Tatiana V. Tkachenko; Valeriy I. Marchenko; Valeriy P. Antonovich; Nataliya A. Chivireva; Konstantin A. Chebishev; Alexandra S. Lyashenko","Isomorphous Substitutions of Rare Earth Elements for Calcium in Synthetic Hydroxyapatites","Inorganic Chemistry","2010","49","","10687","10693","10.1021/ic1015127","powder diffraction","","1.5418","CuKα","","","","","","","","","8.4059","1.4164","","","","","","","has coordinates","179250","2020-10-21","18:00:00",""
"4317356","9.2291","0.0018","9.2291","0.0018","7.488","0.002","90","","90","","120","","552.4","0.2","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ga2 O9 Te3 -","- Ga2 O9 Te3 -","- Ga4 O18 Te6 -","2","0.166667","","Fang Kong; Xiang Xu; Jiang-Gao Mao","A Series of New Ternary and Quaternary Compounds in the LiI-GaIII-TeIV-O System","Inorganic Chemistry","2010","49","","11573","11580","10.1021/ic101843g","","","0.71073","MoKα","","0.0545","0.0544","","","0.134","0.1341","","","","","","1.186","","","","has coordinates","179253","2020-10-21","18:00:00",""
"4319800","13.9283","0.0006","13.9283","0.0006","7.3816","0.0004","90","","90","","120","","1240.16","0.1","218","2","218","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C3 H18 F9 O18 Pu S3 -","- C3 H18 F9 O18 Pu S3 -","- C6 H36 F18 O36 Pu2 S6 -","2","0.166667","","John H. Matonic; Brian L. Scott; Mary P. Neu","High-Yield Synthesis and Single-Crystal X-ray Structure of a Plutonium(III) Aquo Complex: [Pu(H2O)9][CF3SO3]3","Inorganic Chemistry","2001","40","","2638","2639","10.1021/ic015509p","","","0.71073","MoKα","","0.0292","0.0243","","0.0466","0.0452","","","","1.217","1.223","1.223","","","","","has coordinates","179278","2020-10-21","18:00:00",""
"4320647","10.1019","0.0004","10.1019","0.0004","15.5214","0.0008","90","","90","","120","","1371.73","0.1","183","2","183","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C30 H45 La -","- C30 H45 La -","- C60 H90 La2 -","2","0.166667","","William J. Evans; Benjamin L. Davis; Joseph W. Ziller","Synthesis and Structure of Tris(alkyl- and silyl-tetramethylcyclopentadienyl) Complexes of Lanthanum","Inorganic Chemistry","2001","40","","6341","6348","10.1021/ic010554i","","","0.71073","MoKα","","0.0211","0.0206","","","0.0606","0.0609","","","","","","1.201","","","","has coordinates","179309","2020-10-21","18:00:00",""
"4321020","12.5802","0.0009","12.5802","0.0009","24.285","0.004","90","","90","","120","","3328.5","0.6","291","2","291","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C24 H85 Cl2 Cu6 N6 O60 Tb -","- C24 H30 Cl2 Cu6 N6 O60 Tb -","- C48 H60 Cl4 Cu12 N12 O120 Tb2 -","2","0.166667","","Qin-De Liu; Song Gao; Jun-Ran Li; Qing-Zhong Zhou; Kai-Bei Yu; Bao-Qing Ma; Shi-Wei Zhang; Xi-Xiang Zhang; Tian-Zhu Jin","Structures and Magnetism of Two Novel Heptanuclear Lanthanide-Centered Trigonal Prismatic Clusters: [LnCu6(μ3-OH)3(HL)2(L)4](ClO4)2.25H2O (Ln = La, Tb; H2L = Iminodiacetic Acid)","Inorganic Chemistry","2000","39","","2488","2492","10.1021/ic990860k","","","0.71073","MoKα","","0.0618","0.0495","","","0.1374","0.1432","","","","","","1.05","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321021","12.6425","0.0014","12.6425","0.0014","24.541","0.005","90","","90","","120","","3396.9","0.9","291","2","291","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C24 H85 Cl2 Cu6 La N6 O60 -","- C24 H30 Cl2 Cu6 La N6 O60 -","- C48 H60 Cl4 Cu12 La2 N12 O120 -","2","0.166667","","Qin-De Liu; Song Gao; Jun-Ran Li; Qing-Zhong Zhou; Kai-Bei Yu; Bao-Qing Ma; Shi-Wei Zhang; Xi-Xiang Zhang; Tian-Zhu Jin","Structures and Magnetism of Two Novel Heptanuclear Lanthanide-Centered Trigonal Prismatic Clusters: [LnCu6(μ3-OH)3(HL)2(L)4](ClO4)2.25H2O (Ln = La, Tb; H2L = Iminodiacetic Acid)","Inorganic Chemistry","2000","39","","2488","2492","10.1021/ic990860k","","","0.71073","MoKα","","0.0613","0.0497","","","0.1374","0.1431","","","","","","1.061","","","","has coordinates,has disorder","179313","2020-10-21","18:00:00",""
"4321294","13.837","0.002","13.837","0.002","7.407","0.001","90","","90","","120","","1228.2","0.3","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","nonaaquabismuth(III) trifluorormethanesulfonate","","- C3 H18 Bi F9 O18 S3 -","- C3 H18 Bi F9 O18 S3 -","- C6 H36 Bi2 F18 O36 S6 -","2","0.166667","","Jan Näslund; Ingmar Persson; Magnus Sandstrom","Solvation of the Bismuth(III) Ion by Water, Dimethyl Sulfoxide, N,N'-Dimethylpropyleneurea, and N,N-Dimethylthioformamide. An EXAFS, Large-Angle X-ray Scattering, and Crystallographic Structural Study","Inorganic Chemistry","2000","39","","4012","4021","10.1021/ic000022m","","","0.71069","MoKα","","0.0456","0.0258","","","0.0331","0.0417","","","","","","1","","","","has coordinates","179315","2020-10-21","18:00:00",""
"4322454","9.6795","0.0014","9.6795","0.0014","13.951","0.003","90","","90","","120","","1132","0.3","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C12 F18 Mo S6 -","- C8 F12 Mo0.666667 S4 -","- C24 F36 Mo2 S12 -","3","0.25","","Kun Wang; Jonathan M. McConnachie; Edward I. Stiefel","Syntheses of Metal Dithiolene Complexes from Thiometalates by Induced Internal Redox Reactions","Inorganic Chemistry","1999","38","","4334","4341","10.1021/ic990204k","","","0.71073","MoKα","","0.1062","0.1036","","0.2854","0.2836","","","","1.144","1.177","1.177","","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4323086","14.9969","0.0011","14.9969","0.0011","3.5526","0.0004","90","","90","","120","","691.96","0.11","295","2","295","2","","","","","","","","3","P 63/m","-P 6c","176","barium hafnium arsenide","","","- As17.7 Ba0.8 Hf12 -","- As17.73 Ba0.836 Hf12 -","- As17.73 Ba0.836 Hf12 -","1","0.0833333","","Robert Lam; Arthur Mar","Ternary Arsenide Ba0.8Hf12As17.7, a Variant of the Cr12P7 Structure Type with Inserted Arsenic Ribbons","Inorganic Chemistry","1998","37","","5364","5368","10.1021/ic980545i","","","0.71073","MoKα","","0.1376","0.063","","0.1175","0.098","","","","1.06","1.187","1.187","","","","","has coordinates","179333","2020-10-21","18:00:00",""
"4323397","16.395","0.002","16.395","0.002","16.03","0.002","90","","90","","120","","3731.5","0.8","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C39 H78 Ag5 Cl6 F30 N24 P5 -","- C39 H78 Ag5 Cl6 F30 N24 P5 -","- C78 H156 Ag10 Cl12 F60 N48 P10 -","2","0.166667","","Lucia Carlucci; Gianfranco Ciani; Davide M. Proserpio; Angelo Sironi","A Novel 3D Three-Connected cubic Network Containing [Ag6(hmt)6]6+ hexagonal Units (hmt = Hexamethylenetetramine)","Inorganic Chemistry","1997","36","","1736","1737","10.1021/ic970043p","","","0.71069","MoKα","","","0.0549","","","0.1035","","","","","1.137","1.137","","","","","has coordinates","179336","2020-10-21","18:00:00",""
"4323484","18.29","0.003","18.29","0.003","8.479","0.002","90","","90","","120","","2456.4","0.8","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","Tris Benzyltrimethyl ammonium thallium tris Iron Tetracarbonylate","","- C42 H48 Fe3 N3 O12 Tl -","- C42 H48 Fe3 N3 O12 Tl -","- C84 H96 Fe6 N6 O24 Tl2 -","2","0.166667","","Jaap W. van Hal; Lawrence B. Alemany; Kenton H. Whitmire","Solution Dynamics of Thallium-Metal Carbonyl Compounds Using 205Tl NMR Spectroscopy","Inorganic Chemistry","1997","36","","3152","3159","10.1021/ic961203k","","","0.71073","MoKα","","0.0368","0.0235","","0.0533","0.0494","","","","1.009","1.039","1.039","","","","","has coordinates,has disorder","179337","2020-10-21","18:00:00",""
"4325124","14.885","0.0007","14.885","0.0007","11.032","0.0006","90","","90","","120","","2116.81","0.18","296","2","296","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Cs8 Ge9 H6 O36 U4 -","- Cs8 Ge9 H6 O36 U4 -","- Cs16 Ge18 H12 O72 U8 -","2","0.166667","","Quang Bac Nguyen; Hsin-Kuan Liu; Wen-Jung Chang; Kwang-Hwa Lii","Cs8UIV(UVIO2)3(Ge3O9)3.3H2O: A Mixed-Valence Uranium Germanate with 9-Ring Channels","Inorganic Chemistry","2011","50","","4241","4243","10.1021/ic200508v","","","0.71073","MoKα","","0.03","0.0249","","","0.0801","0.0824","","","","","","1.108","","","","has coordinates","179354","2020-10-21","18:00:00",""
"4325389","26.605","0.011","26.605","0.011","33.08","0.03","90","","90","","120","","20278","2","100","2","100","2","","","","","","","","4","P 63/m","-P 6c","176","U42Py3","","","- K9 O317 P6 U42 -","- K9 O317 P6 U42 -","- K18 O634 P12 U84 -","2","0.166667","","Daniel K. Unruh; Jie Ling; Jie Qiu; Laura Pressprich; Melissa Baranay; Matthew Ward; Peter C. Burns","Complex nanoscale Cage Clusters Built from Uranyl Polyhedra and Phosphate Tetrahedra","Inorganic Chemistry","2011","50","","5509","5516","10.1021/ic200065y","","","0.71073","MoKα","","0.1372","0.0867","","","0.2934","0.3144","","","","","","2.095","","","","has coordinates","179356","2020-10-21","18:00:00",""
"4325981","16.988","0.0004","16.988","0.0004","13.5711","0.0004","90","","90","","120","","3391.8","0.15","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C47 H81 B7 Ca3 N18 O13 -","- C45 H75 B7 Ca3 N18 O12 -","- C90 H150 B14 Ca6 N36 O24 -","2","0.166667","","Mark J. Saly; Jing Li; Mary Jane Heeg; Charles H. Winter","Efficient Hydride and Pyrazolyl Redistribution upon Thermolysis of a Calcium Complex Containing Dihydrobis(pyrazolyl)borate Ligands","Inorganic Chemistry","2011","50","","7385","7387","10.1021/ic2012815","","","0.71073","MoKα","","0.0686","0.0405","","","0.0954","0.1035","","","","","","1.007","","","","has coordinates,has disorder","179362","2020-10-21","18:00:00",""
"4326738","40.9234","0.0003","40.9234","0.0003","17.3329","0.0003","90","","90","","120","","25138.8","0.5","200","2","200","2","","","","","","","","5","P 63/m","-P 6c","176","UMCM-1-AMPent-T1","","","- C46 H0 N O13 Zn4 -","- C46 N O13 Zn4 -","- C276 N6 O78 Zn24 -","6","0.5","","Chao Chen; Corinne A. Allen; Seth M. Cohen","Tandem Postsynthetic Modification of Metal-Organic Frameworks Using an Inverse-Electron-Demand Diels-Alder Reaction","Inorganic Chemistry","2011","50","","10534","10536","10.1021/ic2017598","","","1.54178","CuKα","","0.0873","0.0521","","","0.1424","0.1533","","","","","","0.938","","","","has coordinates","179370","2020-10-21","18:00:00",""
"4327021","20.792","0.004","20.792","0.004","13.814","0.003","90","","90","","120","","5171.8","1.8","143","2","143","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C45 H41 Mn3 N27 O4 -","- C45 H21 Mn3 N27 O4 -","- C90 H42 Mn6 N54 O8 -","2","0.166667","","Seok Jeong; Xiaokai Song; Sehyun Jeong; Minhak Oh; Xinfang Liu; Dongwook Kim; Dohyun Moon; Myoung Soo Lah","Metal-Organic Frameworks Based on Unprecedented Trinuclear and Pentanuclear Metal-Tetrazole Clusters as Secondary Building Units","Inorganic Chemistry","2011","50","","12133","12140","10.1021/ic201883f","","","0.71073","MoKα","","0.0943","0.0629","","","0.1368","0.1488","","","","","","1.029","","","","has coordinates","179373","2020-10-21","18:00:00",""
"4327051","18.3539","0.0005","18.3539","0.0005","9.7736","0.0004","90","","90","","120","","2851.29","0.16","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C28.5 H9 N0.75 O22 U3 -","- C28.5 H9 N0.75 O22 U3 -","- C57 H18 N1.5 O44 U6 -","2","0.166667","","Christophe Volkringer; Ionut Mihalcea; Jean-François Vigier; Arnaud Beaurain; Marc Visseaux; Thierry Loiseau","Metal-Organic-Framework-Type 1D-Channel Open Network of a Tetravalent Uranium Trimesate","Inorganic Chemistry","2011","50","","11865","11867","10.1021/ic2021963","","","0.71073","MoKα","","0.0782","0.0505","","","0.1543","0.1832","","","","","","1.25","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327125","9.4486","0.0001","9.4486","0.0001","6.94259","0.00011","90","","90","","120","","536.769","0.012","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","ellestadite","ellestadite","","- Ca10 F2 O24 S3 Si3 -","- Ca10 F2 O24 S3 Si3 -","- Ca10 F2 O24 S3 Si3 -","1","0.0833333","","Yanan Fang; Clemens Ritter; Tim White","The Crystal Chemistry of Ca10-y(SiO4)3(SO4)3Cl2-x-2yFx Ellestadite","Inorganic Chemistry","2011","50","","12641","12650","10.1021/ic201673r","powder diffraction","neutron","1.38994","neutron","","","","","","","","","","0.89","","","","","","","has coordinates","179374","2020-10-21","18:00:00",""
"4327126","9.6702","0.0003","9.6702","0.0003","6.8543","0.0003","90","","90","","120","","555.09","0.03","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","ellestadite","ellestadite","","- Ca9.82 Cl1.64 O24 S3 Si3 -","- Ca9.816 Cl1.64 O24 S3 Si3 -","- Ca9.816 Cl1.64 O24 S3 Si3 -","1","0.0833333","","Yanan Fang; Clemens Ritter; Tim White","The Crystal Chemistry of Ca10-y(SiO4)3(SO4)3Cl2-x-2yFx Ellestadite","Inorganic Chemistry","2011","50","","12641","12650","10.1021/ic201673r","powder diffraction","neutron","1.38994","neutron","","","","","","","","","","0.84","","","","","","","has coordinates","179374","2020-10-21","18:00:00",""
"4327127","9.6239","0.0003","9.6239","0.0003","6.8774","0.0003","90","","90","","120","","551.64","0.03","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","ellestadite","ellestadite","","- Ca9.72 Cl1.04 F0.4 O24 S3 Si3 -","- Ca9.718 Cl1.04 F0.398 O24 S3 Si3 -","- Ca9.718 Cl1.04 F0.398 O24 S3 Si3 -","1","0.0833333","","Yanan Fang; Clemens Ritter; Tim White","The Crystal Chemistry of Ca10-y(SiO4)3(SO4)3Cl2-x-2yFx Ellestadite","Inorganic Chemistry","2011","50","","12641","12650","10.1021/ic201673r","powder diffraction","neutron","1.38994","neutron","","","","","","","","","","0.58","","","","","","","has coordinates","179374","2020-10-21","18:00:00",""
"4327128","9.5772","0.0002","9.5772","0.0002","6.895","0.001","90","","90","","120","","547.7","0.08","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","ellestadite","ellestadite","","- Ca9.87 Cl0.94 F0.8 O24 S3 Si3 -","- Ca9.868 Cl0.93 F0.796 O24 S3 Si3 -","- Ca9.868 Cl0.93 F0.796 O24 S3 Si3 -","1","0.0833333","","Yanan Fang; Clemens Ritter; Tim White","The Crystal Chemistry of Ca10-y(SiO4)3(SO4)3Cl2-x-2yFx Ellestadite","Inorganic Chemistry","2011","50","","12641","12650","10.1021/ic201673r","powder diffraction","neutron","1.38994","neutron","","","","","","","","","","0.61","","","","","","","has coordinates","179374","2020-10-21","18:00:00",""
"4327129","9.5312","0.0002","9.5312","0.0002","6.9181","0.0002","90","","90","","120","","544.27","0.02","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","ellestadite","ellestadite","","- Ca9.92 Cl0.63 F1.21 O24 S3 Si3 -","- Ca9.922 Cl0.624 F1.214 O24 S3 Si3 -","- Ca9.922 Cl0.624 F1.214 O24 S3 Si3 -","1","0.0833333","","Yanan Fang; Clemens Ritter; Tim White","The Crystal Chemistry of Ca10-y(SiO4)3(SO4)3Cl2-x-2yFx Ellestadite","Inorganic Chemistry","2011","50","","12641","12650","10.1021/ic201673r","powder diffraction","neutron","1.38994","neutron","","","","","","","","","","0.73","","","","","","","has coordinates","179374","2020-10-21","18:00:00",""
"4327130","9.5064","0.0002","9.5064","0.0002","6.9263","0.0001","90","","90","","120","","542.081","0.018","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","ellestadite","ellestadite","","- Ca10 Cl0.4 F1.6 O24 S3 Si3 -","- Ca10 Cl0.4 F1.6 O24 S3 Si3 -","- Ca10 Cl0.4 F1.6 O24 S3 Si3 -","1","0.0833333","","Yanan Fang; Clemens Ritter; Tim White","The Crystal Chemistry of Ca10-y(SiO4)3(SO4)3Cl2-x-2yFx Ellestadite","Inorganic Chemistry","2011","50","","12641","12650","10.1021/ic201673r","powder diffraction","neutron","1.38994","neutron","","","","","","","","","","0.74","","","","","","","has coordinates","179374","2020-10-21","18:00:00",""
"4327243","16.5876","0.0007","16.5876","0.0007","19.004","0.0007","90","","90","","120","","4528.4","0.3","293","2","293","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C154 H146 Cl6 F24 N24 O60 S8 Zn4 -","- C154 H144 Cl6 F24 N24 O60 S8 Zn4 -","- C154 H144 Cl6 F24 N24 O60 S8 Zn4 -","1","0.0833333","","Zhi-Min Liu; Yu Liu; Sheng-Run Zheng; Zhi-Quan Yu; Mei Pan; Cheng-Yong Su","Assembly of Trigonal and Tetragonal Prismatic Cages from Octahedral Metal Ions and a Flexible Molecular Clip","Inorganic Chemistry","2007","46","","5814","5816","10.1021/ic062270+","","","0.71073","MoKα","","0.0809","0.0569","","","0.1345","0.148","","","","","","1.013","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327371","9.4204","0.0002","9.4204","0.0002","12.1226","0.0002","90","","90","","120","","931.68","0.03","293","2","293","2","","","","","","","","2","P 63/m","-P 6c","176","","","","- Mo9 Se11 -","- Mo9 Se11 -","- Mo18 Se22 -","2","0.166667","","Patrick Gougeon; Michel Potel; Régis Gautier","Syntheses and Structural, Physical, and Theoretical Studies of the Novel Isostructural Mo9 Cluster Compounds Ag2.6CsMo9Se11, Ag4.1ClMo9Se11, and h-Mo9Se11 with Tunnel Structures","Inorganic Chemistry","2004","43","","1257","1263","10.1021/ic035319+","","","0.71069","MoKα","","0.0828","0.048","","","0.1041","0.1152","","","","","","1.09","","","","has coordinates","179376","2020-10-21","18:00:00",""
"4327372","10.0321","0.0002","10.0321","0.0002","11.8734","0.0002","90","","90","","120","","1034.88","0.03","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ag4.13 Cl Mo9 Se11 -","- Ag4.135 Cl Mo9 Se11 -","- Ag8.27 Cl2 Mo18 Se22 -","2","0.166667","","Patrick Gougeon; Michel Potel; Régis Gautier","Syntheses and Structural, Physical, and Theoretical Studies of the Novel Isostructural Mo9 Cluster Compounds Ag2.6CsMo9Se11, Ag4.1ClMo9Se11, and h-Mo9Se11 with Tunnel Structures","Inorganic Chemistry","2004","43","","1257","1263","10.1021/ic035319+","","","0.71069","MoKα","","0.0429","0.0352","","","0.0731","0.0761","","","","","","1.093","","","","has coordinates","179376","2020-10-21","18:00:00",""
"4327373","10.0472","","10.0472","","11.9548","","90","","90","","120","","1045.11","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ag2.568 Cs Mo9 Se11 -","- Ag2.583 Cs Mo9 Se11 -","- Ag5.166 Cs2 Mo18 Se22 -","2","0.166667","","Patrick Gougeon; Michel Potel; Régis Gautier","Syntheses and Structural, Physical, and Theoretical Studies of the Novel Isostructural Mo9 Cluster Compounds Ag2.6CsMo9Se11, Ag4.1ClMo9Se11, and h-Mo9Se11 with Tunnel Structures","Inorganic Chemistry","2004","43","","1257","1263","10.1021/ic035319+","","","0.71069","MoKα","","0.0446","0.0446","","","0.0446","0.0446","","","","1.47","1.47","1.47","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327455","15.6882","0.0005","15.6882","0.0005","29.9778","0.0018","90","","90","","120","","6389.6","0.5","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C80 H133 Mo12 N7 Na3 O72 P -","- C79.98 H114 Mo12 N7 Na3 O72 P -","- C159.96 H228 Mo24 N14 Na6 O144 P2 -","2","0.166667","","Yangguang Li; Na Hao; Enbo Wang; Mei Yuan; Changwen Hu; Ninghai Hu; Hengqing Jia","New High-Dimensional Networks Based on Polyoxometalate and Crown Ether Building Blocks","Inorganic Chemistry","2003","42","","2729","2735","10.1021/ic026172+","","","0.71073","MoKα","","0.0978","0.0624","","","0.1441","0.1579","","","","","","1.071","","","","has coordinates","179377","2020-10-21","18:00:00",""
"4327456","15.7435","0.0017","15.7435","0.0017","30.042","0.007","90","","90","","120","","6448.5","1.8","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C80 H133 As Mo12 N7 Na3 O72 -","- C79.98 H114 As Mo12 N7 Na3 O72 -","- C159.96 H228 As2 Mo24 N14 Na6 O144 -","2","0.166667","","Yangguang Li; Na Hao; Enbo Wang; Mei Yuan; Changwen Hu; Ninghai Hu; Hengqing Jia","New High-Dimensional Networks Based on Polyoxometalate and Crown Ether Building Blocks","Inorganic Chemistry","2003","42","","2729","2735","10.1021/ic026172+","","","0.71073","MoKα","","0.1028","0.0645","","","0.1603","0.1727","","","","","","0.954","","","","has coordinates","179377","2020-10-21","18:00:00",""
"4327884","36.752","0.002","36.752","0.002","16.2793","0.0019","90","","90","","120","","19043","3","150","2","150","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C48 As7 N8 O42 V10 -","- C49 As7 N8 O42 V10 -","- C294 As42 N48 O252 V60 -","6","0.5","","John M. Breen; Lei Zhang; Raphaèle Clement; Wolfgang Schmitt","Hybrid Polyoxovanadates: Anion-Influenced Formation of Nanoscopic Cages and Supramolecular Assemblies of Asymmetric Clusters","Inorganic Chemistry","2012","51","","19","21","10.1021/ic202104z","","","0.71073","MoKα","","0.1153","0.0585","","","0.1385","0.151","","","","","","0.919","","","","has coordinates,has disorder","179381","2020-10-21","18:00:00",""
"4328065","14.972","0.004","14.972","0.004","22.3","0.009","90","","90","","120","","4329","2","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C36 H71.91 Cl0.416 Co6.584 N23 O51.12 Pr2.416 -","- C36 H69 Cl0.416 Co6.584 N23 O49.41 Pr2.416 -","- C72 H138 Cl0.832 Co13.168 N46 O98.82 Pr4.832 -","2","0.166667","","George J. Sopasis; Maria Orfanoudaki; Pavlos Zarmpas; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Constantinos J. Milios","2-Aminoisobutyric Acid in Co(II) and Co(II)/Ln(III) Chemistry: Homometallic and Heterometallic Clusters","Inorganic Chemistry","2012","51","","1170","1179","10.1021/ic2024007","","","0.71073","MoKα","","0.06","0.0323","","","0.0898","0.1003","","","","","","1.06","","","","has coordinates,has disorder","179383","2020-10-21","18:00:00",""
"4328067","14.92","0.006","14.92","0.006","22.25","0.009","90","","90","","120","","4289","3","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C36 H72.04 Cl0.44 Co6.56 N23 O51.56 Sm2.44 -","- C36 H69 Cl0.4408 Co6.559 N23 O49.76 Sm2.441 -","- C72 H138 Cl0.8816 Co13.118 N46 O99.52 Sm4.882 -","2","0.166667","","George J. Sopasis; Maria Orfanoudaki; Pavlos Zarmpas; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Constantinos J. Milios","2-Aminoisobutyric Acid in Co(II) and Co(II)/Ln(III) Chemistry: Homometallic and Heterometallic Clusters","Inorganic Chemistry","2012","51","","1170","1179","10.1021/ic2024007","","","0.71073","MoKα","","0.1092","0.0389","","","0.0832","0.1014","","","","","","1","","","","has coordinates,has disorder","179383","2020-10-21","18:00:00",""
"4328069","15.021","0.003","15.021","0.003","22.362","0.006","90","","90","","120","","4369.6","1.7","220","2","220","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C36 H71.35 Cl0.35 Co6.656 N23 O50.54 Tb2.344 -","- C36 H69 Cl0.3436 Co6.656 N23 O49.16 Tb2.344 -","- C72 H138 Cl0.6872 Co13.312 N46 O98.32 Tb4.688 -","2","0.166667","","George J. Sopasis; Maria Orfanoudaki; Pavlos Zarmpas; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Constantinos J. Milios","2-Aminoisobutyric Acid in Co(II) and Co(II)/Ln(III) Chemistry: Homometallic and Heterometallic Clusters","Inorganic Chemistry","2012","51","","1170","1179","10.1021/ic2024007","","","0.71073","MoKα","","0.0561","0.0312","","","0.0748","0.0802","","","","","","1.008","","","","has coordinates,has disorder","179383","2020-10-21","18:00:00",""
"4328070","14.844","0.004","14.844","0.004","22.236","0.008","90","","90","","120","","4243","2","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C72 H143.9 Cl0.54 Co13.45 Ho4.54 N46 O101.1 -","- C72 H138 Cl0.54 Co13.46 Ho4.54 N46 O98.92 -","- C72 H138 Cl0.54 Co13.46 Ho4.54 N46 O98.92 -","1","0.0833333","","George J. Sopasis; Maria Orfanoudaki; Pavlos Zarmpas; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Constantinos J. Milios","2-Aminoisobutyric Acid in Co(II) and Co(II)/Ln(III) Chemistry: Homometallic and Heterometallic Clusters","Inorganic Chemistry","2012","51","","1170","1179","10.1021/ic2024007","","","0.71073","MoKα","","0.0663","0.0315","","","0.0792","0.0914","","","","","","1.06","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4328072","12.453","0.004","12.453","0.004","22.078","0.008","90","","90","","120","","2965.1","1.7","110","2","110","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C24 H69 Cl1.48 Co6 N10.52 O43.48 Tm -","- C24 H69 Cl1.48 Co6 N10.52 O43.48 Tm -","- C48 H138 Cl2.96 Co12 N21.04 O86.96 Tm2 -","2","0.166667","","George J. Sopasis; Maria Orfanoudaki; Pavlos Zarmpas; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Constantinos J. Milios","2-Aminoisobutyric Acid in Co(II) and Co(II)/Ln(III) Chemistry: Homometallic and Heterometallic Clusters","Inorganic Chemistry","2012","51","","1170","1179","10.1021/ic2024007","","","0.71073","MoKα","","0.095","0.0342","","","0.0336","0.0362","","","","","","0.813","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4328425","14.924","0.0002","14.924","0.0002","20.755","0.0004","90","","90","","120","","4003.35","0.11","297","2","297","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C45 H108 N6 O9 Ru3 Si12 Sn3 -","- C45 H108 N6 O9 Ru3 Si12 Sn3 -","- C90 H216 N12 O18 Ru6 Si24 Sn6 -","2","0.166667","","Javier A. Cabeza; Pablo García-Álvarez; Diego Polo","Synthesis of Mixed Tin-Ruthenium and Tin-Germanium-Ruthenium Carbonyl Clusters from [Ru3(CO)12] and Diaminometalenes (M = Sn, Ge)","Inorganic Chemistry","2012","51","","2569","2576","10.1021/ic202532u","","","1.5418","CuKα","","0.0493","0.0458","","","0.1279","0.1319","","","","","","1.084","","","","has coordinates,has disorder","179387","2020-10-21","18:00:00",""
"4329046","14.8402","0.0008","14.8402","0.0008","18.0477","0.0018","90","","90","","120","","3442.2","0.4","130","2","130","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C51 H98 Mn3 N12 O14 -","- C52.02 H98.16 Mn3 N12 O14.02 -","- C104.04 H196.32 Mn6 N24 O28.04 -","2","0.166667","","Galina M. Dulcevscaia; Irina G. Filippova; Manfred Speldrich; Jan van Leusen; Victor Ch. Kravtsov; Svetlana G. Baca; Paul Kögerler; Shi-Xia Liu; Silvio Decurtins","Cluster-Based Networks: 1D and 2D Coordination Polymers Based on {MnFe~2~(μ~3~-O)}-Type Clusters","Inorganic Chemistry","2012","51","","5110","5117","10.1021/ic202644t","","","0.71073","MoKα","","0.0702","0.0577","","","0.1674","0.1783","","","","","","1.007","","","","has coordinates,has disorder","179393","2020-10-21","18:00:00",""
"4329269","20.13","0.005","20.13","0.005","13.367","0.004","90","","90","","120","","4691","2","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C39 H87.6 Ce Cu6 N9 O34.8 -","- C39 H87 Ce Cu6 N9 O34.8 -","- C78 H174 Ce2 Cu12 N18 O69.6 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.0703","0.0504","","","0.1529","0.1636","","","","","","1.113","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4329270","19.892","0.007","19.892","0.007","13.304","0.005","90","","90","","120","","4559","3","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C41.25 H96.2 Cu6 N9 O36.85 Pr -","- C41.25 H96 Cu6 N9 O36.85 Pr -","- C82.5 H192 Cu12 N18 O73.7 Pr2 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.0801","0.0478","","","0.1232","0.1341","","","","","","1.072","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4329271","19.88","0.008","19.88","0.008","13.243","0.005","90","","90","","120","","4533","3","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C42.75 H102.2 Cu6 N9 Nd O38.35 -","- C42.75 H102 Cu6 N9 Nd O38.35 -","- C85.5 H204 Cu12 N18 Nd2 O76.7 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.1052","0.0721","","","0.165","0.1791","","","","","","1.144","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4329272","19.858","0.006","19.858","0.006","13.23","0.004","90","","90","","120","","4518","2","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C42.75 H102.2 Cu6 N9 O38.35 Sm -","- C42.75 H102 Cu6 N9 O38.35 Sm -","- C85.5 H204 Cu12 N18 O76.7 Sm2 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.1008","0.0645","","","0.134","0.1478","","","","","","1.094","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4329273","19.827","0.004","19.827","0.004","13.258","0.003","90","","90","","120","","4513.6","1.6","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C42.75 H102 Cu6 Eu N9 O38.25 -","- C42.75 H102 Cu6 Eu N9 O38.25 -","- C85.5 H204 Cu12 Eu2 N18 O76.5 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.0819","0.054","","","0.1289","0.1408","","","","","","1.1","","","","has coordinates,has disorder","179395","2020-10-21","18:00:00",""
"4329274","19.929","0.006","19.929","0.006","13.308","0.004","90","","90","","120","","4577","2","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C40.5 H95.25 Cu6 Gd N9 O37.125 -","- C40.5 H93 Cu6 Gd N9 O37.125 -","- C81 H186 Cu12 Gd2 N18 O74.25 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.0504","0.0332","","","0.1031","0.1085","","","","","","1.004","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4329275","20.013","0.009","20.013","0.009","13.26","0.003","90","","90","","120","","4599","3","200","2","200","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C31.5 H69 Cu6 N9 O33 Tb -","- C31.5 H66 Cu6 N9 O33 Tb -","- C63 H132 Cu12 N18 O66 Tb2 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.1913","0.098","","","0.2132","0.2454","","","","","","1.064","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4329276","20.116","0.005","20.116","0.005","13.338","0.005","90","","90","","120","","4674","2","120","2","120","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C39 H87 Cu6 Dy N9 O34.5 -","- C39 H87 Cu6 Dy N9 O34.5 -","- C78 H174 Cu12 Dy2 N18 O69 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.0689","0.0474","","","0.136","0.1442","","","","","","1.11","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4329277","19.802","0.006","19.802","0.006","13.224","0.004","90","","90","","120","","4491","2","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C42.75 H102 Cu6 Ho N9 O38.25 -","- C42.75 H102 Cu6 Ho N9 O38.25 -","- C85.5 H204 Cu12 Ho2 N18 O76.5 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.0571","0.045","","","0.1076","0.1125","","","","","","1.123","","","","has coordinates,has disorder","179395","2020-10-21","18:00:00",""
"4329278","19.955","0.004","19.955","0.004","13.273","0.003","90","","90","","120","","4577.2","1.7","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C42.75 H102.2 Cu6 Er N9 O38.35 -","- C42.75 H102 Cu6 Er N9 O38.35 -","- C85.5 H204 Cu12 Er2 N18 O76.7 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.0945","0.0598","","","0.1369","0.1479","","","","","","1.114","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4329279","19.852","0.007","19.852","0.007","13.239","0.004","90","","90","","120","","4519","3","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C42.75 H102 Cu6 N9 O38.25 Tm -","- C42.75 H102 Cu6 N9 O38.25 Tm -","- C85.5 H204 Cu12 N18 O76.5 Tm2 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.083","0.0549","","","0.123","0.1328","","","","","","1.14","","","","has coordinates,has disorder","179395","2020-10-21","18:00:00",""
"4329280","19.965","0.005","19.965","0.005","13.193","0.004","90","","90","","120","","4554","2","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C39 H87.2 Cu6 N9 O34.6 Yb -","- C39 H87 Cu6 N9 O34.6 Yb -","- C78 H174 Cu12 N18 O69.2 Yb2 -","2","0.166667","","George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios","Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids","Inorganic Chemistry","2012","51","","5911","5918","10.1021/ic300538q","","","0.71073","MoKα","","0.0894","0.0636","","","0.1548","0.1644","","","","","","1.235","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4331435","21.626","","21.626","","21.46","","90","","90","","120","","8691.86","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","H21 (B3 W39 O132) (H2 O)69","","- B3 O150 W39 -","- B3 O150 W39 -","- B6 O300 W78 -","2","0.166667","","Teze, A.; Herve, G.; Michelon, M.","Syntheses and structures of the tungstoborate anions","Inorganic Chemistry","1997","36","","505","509","10.1021/ic961051t","","","","","","","","","","","","","","","","","","","","","has coordinates","179417","2020-10-21","18:00:00",""
"4331445","7","","7","","7.46","","90","","90","","120","","316.567","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- B I3 -","- B I3 -","- B2 I6 -","2","0.166667","","Ring, M.A.; Koski, W.S.; Donnay, J.D.H.","The Crystal Structure of Boron Triiodide","Inorganic Chemistry","1962","1","","109","111","10.1021/ic50001a021","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4331448","7.73","","7.73","","18.853","","90","","90","","120","","975.596","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Li14 Be5 B (B O3)9","","- B10 Be5 Li14 O27 -","- B10.0002 Be4.9998 Li14 O27 -","- B20.0004 Be9.9996 Li28 O54 -","2","0.166667","","Luce, J.L.; Keszler, D.A.; Schaffers, K.I.","Structure of the borate Li14Be5B(BO3)9","Inorganic Chemistry","1994","33","","2453","2455","10.1021/ic00089a023","","","","","","","","","","","","","","","","","","","","","has coordinates","179417","2020-10-21","18:00:00",""
"4331484","4.8238","0.0005","4.8238","0.0005","15.472","0.003","90","","90","","120","","311.79","0.08","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Al2 B2 Ca0.69 Na0.64 O7 -","- Al2 B2 Ca0.693 Na0.638 O6.99 -","- Al4 B4 Ca1.386 Na1.276 O13.98 -","2","0.166667","","He, Meng; Okudera, Hiroki; Simon, Arndt","Ca1-xNa2xAl2B2O7: A Structure with Tunable Density of Na+Vacancies","Inorganic Chemistry","2005","44","12","4421","4426","10.1021/ic0500863","","","0.71073","MoKα","","0.0407","0.0345","","","0.0839","0.0867","","","","","","1.095","","","","has coordinates,has disorder","179417","2020-10-21","18:00:00",""
"4331485","4.8138","0.0007","4.8138","0.0007","15.301","0.003","90","","90","","120","","307.06","0.09","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Al2 B2 Ca0.05 Na1.9 O7 -","- Al2 B2 Ca0.051 Na1.906 O6.99 -","- Al4 B4 Ca0.102 Na3.812 O13.98 -","2","0.166667","","He, Meng; Okudera, Hiroki; Simon, Arndt","Ca1-xNa2xAl2B2O7: A Structure with Tunable Density of Na+Vacancies","Inorganic Chemistry","2005","44","12","4421","4426","10.1021/ic0500863","","","0.71073","MoKα","","0.0497","0.0419","","","0.1082","0.1125","","","","","","1.177","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4332695","14.2228","0.0008","14.2228","0.0008","25.594","0.003","90","","90","","120","","4483.7","0.6","173","2","173","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C63 H84 Cl N8 O P2 Rh Ta2 -","- C62.99 H84 Cl0.99 N8 O0.99 P2 Rh Ta2 -","- C125.98 H168 Cl1.98 N16 O1.98 P4 Rh2 Ta4 -","2","0.166667","","Han, Hua; Elsmaili, Mona; Johnson, Samuel A.","Diligating Tripodal Amido-Phosphine Ligands: the Effect of a Proximal Antipodal Early Transition Metal on Phosphine Donor Ability in a Building Block for Heterometallic Complexes","Inorganic Chemistry","2006","45","18","7435","7445","10.1021/ic060692d","","","0.71073","MoKα","","0.0561","0.0479","","","0.1181","0.1254","","","","","","1.17","","","","has coordinates","179429","2020-10-21","18:00:00",""
"4333200","14.7797","0.0003","14.7797","0.0003","25.3168","0.0009","90","","90","","120","","4789.3","0.2","150","1","150","1","","","","","","","","8","P 63/m","-P 6c","176","","","","- C74 H54 Co2 Cu6 I16 N12 O Pb3 -","- C73.98 H54.06 Co2 Cu6 I16 N12 O0.99 Pb3 -","- C147.96 H108.12 Co4 Cu12 I32 N24 O1.98 Pb6 -","2","0.166667","","Burns, Michael C.; Tershansy, Meredith A.; Ellsworth, Joseph M.; Khaliq, Zeeshan; Peterson, LeRoy; Smith, Mark D.; zur Loye, Hans-Conrad","Layered Heterometallic Iodoplumbate Containing a Novel Pb3Cu6I16Net: Structure and Optical Properties","Inorganic Chemistry","2006","45","26","10437","10439","10.1021/ic061827i","","","0.71073","MoKα","","0.0289","0.0246","","","0.0555","0.0569","","","","","","1.109","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333726","5.2013","0.0001","5.2013","0.0001","22.4066","0.0003","90","","90","","120","","524.965","0.016","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","potassiun manganese vanadate carbonate","Dipotassium trimanganese bivanadate carbonate","","- C K2 Mn3 O11 V2 -","- C K2 Mn3 O11 V2 -","- C2 K4 Mn6 O22 V4 -","2","0.166667","","Olga V. Yakubovich; Ekaterina V. Yakovleva; Alexey N. Golovanov; Anatoly S. Volkov; Olga S. Volkova; Elena A. Zvereva; Olga V. Dimitrova; Alexander N. Vasiliev","The First Vanadate-Carbonate, K2Mn3(VO4)2(CO3): Crystal Structure and Physical Properties","Inorganic Chemistry","2013","52","","1538","1543","10.1021/ic302333e","","","0.71073","MoKα","","0.0226","0.0222","","","0.0562","0.0563","","","","","","1.568","","","","has coordinates","179440","2020-10-21","18:00:00",""
"4334519","12.4547","0.0011","12.4547","","14.3765","0.0013","90","","90","","120","","1931.3","0.2","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","Pt3(mu-PBut2)3I3","","","- C24 H54 I3 P3 Pt3 -","- C24 H54 I3 P3 Pt3 -","- C48 H108 I6 P6 Pt6 -","2","0.166667","","Tiziana Funaioli; Piero Leoni; Lorella Marchetti; Alberto Albinati; Silvia Rizzato; Fabrizia Fabrizi de Biani; Andrea Ienco; Gabriele Manca; Carlo Mealli","Unprecedented Tris-Phosphido-Bridged Triangular Clusters with 42 Valence Electrons. Chemical, Electrochemical and Computational Studies of their Formation and Stability","Inorganic Chemistry","2013","52","","4635","4647","10.1021/ic400251y","","","0.71073","MoKα","","0.0212","0.0183","","","0.0409","0.0419","","","","","","1.048","","","","has coordinates","179448","2020-10-21","18:00:00",""
"4334520","11.9553","0.0008","11.9553","","14.656","0.001","90","","90","","120","","1814.12","0.17","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","Pt3(mu-PBut2)3Br3","","","- C24 H54 Br3 P3 Pt3 -","- C24 H54 Br3 P3 Pt3 -","- C48 H108 Br6 P6 Pt6 -","2","0.166667","","Tiziana Funaioli; Piero Leoni; Lorella Marchetti; Alberto Albinati; Silvia Rizzato; Fabrizia Fabrizi de Biani; Andrea Ienco; Gabriele Manca; Carlo Mealli","Unprecedented Tris-Phosphido-Bridged Triangular Clusters with 42 Valence Electrons. Chemical, Electrochemical and Computational Studies of their Formation and Stability","Inorganic Chemistry","2013","52","","4635","4647","10.1021/ic400251y","","","0.71073","MoKα","","0.0269","0.0207","","","0.0431","0.0452","","","","","","1.095","","","","has coordinates","179448","2020-10-21","18:00:00",""
"4334521","11.6624","0.0014","11.6624","","14.8688","0.0018","90","","90","","120","","1751.4","0.3","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","Pt3(mu-PBut2)3Cl3","","","- C24 H54 Cl3 P3 Pt3 -","- C24 H54 Cl3 P3 Pt3 -","- C48 H108 Cl6 P6 Pt6 -","2","0.166667","","Tiziana Funaioli; Piero Leoni; Lorella Marchetti; Alberto Albinati; Silvia Rizzato; Fabrizia Fabrizi de Biani; Andrea Ienco; Gabriele Manca; Carlo Mealli","Unprecedented Tris-Phosphido-Bridged Triangular Clusters with 42 Valence Electrons. Chemical, Electrochemical and Computational Studies of their Formation and Stability","Inorganic Chemistry","2013","52","","4635","4647","10.1021/ic400251y","","","0.71069","MoKα","","0.046","0.0384","","","0.0955","0.0988","","","","","","1.308","","","","has coordinates","179448","2020-10-21","18:00:00",""
"4336566","10.754","0.0015","10.754","0.0015","11.457","0.002","90","","90","","120","","1147.5","0.3","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Au10 Ga16 Na5 -","- Au10 Ga16 Na5 -","- Au20 Ga32 Na10 -","2","0.166667","","Volodymyr Smetana; Gordon J. Miller; John D. Corbett","Polyclusters and Substitution Effects in the Na-Au-Ga System: Remarkable Sodium Bonding Characteristics in Polar Intermetallics","Inorganic Chemistry","2013","52","","12502","12510","10.1021/ic401580y","","","0.71073","MoKα","","0.0533","0.0332","","","0.0551","0.0595","","","","","","1.016","","","","has coordinates","179468","2020-10-21","18:00:00",""
"4336651","10.9879","0.0004","10.9879","0.0004","14.3934","0.0006","90","","90","","120","","1504.95","0.1","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","Sodium neptunium(IV) neptunyl(V) hydroxide chrolide hydrate","","","- Cl9 H16.2 Na0.8 Np7 O21 -","- Cl9 Na0.75 Np7 O21 -","- Cl18 Na1.5 Np14 O42 -","2","0.166667","","Geng Bang Jin","Mixed-Valent Neptunium(IV/V) Compound with Cation-Cation-Bound Six-Membered Neptunyl Rings","Inorganic Chemistry","2013","52","","12317","12319","10.1021/ic4021492","","","0.71073","MoKα","","0.0471","0.0443","","","0.1404","0.1421","","","","","","1.063","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4337102","17.5075","0.0002","17.5075","0.0002","16.9453","0.0002","90","","90","","120","","4498.09","0.09","183.1","","183","2","","","","","","","","7","P 63/m","-P 6c","176","","Diiodo-(1,1'-dipentyl-3,3'-methylene-bis(benzimidazoline)-2,2'-diylidene) -platinum(II) dichloromethane and methanol solvate 3/1/1","","- C25.67 H34 Cl0.67 I2 N4 O0.33 Pt -","- C24.6666 H31.0002 Cl0.6666 I2 N4 O0.3333 Pt -","- C148 H186.001 Cl3.9996 I12 N24 O1.9998 Pt6 -","6","0.5","","Zhang, Yuzhen; Clavadetscher, Jessica; Bachmann, Michael; Blacque, Olivier; Venkatesan, Koushik","Tuning the Luminescent Properties of Pt(II) Acetylide Complexes through Varying the Electronic Properties of N-Heterocyclic Carbene Ligands.","Inorganic chemistry","2014","53","2","756","771","10.1021/ic401841n","","","0.7107","MoKα","","0.0467","0.0391","","","0.1024","0.1063","","","","","","1.12","","","","has coordinates,has disorder","179474","2020-10-21","18:00:00",""
"4338294","9.7272","0.0003","9.7272","0.0003","7.1816","0.0003","90","","90","","120","","588.47","0.04","293","","293","","","","","","","","","5","P 63/m","-P 6c","176","","","","- H0.625 La8.423 Na1.423 O25.884 Si6 -","- H0.624 La8.422 Na1.422 O25.884 Si6 -","- H0.624 La8.422 Na1.422 O25.884 Si6 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Keenan, Philip J.; Slater, Peter R.; Brink, Frank; Hester, James; An, Tao; White, Tim J.","Hydrothermal synthesis, structure investigation, and oxide ion conductivity of mixed si/ge-based apatite-type phases.","Inorganic chemistry","2014","53","10","4803","4812","10.1021/ic402370e","powder diffraction","neutron","1.622","Neutron","","0.0414","","","","","","","","1.69","","","","","","","has coordinates","179485","2020-10-21","18:00:00",""
"4338295","9.7332","0.0003","9.7332","0.0003","7.1863","0.0003","90","","90","","120","","589.59","0.04","293","","293","","","","","","","","","6","P 63/m","-P 6c","176","","","","- Ge0.181 H0.982 La8.395 Na1.535 O26.123 Si5.819 -","- Ge0.18 H0.98 La8.398 Na1.534 O26.124 Si5.82 -","- Ge0.18 H0.98 La8.398 Na1.534 O26.124 Si5.82 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Keenan, Philip J.; Slater, Peter R.; Brink, Frank; Hester, James; An, Tao; White, Tim J.","Hydrothermal synthesis, structure investigation, and oxide ion conductivity of mixed si/ge-based apatite-type phases.","Inorganic chemistry","2014","53","10","4803","4812","10.1021/ic402370e","powder diffraction","neutron","1.622","Neutron","","0.0419","","","","","","","","1.91","","","","","","","has coordinates","179485","2020-10-21","18:00:00",""
"4338296","9.7503","0.0002","9.7503","0.0002","7.1955","0.0002","90","","90","","120","","592.42","0.02","293","","293","","","","","","","","","6","P 63/m","-P 6c","176","","","","- Ge0.56 H0.626 La8.587 Na1.231 O25.71 Si5.44 -","- Ge0.558 H0.628 La8.59 Na1.23 O25.708 Si5.442 -","- Ge0.558 H0.628 La8.59 Na1.23 O25.708 Si5.442 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Keenan, Philip J.; Slater, Peter R.; Brink, Frank; Hester, James; An, Tao; White, Tim J.","Hydrothermal synthesis, structure investigation, and oxide ion conductivity of mixed si/ge-based apatite-type phases.","Inorganic chemistry","2014","53","10","4803","4812","10.1021/ic402370e","powder diffraction","neutron","1.622","Neutron","","0.0439","","","","","","","","1.86","","","","","","","has coordinates","179485","2020-10-21","18:00:00",""
"4338297","9.7912","0.0003","9.7912","0.0003","7.2058","0.0002","90","","90","","120","","598.25","0.03","293","","293","","","","","","","","","6","P 63/m","-P 6c","176","","","","- Ge1.303 H0.438 La8.403 Na1.307 O25.583 Si4.697 -","- Ge1.302 H0.436 La8.406 Na1.306 O25.584 Si4.698 -","- Ge1.302 H0.436 La8.406 Na1.306 O25.584 Si4.698 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Keenan, Philip J.; Slater, Peter R.; Brink, Frank; Hester, James; An, Tao; White, Tim J.","Hydrothermal synthesis, structure investigation, and oxide ion conductivity of mixed si/ge-based apatite-type phases.","Inorganic chemistry","2014","53","10","4803","4812","10.1021/ic402370e","powder diffraction","neutron","1.622","Neutron","","0.039","","","","","","","","1.68","","","","","","","has coordinates","179485","2020-10-21","18:00:00",""
"4338298","9.8442","0.0004","9.8442","0.0004","7.2185","0.0002","90","","90","","120","","605.81","0.04","293","","293","","","","","","","","","6","P 63/m","-P 6c","176","","","","- Ge3.129 H0.428 La8.581 Na1.168 O25.615 Si2.871 -","- Ge3.126 H0.428 La8.578 Na1.166 O25.616 Si2.874 -","- Ge3.126 H0.428 La8.578 Na1.166 O25.616 Si2.874 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Keenan, Philip J.; Slater, Peter R.; Brink, Frank; Hester, James; An, Tao; White, Tim J.","Hydrothermal synthesis, structure investigation, and oxide ion conductivity of mixed si/ge-based apatite-type phases.","Inorganic chemistry","2014","53","10","4803","4812","10.1021/ic402370e","powder diffraction","neutron","1.622","Neutron","","0.0474","","","","","","","","1.82","","","","","","","has coordinates","179485","2020-10-21","18:00:00",""
"4338299","9.8973","0.0003","9.8973","0.0003","7.2309","0.0002","90","","90","","120","","613.42","0.03","293","","293","","","","","","","","","6","P 63/m","-P 6c","176","","","","- Ge4.488 H0.958 La8.463 Na1.174 O26.021 Si1.512 -","- Ge4.488 H0.96 La8.462 Na1.178 O26.02 Si1.512 -","- Ge4.488 H0.96 La8.462 Na1.178 O26.02 Si1.512 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Keenan, Philip J.; Slater, Peter R.; Brink, Frank; Hester, James; An, Tao; White, Tim J.","Hydrothermal synthesis, structure investigation, and oxide ion conductivity of mixed si/ge-based apatite-type phases.","Inorganic chemistry","2014","53","10","4803","4812","10.1021/ic402370e","powder diffraction","neutron","1.622","Neutron","","0.0397","","","","","","","","1.72","","","","","","","has coordinates","179485","2020-10-21","18:00:00",""
"4338300","9.9451","0.0002","9.9451","0.0002","7.2431","0.0002","90","","90","","120","","620.4","0.02","293","","293","","","","","","","","","6","P 63/m","-P 6c","176","","","","- Ge5.239 H1.063 La8.634 Na1.19 O25.877 Si0.761 -","- Ge5.238 H1.064 La8.632 Na1.192 O25.876 Si0.762 -","- Ge5.238 H1.064 La8.632 Na1.192 O25.876 Si0.762 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Keenan, Philip J.; Slater, Peter R.; Brink, Frank; Hester, James; An, Tao; White, Tim J.","Hydrothermal synthesis, structure investigation, and oxide ion conductivity of mixed si/ge-based apatite-type phases.","Inorganic chemistry","2014","53","10","4803","4812","10.1021/ic402370e","powder diffraction","neutron","1.622","Neutron","","0.0426","","","","","","","","1.96","","","","","","","has coordinates","179486","2020-10-21","18:00:00",""
"4339977","21.3259","0.0014","21.3259","0.0014","14.1254","0.0009","90","","90","","120","","5563.5","0.6","293","","293","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Au0.987 Cd4.07 -","- Au0.986667 Cd4.06989 -","- Au53.28 Cd219.774 -","54","4.5","","Jana, Partha P.; Lidin, Sven","AuCd4: A Hume-Rothery Phase with VEC of 1.8 and Icosahedral and Trigonal-Prismatic Clusters as Building Blocks.","Inorganic chemistry","2015","54","3","713","721","10.1021/ic500616t","","x-ray","0.7107","MoKα","","0.0982","0.0435","","","0.0769","0.098","","","","1.14","1.14","1.09","","","","has coordinates","288070","2023-12-06","12:53:07",""
"4339978","21.34","0.003","21.34","0.003","14.1212","0.0017","90","","90","","120","","5569.2","1.3","293","","293","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Au0.975 Cd4.088 -","- Au0.975667 Cd4.08685 -","- Au52.686 Cd220.69 -","54","4.5","","Jana, Partha P.; Lidin, Sven","AuCd4: A Hume-Rothery Phase with VEC of 1.8 and Icosahedral and Trigonal-Prismatic Clusters as Building Blocks.","Inorganic chemistry","2015","54","3","713","721","10.1021/ic500616t","","x-ray","0.7107","MoKα","","0.0874","0.0379","","","0.0651","0.0829","","","","1.12","1.12","1.09","","","","has coordinates","288070","2023-12-06","12:53:34",""
"4340870","9.5812","0.0003","9.5812","0.0003","7.0655","0.0005","90","","90","","120","","561.71","0.05","100","","100","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Nd7.977 O26 Si6 Sr2.023 -","- Nd7.96 O26 Si6 Sr2.04 -","- Nd7.96 O26 Si6 Sr2.04 -","1","0.0833333","","An, Tao; Orera, Alodia; Baikie, Tom; Herrin, Jason S.; Piltz, Ross O.; Slater, Peter R.; White, Tim J.; Sanjuán, María L","Structural Study of the Apatite Nd8Sr2Si6O26 by Laue Neutron Diffraction and Single-Crystal Raman Spectroscopy.","Inorganic chemistry","2014","53","17","9416","9423","10.1021/ic501558r","","neutron","0.71069","neutron","","0.0567","0.03","","","0.0323","0.0344","","","","1.61","1.61","1.48","","","","has coordinates","179511","2020-10-21","18:00:00",""
"4341262","33.7242","0.0012","33.7242","0.0012","17.3577","0.0006","90","","90","","120","","17096.5","1","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- Cl0.6 H126.53 Hf18 O137.07 S12.7 -","- Cl0.6 Hf18 O137.067 S12.7 -","- Cl3.6 Hf108 O822.4 S76.2 -","6","0.5","","Kalaji, Ali; Soderholm, L.","Aqueous hafnium sulfate chemistry: structures of crystalline precipitates.","Inorganic chemistry","2014","53","20","11252","11260","10.1021/ic501841e","","","0.71073","MoKα","","0.0338","0.0263","","","0.0614","0.0643","","","","","","1.041","","","","has coordinates,has disorder","179515","2020-10-21","18:00:00",""
"4341263","34.763","0.002","34.763","0.002","18.7107","0.0013","90","","90","","120","","19582","2","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- H116.92 Hf18.12 N5.64 O134.26 S15.88 -","- Hf18.12 N5.64 O134.26 S15.88 -","- Hf108.72 N33.84 O805.56 S95.28 -","6","0.5","","Kalaji, Ali; Soderholm, L.","Aqueous hafnium sulfate chemistry: structures of crystalline precipitates.","Inorganic chemistry","2014","53","20","11252","11260","10.1021/ic501841e","","","0.71073","MoKα","","0.0537","0.0439","","","0.108","0.1149","","","","","","1.119","","","","has coordinates,has disorder","179515","2020-10-21","18:00:00",""
"4342309","13.1973","0.0009","13.1973","0.0009","22.4007","0.0015","90","","90","","120","","3378.8","0.4","90","2","90","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C75 H84 Sn5 -","- C75 H84 Sn5 -","- C150 H168 Sn10 -","2","0.166667","","Erickson, Jeremy D.; Fettinger, James C.; Power, Philip P.","Reaction of a germylene, stannylene, or plumbylene with trimethylaluminum and trimethylgallium: insertion into Al-C or ga-C bonds, a reversible metal-carbon insertion equilibrium, and a new route to diplumbenes.","Inorganic chemistry","2015","54","4","1940","1948","10.1021/ic502824w","","","0.71073","MoKα","","0.0275","0.0237","","","0.0635","0.0678","","","","","","1.112","","","","has coordinates","179526","2020-10-21","18:00:00",""
"4342989","19.003","0.005","19.003","","16.916","0.005","90","","90","","120","","5290","2","200","2","200","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C73 H99 Br Cu6 N32 -","- C73 H98.94 Br Cu6 N32 -","- C146 H197.88 Br2 Cu12 N64 -","2","0.166667","","Xu, Zhenghu; Han, Lu Lu; Zhuang, Gui Lin; Bai, Jing; Sun, Di","In situ construction of three anion-dependent cu(i) coordination networks as promising heterogeneous catalysts for azide-alkyne ""click"" reactions.","Inorganic chemistry","2015","54","10","4737","4743","10.1021/acs.inorgchem.5b00110","","","0.71073","MoKα","","0.1156","0.0634","","","0.1565","0.1756","","","","","","0.983","","","","has coordinates","138127","2020-10-21","18:00:00",""
"4343124","23.3919","0.0006","23.3919","0.0006","61.397","0.0019","90","","90","","120","","29094.4","1.4","100","2","100","2","","","","","","","","9","P 63/m","-P 6c","176","","","","- C286 H360 Cl4 Dy4 N8 Na4 Ni24 O72 S24 -","- C285.84 H299.76 Cl4.02 Dy3.98 N12 Ni24 O67.94 S24 -","- C571.68 H599.52 Cl8.04 Dy7.96 N24 Ni48 O135.88 S48 -","2","0.166667","","Su, Kongzhao; Jiang, Feilong; Qian, Jinjie; Chen, Lian; Pang, Jiandong; Bawaked, Salem M.; Mokhtar, Mohamed; Al-Thabaiti, Shaeel A; Hong, Maochun","Stepwise construction of extra-large heterometallic calixarene-based cages.","Inorganic chemistry","2015","54","7","3183","3188","10.1021/ic502677g","","","1.54184","CuKα","","0.1296","0.0866","","","0.2288","0.2526","","","","","","0.968","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4343125","23.5399","0.0002","23.5399","0.0002","65.794","0.0004","90","","90","","120","","31573.7","0.4","100","2","100","2","","","","","","","","9","P 63/m","-P 6c","176","","","","- C298 H366 Cl4 Dy4 N8 Na4 Ni24 O72 S24 -","- C297.84 H287.76 Cl3.96 Dy3.98 N12 Ni24 O67.94 S24 -","- C595.68 H575.52 Cl7.92 Dy7.96 N24 Ni48 O135.88 S48 -","2","0.166667","","Su, Kongzhao; Jiang, Feilong; Qian, Jinjie; Chen, Lian; Pang, Jiandong; Bawaked, Salem M.; Mokhtar, Mohamed; Al-Thabaiti, Shaeel A; Hong, Maochun","Stepwise construction of extra-large heterometallic calixarene-based cages.","Inorganic chemistry","2015","54","7","3183","3188","10.1021/ic502677g","","","1.54184","CuKα","","0.1046","0.088","","","0.2445","0.2571","","","","","","1.093","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4343126","23.4172","0.0001","23.4172","0.0001","70.1696","0.0003","90","","90","","120","","33323.4","0.2","100","2","100","2","","","","","","","","9","P 63/m","-P 6c","176","","","","- C304 H366 Cl4 Dy4 N8 Na4 Ni24 O74 S24 -","- C303.84 H299.88 Cl3.96 Dy3.98 N12 Ni24 O69.92 S24 -","- C607.68 H599.76 Cl7.92 Dy7.96 N24 Ni48 O139.84 S48 -","2","0.166667","","Su, Kongzhao; Jiang, Feilong; Qian, Jinjie; Chen, Lian; Pang, Jiandong; Bawaked, Salem M.; Mokhtar, Mohamed; Al-Thabaiti, Shaeel A; Hong, Maochun","Stepwise construction of extra-large heterometallic calixarene-based cages.","Inorganic chemistry","2015","54","7","3183","3188","10.1021/ic502677g","","","1.54184","CuKα","","0.0839","0.0766","","","0.2157","0.2235","","","","","","1.094","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4343127","23.3568","0.0002","23.3568","0.0002","69.7927","0.0006","90","","90","","120","","32973.7","0.5","100","2","100","2","","","","","","","","9","P 63/m","-P 6c","176","","","","- C298 H366 Cl4 Dy4 N14 Na4 Ni24 O72 S24 -","- C297.84 H275.88 Cl3.96 Dy3.98 N18 Ni24 O67.94 S24 -","- C595.68 H551.76 Cl7.92 Dy7.96 N36 Ni48 O135.88 S48 -","2","0.166667","","Su, Kongzhao; Jiang, Feilong; Qian, Jinjie; Chen, Lian; Pang, Jiandong; Bawaked, Salem M.; Mokhtar, Mohamed; Al-Thabaiti, Shaeel A; Hong, Maochun","Stepwise construction of extra-large heterometallic calixarene-based cages.","Inorganic chemistry","2015","54","7","3183","3188","10.1021/ic502677g","","","1.54184","CuKα","","0.0953","0.0881","","","0.2328","0.2388","","","","","","1.029","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4343128","23.3815","0.0002","23.3815","0.0002","61.3635","0.0007","90","","90","","120","","29052.6","0.5","100","2","100","2","","","","","","","","9","P 63/m","-P 6c","176","","","","- C286 H360 Cl4 N8 Na4 Ni24 O72 S24 Tb4 -","- C285.84 H258 Cl3.96 N12 Ni24 O67.94 S24 Tb3.98 -","- C571.68 H516 Cl7.92 N24 Ni48 O135.88 S48 Tb7.96 -","2","0.166667","","Su, Kongzhao; Jiang, Feilong; Qian, Jinjie; Chen, Lian; Pang, Jiandong; Bawaked, Salem M.; Mokhtar, Mohamed; Al-Thabaiti, Shaeel A; Hong, Maochun","Stepwise construction of extra-large heterometallic calixarene-based cages.","Inorganic chemistry","2015","54","7","3183","3188","10.1021/ic502677g","","","1.54184","CuKα","","0.1024","0.0825","","","0.2304","0.2458","","","","","","1.08","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4344053","9.8117","0.0014","9.8117","0.0014","19.286","0.006","90","","90","","120","","1607.9","0.6","298","2","298","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- Ba3 Cl La6 N29 O2 Si17 -","- Ba3 Cl La6 N29 O2 Si17 -","- Ba6 Cl2 La12 N58 O4 Si34 -","2","0.166667","","Durach, Dajana; Fahrnbauer, Felix; Oeckler, Oliver; Schnick, Wolfgang","La6Ba3[Si17N29O2]Cl-An Oxonitridosilicate Chloride with Exceptional Structural Motifs.","Inorganic chemistry","2015","54","17","8727","8732","10.1021/acs.inorgchem.5b01368","","","0.3351","","","0.0171","0.0169","","","0.0396","0.0397","","","","","","1.302","","","","has coordinates","160508","2020-10-21","18:00:00",""
"4344108","7.392","","7.392","","13.871","","90","","90","","120","","656.391","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","Ce K (Fe (C N)6) (H2 O)4","","- C6 H8 Ce Fe K N6 O4 -","- C6 Ce Fe K N6 O4 -","- C12 Ce2 Fe2 K2 N12 O8 -","2","0.166667","","Mullica, D.F.; Milligan, W.O.; Oliver, J.D.","Refined structure of Ce K Fe C N6 H2 O4","Inorganic and Nuclear Chemistry Letters","1979","15","","1","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344255","7.358","","7.358","","13.78","","90","","90","","120","","646.1","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","Nd K (Fe (C N)6) (H2 O)4","","- C6 H8 Fe K N6 Nd O4 -","- C6 Fe K0.98 N6 Nd O3.98 -","- C12 Fe2 K1.96 N12 Nd2 O7.96 -","2","0.166667","","Milligan, W.O.; Perkins, H.O.; Mullica, D.F.","The structural analysis of Nd K Fe (CN)6 * 4(H2 O)","Inorganic and Nuclear Chemistry Letters","1979","15","","1","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344294","13.89","","13.89","","10.692","","90","","90","","120","","1786.46","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Bi10 (Hf Cl6)3","","- Bi10 Cl18 Hf3 -","- Bi10 Cl18 Hf3 -","- Bi20 Cl36 Hf6 -","2","0.166667","","Friedman, R.M.; Corbett, J.D.","Synthesis and Structural Characterization of Bismuth(1+) Nonabismuth(5+) Hexachlorohafnate(IV), Bi Bi9 (Hf Cl6)3","Inorganic Chemistry","1973","12","","1134","1139","","","","","","","","","","","","","","","","","","","","","","has coordinates","165392","2020-10-21","18:00:00",""
"4345115","9.3309","0.0003","9.3309","0.0003","21.546","0.0009","90","","90","","120","","1624.59","0.1","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","Guanidinium Tin Iodide","","","- C H6 I3 N3 Sn -","- C H6 I3 N3 Sn -","- C6 H36 I18 N18 Sn6 -","6","0.5","","Stoumpos, Constantinos C.; Mao, Lingling; Malliakas, Christos D.; Kanatzidis, Mercouri G.","Structure-Band Gap Relationships in Hexagonal Polytypes and Low-Dimensional Structures of Hybrid Tin Iodide Perovskites.","Inorganic chemistry","2017","56","1","56","73","10.1021/acs.inorgchem.6b02764","","","0.71073","MoKα","","0.0511","0.047","","","0.1126","0.1149","","","","","","1.181","","","","has coordinates","191262","2020-10-21","18:00:00",""
"4345330","13.1624","0.0019","13.1624","0.0019","8.3592","0.0017","90","","90","","120","","1254.2","0.4","100","","100","","","","","","","","","5","P 63/m","-P 6c","176","Lanthanum-pentafluoroethyltricyanoborate","Tris(pentafluoroethyltri(cyano-κC))borat-κN-lanthanum","","- C15 B3 F15 La N9 -","- C15 B3 F15 La N9 -","- C30 B6 F30 La2 N18 -","2","0.166667","","Ribbeck, Tatjana; Zottnick, Sven H.; Kerpen, Christoph; Landmann, Johannes; Ignat'ev, Nikolai V.; Müller-Buschbaum, Klaus; Finze, Maik","Anhydrous, Homoleptic Lanthanide Frameworks with the Pentafluoroethyltricyanoborate Anion.","Inorganic chemistry","2017","56","4","2278","2286","10.1021/acs.inorgchem.6b02984","","","0.71073","MoKα","","0.0223","0.0199","","","0.0527","0.0542","","","","","","1.068","","","","has coordinates","192890","2020-10-21","18:00:00",""
"4345404","9.7563","0.0003","9.7563","0.0003","7.3053","0.0002","90","","90","","120","","602.2","0.03","293","","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Co0.18 O12.92 P3 Sr5 -","- Co0.18 O12.92 P3 Sr5 -","- Co0.36 O25.84 P6 Sr10 -","2","0.166667","","Kazin, Pavel E.; Zykin, Mikhail A.; Schnelle, Walter; Zubavichus, Yan V.; Babeshkin, Konstantin A.; Tafeenko, Victor A.; Felser, Claudia; Jansen, Martin","Cobalt-Based Single-Ion Magnets on an Apatite Lattice: Toward Patterned Arrays for Magnetic Memories.","Inorganic chemistry","2017","56","3","1232","1240","10.1021/acs.inorgchem.6b02348","","","1.54186","CuKα","","0.0461","0.0447","","","0.0619","0.0628","","","","2.77","2.77","2.76","","","","has coordinates","192963","2020-10-21","18:00:00",""
"4346777","19.5284","0.0013","19.5284","0.0013","28.677","0.002","90","","90","","120","","9471","1.1","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C185 H230 Ca2 Mn6 N10 O39 -","- C185 H199.98 Ca2 Mn6 N10 O39 -","- C370 H399.96 Ca4 Mn12 N20 O78 -","2","0.166667","","Escriche-Tur, Luis; Jover, Jesús; Font-Bardia, Mercè; Aullón, Gabriel; Corbella, Montserrat","Magnetic Behavior of Heterometallic Wheels Having a [Mn(IV)6M2O9](10+) Core with M = Ca(2+) and Sr(2+).","Inorganic chemistry","2015","54","24","11596","11605","10.1021/acs.inorgchem.5b02131","","","0.71073","MoKα","","0.0752","0.0545","","","0.133","0.1556","","","","","","1.092","","","","has coordinates","231976","2020-10-21","18:00:00",""
"4346778","19.6062","0.0006","19.6062","0.0006","28.9147","0.001","90","","90","","120","","9625.8","0.5","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C185 H230 Mn6 N10 O39 Sr2 -","- C185 H199.98 Mn6 N10 O39 Sr2 -","- C370 H399.96 Mn12 N20 O78 Sr4 -","2","0.166667","","Escriche-Tur, Luis; Jover, Jesús; Font-Bardia, Mercè; Aullón, Gabriel; Corbella, Montserrat","Magnetic Behavior of Heterometallic Wheels Having a [Mn(IV)6M2O9](10+) Core with M = Ca(2+) and Sr(2+).","Inorganic chemistry","2015","54","24","11596","11605","10.1021/acs.inorgchem.5b02131","","","0.71073","MoKα","","0.1037","0.0724","","","0.1948","0.2184","","","","","","1.041","","","","has coordinates","231976","2020-10-21","18:00:00",""
"4346979","21.2928","0.0008","21.2928","0.0008","25.9195","0.0009","90","","90","","120","","10177.1","0.6","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C144 H242 N36 O82 Pd3 -","- C144 H114 N36 O18 Pd3 -","- C288 H228 N72 O36 Pd6 -","2","0.166667","","Samanta, Dipak; Chowdhury, Aniket; Mukherjee, Partha Sarathi","Covalent Postassembly Modification and Water Adsorption of Pd3 Self-Assembled Trinuclear Barrels.","Inorganic chemistry","2016","55","4","1562","1568","10.1021/acs.inorgchem.5b02464","","","0.71073","MoKα","","0.1293","0.1066","","","0.3301","0.3464","","","","","","1.372","","","","has coordinates","232086","2020-10-21","18:00:00",""
"4347866","5.25963","0.00015","5.25963","0.00015","6.67042","0.00019","90","","90","","120","","159.806","0.008","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","Ytterbium(II)guanidinate","","","- C H3 N3 Yb -","- C H3 N3 Yb -","- C2 H6 N6 Yb2 -","2","0.166667","","Görne, Arno L; George, Janine; van Leusen, Jan; Dück, Gerald; Jacobs, Philipp; Chogondahalli Muniraju, Naveen Kumar; Dronskowski, Richard","Ammonothermal Synthesis, Crystal Structure, and Properties of the Ytterbium(II) and Ytterbium(III) Amides and the First Two Rare-Earth-Metal Guanidinates, YbC(NH)3 and Yb(CN3H4)3.","Inorganic chemistry","2016","55","12","6161","6168","10.1021/acs.inorgchem.6b00736","powder diffraction","x-ray","1.5406","CuKα1","","0.0554","0.0554","","0.096","0.096","","","","7.64","","","","","","","has coordinates","232548","2020-10-21","18:00:00",""
"4348124","25.56","0.007","25.56","0.007","39.513","0.005","90","","90","","120","","22356","9","123","","123","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C852 H72 B2 Cl2 N12 S12 -","- C851.536 H72 B2 Cl2 N12 S12 -","- C1703.07 H144 B4 Cl4 N24 S24 -","2","0.166667","","Rhoda, Hannah M.; Kayser, Mathew P.; Wang, Yefeng; Nazarenko, Alexander Y.; Belosludov, Rodion V.; Kiprof, Paul; Blank, David A.; Nemykin, Victor N.","Tuning Up an Electronic Structure of the Subphthalocyanine Derivatives toward Electron-Transfer Process in Noncovalent Complexes with C<sub>60</sub> and C<sub>70</sub> Fullerenes: Experimental and Theoretical Studies.","Inorganic chemistry","2016","55","19","9549","9563","10.1021/acs.inorgchem.6b00992","","","0.71073","MoKα","","0.2626","0.199","","","0.5096","0.548","","","","","","2.035","","","","has coordinates,has disorder","232770","2020-10-21","18:00:00",""
"4348372","9.798","0.003","9.798","0.003","7.953","0.003","90","","90","","120","","661.2","0.4","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C4 H12 I3 N Pb -","- C3 H9 I3 N Pb -","- C6 H18 I6 N2 Pb2 -","2","0.166667","","Liu, Guangfeng; Liu, Jie; Sun, Zhihua; Zhang, Zhenyi; Chang, Lei; Wang, Junling; Tao, Xutang; Zhang, Qichun","Thermally Induced Reversible Double Phase Transitions in an Organic-Inorganic Hybrid Iodoplumbate C4H12NPbI3 with Symmetry Breaking.","Inorganic chemistry","2016","55","16","8025","8030","10.1021/acs.inorgchem.6b01143","","","0.71073","MoKα","","0.031","0.0304","","","0.078","0.0787","","","","","","0.943","","","","has coordinates,has disorder","232892","2020-10-21","18:00:00",""
"4348670","18.1136","0.001","18.1136","0.001","47.919","0.002","90","","90","","120","","13615.9","1.2","250","2","250","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C162 H138 Cl8 Fe9 N60 O66 -","- C162 H138 Cl8 Fe9 N60 O66 -","- C324 H276 Cl16 Fe18 N120 O132 -","2","0.166667","","Abhervé, Alexandre; Recio-Carretero, María José; López-Jordà, Maurici; Clemente-Juan, Juan Modesto; Canet-Ferrer, Josep; Cantarero, Andrés; Clemente-León, Miguel; Coronado, Eugenio","Nonanuclear Spin-Crossover Complex Containing Iron(II) and Iron(III) Based on a 2,6-Bis(pyrazol-1-yl)pyridine Ligand Functionalized with a Carboxylate Group.","Inorganic chemistry","2016","55","18","9361","9367","10.1021/acs.inorgchem.6b01508","","","0.71073","MoKα","","0.182","0.0891","","","0.2543","0.3268","","","","","","0.929","","","","has coordinates","233247","2020-10-21","18:00:00",""
"4348671","18.1644","0.0006","18.1644","0.0006","48.1237","0.001","90","","90","","120","","13750.9","0.7","120","2","120","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C162 H138 Cl8 Fe9 N60 O66 -","- C162 H138 Cl8 Fe9 N60 O66 -","- C324 H276 Cl16 Fe18 N120 O132 -","2","0.166667","","Abhervé, Alexandre; Recio-Carretero, María José; López-Jordà, Maurici; Clemente-Juan, Juan Modesto; Canet-Ferrer, Josep; Cantarero, Andrés; Clemente-León, Miguel; Coronado, Eugenio","Nonanuclear Spin-Crossover Complex Containing Iron(II) and Iron(III) Based on a 2,6-Bis(pyrazol-1-yl)pyridine Ligand Functionalized with a Carboxylate Group.","Inorganic chemistry","2016","55","18","9361","9367","10.1021/acs.inorgchem.6b01508","","","0.71073","MoKα","","0.1382","0.0672","","","0.2067","0.2664","","","","","","0.833","","","","has coordinates","233249","2020-10-21","18:00:00",""
"4349122","13.368","0.0001","13.368","0.0001","19.0237","0.0002","90","","90","","120","","2944.14","0.04","90","2","90","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C62 H50 Cl Fe3 N4 O17 -","- C61.9998 H49.9998 Cl1.0002 Fe3 N4.0002 O17.0008 -","- C124 H99.9996 Cl2.0004 Fe6 N8.0004 O34.0016 -","2","0.166667","","Georgopoulou, Anastasia N.; Margiolaki, Irene; Psycharis, Vassilis; Boudalis, Athanassios K.","Dynamic versus Static Character of the Magnetic Jahn-Teller Effect: Magnetostructural Studies of [Fe<sub>3</sub>O(O<sub>2</sub>CPh)<sub>6</sub>(py)<sub>3</sub>]ClO<sub>4</sub>·py.","Inorganic chemistry","2017","56","2","762","772","10.1021/acs.inorgchem.6b01912","","","0.7","synchrotron","","0.0285","0.0269","","","0.0759","0.0783","","","","","","1.041","","","","has coordinates,has disorder","233603","2020-10-21","18:00:00",""
"4349636","20.034","0.005","20.034","0.005","30.459","0.005","90","0.005","90","0.005","120","0.005","10587","4","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C66 H18 N21 O24 Zn8 -","- C66 H18 N21 O24 Zn8 -","- C132 H36 N42 O48 Zn16 -","2","0.166667","","Xie, Wei; Qin, Jun-Sheng; He, Wen-Wen; Shao, Kui-Zhan; Su, Zhong-Min; Du, Dong-Ying; Li, Shun-Li; Lan, Ya-Qian","Encapsulation of an iridium complex in a metal‒organic framework to give a composite with efficient white light emission","Inorganic Chemistry Frontiers","2017","4","3","547","","10.1039/C6QI00528D","","","0.71069","MoKα","","0.1871","0.103","","","0.2483","0.2822","","","","","","0.976","","","","has coordinates,has disorder","234932","2020-10-21","18:00:00",""
"4349837","26.6695","0.0005","26.6695","0.0005","21.9235","0.0005","90","","90","","120","","13504.2","0.5","150","2","150","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C180 H287 Cl3 Co14 N62 O43 S12 -","- C165 H159 Cl3 Co14 N57 O38 S12 -","- C330 H318 Cl6 Co28 N114 O76 S24 -","2","0.166667","","Shi, Cheng; Chen, Mengwei; Han, Xu; Bi, Yanfeng; Huang, Liangliang; Zhou, Kun; Zheng, Zhiping","Thiacalix[4]arene-supported tetradecanuclear cobalt nanocage cluster as precursor to synthesize CoO/Co9S8@CN composite for supercapacitor application","Inorganic Chemistry Frontiers","2018","5","6","1329","","10.1039/C8QI00178B","","","0.71073","MoKα","","0.0978","0.0745","","","0.2122","0.2467","","","","","","1.069","","","","has coordinates,has disorder","236885","2020-10-21","18:00:00",""
"4500728","15.901","0.003","15.901","0.003","35.553","0.014","90","","90","","120","","7785","4","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C145 H137 Br6 Cl3 O35 Sn6 -","- C145 H138 Br6 Cl3 O34.98 Sn6 -","- C290 H276 Br12 Cl6 O69.96 Sn12 -","2","0.166667","","Chandrasekhar, V.; Thilagar, P.; Steiner, A.","Guest-Assisted Self-assembly of Organostannoxane Nanotubules on a Mica Surface","Crystal Growth & Design","2011","11","5","1446","","10.1021/cg2001927","","","0.71073","MoKα","","0.0692","0.0436","","","0.1046","0.1175","","","","","","1.013","","","","has coordinates,has disorder","179538","2020-10-21","18:00:00",""
"4501398","19.869","0.003","19.869","0.003","27.47","0.007","90","","90","","120","","9392","3","273","2","273","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C81 H99 N0 O62 Pr6 -","- C81 H99 O62 Pr6 -","- C162 H198 O124 Pr12 -","2","0.166667","","Dai, Fangna; Sun, Di; Sun, Daofeng","Three 3D Lanthanide‒Organic Frameworks Based on Novel Flexible Multicarboxylates: From ssa to rtl Topologies","Crystal Growth & Design","2011","11","12","5670","","10.1021/cg201210p","","","0.71073","MoKα","","0.1238","0.0738","","","0.2135","0.2368","","","","","","0.957","","","","has coordinates","179544","2020-10-21","18:00:00",""
"4503695","11.4833","0.0003","11.4833","0.0003","31.0746","0.0011","90","","90","","120","","3548.7","0.18","153","2","153","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C36 H100 N8 O38 P6 -","- C36 H99.96 N8 O38.02 P6 -","- C72 H199.92 N16 O76.04 P12 -","2","0.166667","","Li, Yu; Jiang, Long; Feng, Xiao-Long; Lu, Tong-Bu","Anion Dependent Water Clusters Encapsulated Inside a Cryptand Cavity","Crystal Growth & Design","2008","8","10","3689","","10.1021/cg800292e","","","1.54184","CuKα","","0.1057","0.0987","","","0.2602","0.2732","","","","","","1.215","","","","has coordinates,has disorder","179571","2020-10-21","18:00:00",""
"4503721","16.936","0.005","16.936","0.005","15.65","0.005","90","","90","","120","","3887","2","298","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C90 H94 O23 -","- C90 H84 O23 -","- C180 H168 O46 -","2","0.166667","","Tedesco, Consiglia; Gregoli, Luisa; Immediata, Ivano; Gavuzzo, Enrico; Neri, Placido","Molecular Assembly of Distalp-H-Calix[4]dihydroquinone Units","Crystal Growth & Design","2008","8","10","3700","","10.1021/cg800320e","","","1.5418","CuKα","","0.0921","0.051","","","0.141","0.1649","","","","","","1.05","","","","has coordinates","179572","2020-10-21","18:00:00",""
"4506089","13.6046","0.0002","13.6046","0.0002","18.3638","0.0006","90","","90","","120","","2943.5","0.11","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 Cd4 Gd2 N12 O14 -","- C120 H91.98 Cd4 Gd2 N12 O13.98 -","- C120 H91.98 Cd4 Gd2 N12 O13.98 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.0836","0.0565","","","0.1529","0.168","","","","","","1.057","","","","has coordinates","179596","2020-10-21","18:00:00",""
"4506090","13.3921","0.0002","13.3921","0.0002","18.379","0.0005","90","","90","","120","","2854.63","0.1","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 Co4 Dy2 N12 O14 -","- C120 H85.98 Co4 Dy2 N12 O13.98 -","- C120 H85.98 Co4 Dy2 N12 O13.98 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.0457","0.0398","","","0.1048","0.109","","","","","","1.105","","","","has coordinates","179596","2020-10-21","18:00:00",""
"4506091","13.3242","0.0004","13.3242","0.0004","18.4954","0.0011","90","","90","","120","","2843.7","0.2","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 Dy2 Fe4 N12 O14 -","- C120 H90 Dy2 Fe4 N12 O13.98 -","- C120 H90 Dy2 Fe4 N12 O13.98 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.1307","0.1191","","","0.2301","0.2344","","","","","","1.125","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4506092","13.3193","0.0019","13.3193","0.0019","18.649","0.005","90","","90","","120","","2865.2","1","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 Eu2 N12 O14 Zn4 -","- C120 H91.98 Eu2 N12 O13.98 Zn4 -","- C120 H91.98 Eu2 N12 O13.98 Zn4 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.2148","0.1493","","","0.3995","0.4369","","","","","","1.388","","","","has coordinates","179596","2020-10-21","18:00:00",""
"4506093","13.6227","0.0003","13.6227","0.0003","18.3213","0.0009","90","","90","","120","","2944.51","0.17","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 Cd4 Eu2 N12 O14 -","- C120 H85.98 Cd4 Eu2 N12 O13.98 -","- C120 H85.98 Cd4 Eu2 N12 O13.98 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.0378","0.0339","","","0.0883","0.0919","","","","","","1.049","","","","has coordinates","179596","2020-10-21","18:00:00",""
"4506094","13.4072","0.0002","13.4072","0.0002","18.3357","0.0007","90","","90","","120","","2854.33","0.12","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 Co4 Eu2 N12 O14 -","- C120 H91.98 Co4 Eu2 N12 O13.98 -","- C120 H91.98 Co4 Eu2 N12 O13.98 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.1001","0.0813","","","0.1523","0.1612","","","","","","1.087","","","","has coordinates","179596","2020-10-21","18:00:00",""
"4506095","13.3574","0.0003","13.3574","0.0003","18.3706","0.0012","90","","90","","120","","2838.6","0.2","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 Eu2 N12 Ni4 O14 -","- C120 H91.98 Eu2 N12 Ni4 O13.98 -","- C120 H91.98 Eu2 N12 Ni4 O13.98 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.1818","0.1666","","","0.3452","0.3531","","","","","","1.131","","","","has coordinates","179596","2020-10-21","18:00:00",""
"4506096","13.4432","0.0002","13.4432","0.0002","18.3107","0.0004","90","","90","","120","","2865.77","0.09","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 N12 O14 Tb2 Zn4 -","- C120 H85.98 N12 O13.98 Tb2 Zn4 -","- C120 H85.98 N12 O13.98 Tb2 Zn4 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.0726","0.048","","","0.1154","0.1252","","","","","","1.064","","","","has coordinates","179596","2020-10-21","18:00:00",""
"4506097","13.3911","0.0007","13.3911","0.0007","18.4749","0.0018","90","","90","","120","","2869.1","0.4","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 Co4 N12 O14 Tb2 -","- C120 H85.98 Co4 N12 O13.98 Tb2 -","- C120 H85.98 Co4 N12 O13.98 Tb2 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.0714","0.0516","","","0.1316","0.1434","","","","","","1.089","","","","has coordinates","179596","2020-10-21","18:00:00",""
"4506098","13.3357","0.0002","13.3357","0.0002","18.5394","0.0004","90","","90","","120","","2855.34","0.09","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 N12 Ni4 O14 Tb2 -","- C120 H85.98 N12 Ni4 O13.98 Tb2 -","- C120 H85.98 N12 Ni4 O13.98 Tb2 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.0894","0.0779","","","0.1647","0.1717","","","","","","1.085","","","","has coordinates","179596","2020-10-21","18:00:00",""
"4506099","13.4647","0.0002","13.4647","0.0002","18.3963","0.0006","90","","90","","120","","2888.38","0.11","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H84 Cd4 Dy2 N12 O14 -","- C120 H84 Cd4 Dy2 N12 O13.98 -","- C120 H84 Cd4 Dy2 N12 O13.98 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.1056","0.0925","","","0.3132","0.3294","","","","","","1.397","","","","has coordinates","179596","2020-10-21","18:00:00",""
"4506100","13.4049","0.0001","13.4049","0.0001","18.4479","0.0002","90","","90","","120","","2870.81","0.04","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 Co4 Gd2 N12 O14 -","- C120 H85.98 Co4 Gd2 N12 O13.98 -","- C120 H85.98 Co4 Gd2 N12 O13.98 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.0482","0.0411","","","0.0996","0.1046","","","","","","1.097","","","","has coordinates","179597","2020-10-21","18:00:00",""
"4506101","13.377","0.0003","13.377","0.0003","18.6505","0.001","90","","90","","120","","2890.27","0.18","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 Gd2 N12 Ni4 O14 -","- C120 H91.98 Gd2 N12 Ni4 O13.98 -","- C120 H91.98 Gd2 N12 Ni4 O13.98 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.1298","0.1101","","","0.2949","0.311","","","","","","1.064","","","","has coordinates","179597","2020-10-21","18:00:00",""
"4506102","13.436","0.0013","13.436","0.0013","18.334","0.003","90","","90","","120","","2866.3","0.6","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 N12 O14 Sm2 Zn4 -","- C120 H85.98 N12 O13.98 Sm2 Zn4 -","- C120 H85.98 N12 O13.98 Sm2 Zn4 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.0951","0.0545","","","0.1307","0.1484","","","","","","1.041","","","","has coordinates","179597","2020-10-21","18:00:00",""
"4506103","13.3608","0.0004","13.3608","0.0004","18.6145","0.0015","90","","90","","120","","2877.7","0.3","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H84 Co4 N12 O14 Sm2 -","- C120 H90 Co4 N12 O13.98 Sm2 -","- C120 H90 Co4 N12 O13.98 Sm2 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.2134","0.1598","","","0.4232","0.4535","","","","","","1.569","","","","has coordinates","179597","2020-10-21","18:00:00",""
"4506104","13.3759","0.0002","13.3759","0.0002","18.6826","0.0004","90","","90","","120","","2894.77","0.09","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H86 N12 Ni4 O14 Sm2 -","- C120 H91.98 N12 Ni4 O13.98 Sm2 -","- C120 H91.98 N12 Ni4 O13.98 Sm2 -","1","0.0833333","","Zhu, Yan; Luo, Feng; Song, Yu-mei; Feng, Xue-feng; Luo, Ming-biao; Liao, Zhen-wei; Sun, Gong-ming; Tian, Xiao-zhao; Yuan, Zi-Jun","The First One-Pot Synthesis of Multinuclear 3d-4f Metal‒Organic Compounds Involving a Polytopic N,O-Donor Ligand Formed in Situ","Crystal Growth & Design","2012","12","5","2158","","10.1021/cg3002509","","","0.71073","MoKα","","0.1719","0.1521","","","0.4802","0.4954","","","","","","2.053","","","","has coordinates","179597","2020-10-21","18:00:00",""
"4506302","15.8469","0.0006","15.8469","0.0006","10.5371","0.0007","90","","90","","120","","2291.6","0.2","85","","85","","","","","","","","","4","P 63/m","-P 6c","176","HMX - 2-pyrrolidone","1,3,5,7-tetranitro-1,3,5,7-tetraza-cyclooctane - 2-pyrrolidone","","- C8 H15 N9 O9 -","- C8 H15 N9 O9 -","- C48 H90 N54 O54 -","6","0.5","","Landenberger, Kira B.; Matzger, Adam J.","Cocrystals of 1,3,5,7-Tetranitro-1,3,5,7-tetrazacyclooctane (HMX)","Crystal Growth & Design","2012","12","7","3603","","10.1021/cg3004245","","","1.54187","CuKα","","","0.0627","","","","0.1744","","","","","","1.007","","","","has coordinates","179599","2020-10-21","18:00:00",""
"4509537","19.418","0.002","19.418","0.002","7.5446","0.0009","90","","90","","120","","2463.6","0.5","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C13 H18 Cl N3 O3 S -","- C13.01 H18.02 Cl N3 O3 S -","- C78.06 H108.12 Cl6 N18 O18 S6 -","6","0.5","","Comotti, Angiolina; Bracco, Silvia; Sozzani, Piero; Hawxwell, Samuel M.; Hu, Chunhua; Ward, Michael D.","Guest Molecules Confined in Amphipathic Crystals as Revealed by X-ray Diffraction and MAS NMR†","Crystal Growth & Design","2009","9","7","2999","","10.1021/cg900282k","","","0.71073","MoKα","","0.0777","0.0549","","","0.1298","0.1472","","","","","","1.105","","","","has coordinates,has disorder","179631","2020-10-21","18:00:00",""
"4509538","19.328","0.006","19.328","0.006","7.616","0.002","90","","90","","120","","2463.9","1.3","299","2","299","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C12.33 H16.67 Cl N3 O3 S -","- C12.38 H17.34 Cl N3 O3 S -","- C74.28 H104.04 Cl6 N18 O18 S6 -","6","0.5","","Comotti, Angiolina; Bracco, Silvia; Sozzani, Piero; Hawxwell, Samuel M.; Hu, Chunhua; Ward, Michael D.","Guest Molecules Confined in Amphipathic Crystals as Revealed by X-ray Diffraction and MAS NMR†","Crystal Growth & Design","2009","9","7","2999","","10.1021/cg900282k","","","0.71073","MoKα","","0.074","0.0639","","","0.1829","0.1963","","","","","","1.109","","","","has coordinates,has disorder","179631","2020-10-21","18:00:00",""
"4509539","19.0746","0.0006","19.0746","0.0006","7.6483","0.0003","90","","90","","120","","2409.94","0.14","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C12.33 H16.67 Cl N3 O3 S -","- C12.37 H17.34 Cl N3 O3 S -","- C74.22 H104.04 Cl6 N18 O18 S6 -","6","0.5","","Comotti, Angiolina; Bracco, Silvia; Sozzani, Piero; Hawxwell, Samuel M.; Hu, Chunhua; Ward, Michael D.","Guest Molecules Confined in Amphipathic Crystals as Revealed by X-ray Diffraction and MAS NMR†","Crystal Growth & Design","2009","9","7","2999","","10.1021/cg900282k","","","0.71073","MoKα","","0.0852","0.0588","","","0.1451","0.1663","","","","","","1.097","","","","has coordinates,has disorder","179631","2020-10-21","18:00:00",""
"4510358","18.018","0.003","18.018","0.003","20.174","0.004","90","","90","","120","","5672","1.7","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C34 H40 N4 O18 Zn2 -","- C30 H24 N2 O18 Zn2 -","- C60 H48 N4 O36 Zn4 -","2","0.166667","","Chun, Hyungphil; Bak, Woojeong; Hong, Keunil; Moon, Dohyun","A Simple and Rational Approach for Binodal Metal‒Organic Frameworks with Tetrahedral Nodes and Unexpected Multimodal Porosities from Nonstoichiometric Defects","Crystal Growth & Design","2014","14","4","1998","","10.1021/cg500116f","","","0.8","Synchrotron","","0.1754","0.1121","","","0.2969","0.3192","","","","","","1.703","","","","has coordinates","179650","2020-10-21","18:00:00",""
"4511046","19.69","0.003","19.69","0.003","7.6026","0.0012","90","","90","","120","","2552.6","0.7","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C13 H18 Cl N3 O3 S -","- C13.01 H18.02 Cl N3 O3 S -","- C78.06 H108.12 Cl6 N18 O18 S6 -","6","0.5","","Comotti, Angiolina; Bracco, Silvia; Sozzani, Piero; Hawxwell, Samuel M.; Hu, Chunhua; Ward, Michael D.","Guest Molecules Confined in Amphipathic Crystals as Revealed by X-ray Diffraction and MAS NMR†","Crystal Growth & Design","2009","9","7","2999","","10.1021/cg900282k","","","0.71073","MoKα","","0.0962","0.0661","","","0.1835","0.2007","","","","","","1.093","","","","has coordinates,has disorder","179657","2020-10-21","18:00:00",""
"4511642","20.7493","0.0007","20.7493","0.0007","10.0311","0.0002","90","","90","","120","","3740.12","0.19","150","2","150","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C9 H10 O8 U -","- C9 H9 O8 U -","- C54 H54 O48 U6 -","6","0.5","","Thuéry, Pierre; Harrowfield, Jack","Uranyl Ion Complexes with all-cis-1,3,5-Cyclohexanetricarboxylate: Unexpected Framework and Nanotubular Assemblies","Crystal Growth & Design","2014","14","8","4214","","10.1021/cg500828s","","","0.71073","MoKα","","0.0397","0.0318","","","0.0781","0.0802","","","","","","1.052","","","","has coordinates","179663","2020-10-21","18:00:00",""
"4512474","7.3489","0.001","7.3489","0.001","12.642","0.004","90","","90","","120","","591.3","0.2","296","2","296","2","","","","","","","","5","P 63/m","-P 6c","176","Na3Ba2B6O12F","","","- B6 Ba2 F Na3 O12 -","- B6 Ba2 F Na3 O12 -","- B12 Ba4 F2 Na6 O24 -","2","0.166667","","Zhang, Hui; Zhang, Min; Pan, Shilie; Yang, Zhihua; Wang, Zheng; Bian, Qiang; Hou, Xueling; Yu, Hongwei; Zhang, Fangfang; Wu, Kui; Yang, Feng; Peng, Qinjun; Xu, Zuyan; Chang, Kelvin B.; Poeppelmeier, Kenneth R.","Na3Ba2(B3O6)2F: Next Generation of Deep-Ultraviolet Birefringent Materials","Crystal Growth & Design","2015","15","1","523","","10.1021/cg5016912","","","0.71073","MoKα","","0.0128","0.0124","","","0.0285","0.0286","","","","","","1.226","","","","has coordinates","179671","2020-10-21","18:00:00",""
"4512917","7.4738","0.0011","7.4738","0.0011","10.674","0.002","90","","90","","120","","516.35","0.14","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cs2 O9 Si3 Th -","- Cs2 O9 Si3 Th -","- Cs4 O18 Si6 Th2 -","2","0.166667","","Mann, J. Matthew; McMillen, Colin D.; Kolis, Joseph W.","Crystal Chemistry of Alkali Thorium Silicates Under Hydrothermal Conditions","Crystal Growth & Design","2015","15","6","2643","","10.1021/cg5017164","","","0.71073","MoKα","","0.0294","0.0251","","","0.0563","0.059","","","","","","1.183","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4512918","7.3064","0.001","7.3064","0.001","10.604","0.002","90","","90","","120","","490.24","0.13","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- O9 Rb2 Si3 Th -","- O9 Rb2 Si3 Th -","- O18 Rb4 Si6 Th2 -","2","0.166667","","Mann, J. Matthew; McMillen, Colin D.; Kolis, Joseph W.","Crystal Chemistry of Alkali Thorium Silicates Under Hydrothermal Conditions","Crystal Growth & Design","2015","15","6","2643","","10.1021/cg5017164","","","0.71073","MoKα","","0.0338","0.0305","","","0.0649","0.0664","","","","","","1.183","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4514348","32.2282","0.0014","32.2282","0.0014","26.548","0.0012","90","","90","","120","","23880","1.8","100","","100","","","","","","","","","5","P 63/m","-P 6c","176","","","","- C56.67 H24 N O28.67 Zr4 -","- C56.6666 H24 N O28.6665 Zr4 -","- C340 H144 N6 O171.999 Zr24 -","6","0.5","","Nguyen, Phuong T. K.; Nguyen, Huong T. D.; Nguyen, Hung N.; Trickett, Christopher A.; Ton, Quang T.; Gutiérrez-Puebla, Enrique; Monge, M. Angeles; Cordova, Kyle E.; Gándara, Felipe","New Metal-Organic Frameworks for Chemical Fixation of CO2.","ACS applied materials & interfaces","2018","10","1","733","744","10.1021/acsami.7b16163","","","0.71073","MoKα","","0.1775","0.1554","","","0.4612","0.4922","","","","","","2.247","","","","has coordinates,has disorder","206108","2020-10-21","18:00:00",""
"4515874","20.702","0.002","20.702","0.002","16.158","0.002","90","","90","","120","","5997.1","1.1","200","2","200","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C27 H45 Cl Mo3 O10 S4 -","- C27 H46 Cl Mo3 O10 S4 -","- C162 H276 Cl6 Mo18 O60 S24 -","6","0.5","","Fu, Dong; Fabre, Bruno; Loget, Gabriel; Mériadec, Cristelle; Ababou-Girard, Soraya; Cadot, Emmanuel; Leclerc-Laronze, Nathalie; Marrot, Jérôme; de Ponfilly, Quentin","Polyoxothiometalate-Derivatized Silicon Photocathodes for Sunlight-Driven Hydrogen Evolution Reaction.","ACS omega","2018","3","10","13837","13849","10.1021/acsomega.8b01734","","","0.71073","MoKα","","0.0566","0.05","","","0.1298","0.1353","","","","","","1.147","","","","has coordinates","225966","2020-10-21","18:00:00",""
"4516379","27.538","0.004","27.538","0.004","20.139","0.004","90","","90","","120","","13226","4","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C63 H84 Cu7 I4 N11 O23 -","- C42 H27 Cu7 I4 N4 O15 -","- C168 H108 Cu28 I16 N16 O60 -","4","0.333333","","Luo, Xiaolong; Sun, Libo; Zhao, Jun; Li, Dong-Sheng; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Three Metal‒Organic Frameworks Based on Binodal Inorganic Building Units and Hetero-O, N Donor Ligand: Solvothermal Syntheses, Structures, and Gas Sorption Properties","Crystal Growth & Design","2015","15","10","4901","","10.1021/acs.cgd.5b00791","","","0.71073","MoKα","","0.1389","0.0509","","","0.1276","0.1485","","","","","","0.94","","","","has coordinates","231278","2020-10-21","18:00:00",""
"4516381","28.1563","0.0007","28.1563","0.0007","19.1585","0.0007","90","","90","","120","","13153.6","0.7","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C39 H21 Cu7 I4 N3 O18 -","- C39 H21 Cu7 I4 N3 O17.65 -","- C156 H84 Cu28 I16 N12 O70.6 -","4","0.333333","","Luo, Xiaolong; Sun, Libo; Zhao, Jun; Li, Dong-Sheng; Wang, Dongmei; Li, Guanghua; Huo, Qisheng; Liu, Yunling","Three Metal‒Organic Frameworks Based on Binodal Inorganic Building Units and Hetero-O, N Donor Ligand: Solvothermal Syntheses, Structures, and Gas Sorption Properties","Crystal Growth & Design","2015","15","10","4901","","10.1021/acs.cgd.5b00791","","","0.71073","MoKα","","0.0602","0.0439","","","0.1289","0.136","","","","","","1.01","","","","has coordinates,has disorder","231280","2020-10-21","18:00:00",""
"4517306","23.6621","0.0003","23.6621","0.0003","7.5296","0.0002","90","","90","","120","","3650.98","0.12","99.9","0.5","99.9","0.5","","","","","","","","6","P 63/m","-P 6c","176","","","","- C22 H33 N3 O4 S Si -","- C22 H33 N3 O4 S Si -","- C132 H198 N18 O24 S6 Si6 -","6","0.5","","Prybil, Joshua W.; Wallace, Rodney; Warren, Alexandra; Klingman, Jordan; Vaillant, Romane; Hall, Michael B.; Yang, Xin; Brennessel, William W.; Chin, Robert M.","Silylation of Pyridine, Picolines, and Quinoline with a Zinc Catalyst","ACS Omega","2020","5","3","1528","1539","10.1021/acsomega.9b03317","","x-ray","1.54184","CuKα","","0.1383","0.1365","","","0.3691","0.3702","","","","","","1.184","","","","has coordinates,has disorder","257079","2020-10-21","18:00:00",""
"4518520","26.2298","0.0007","26.2298","0.0007","17.6575","0.0007","90","","90","","120","","10520.8","0.6","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","none","","","- C12 H27.75 N3.25 O S7 Sn3 -","- C10.5 H20.625 N2.625 O0.375 S7 Sn3 -","- C168 H330 N42 O6 S112 Sn48 -","16","1.33333","","Li, Wei-An; Li, Jian-Rong; Zhang, Bo; Sun, Hai-Yan; Jin, Jian-Ce; Huang, Xiao-Ying; Feng, Mei-Ling","Layered Thiostannates with Distinct Arrangements of Mixed Cations for the Selective Capture of Cs<sup>+</sup>, Sr<sup>2+</sup>, and Eu<sup>3+</sup> Ions.","ACS applied materials & interfaces","2021","13","8","10191","10201","10.1021/acsami.0c22690","","","0.71073","MoKα","","0.0595","0.0429","","","0.1047","0.1164","","","","","","1.101","","","","has coordinates,has disorder","262405","2021-03-03","20:07:26",""
"5000041","9.363","0.002","9.363","0.002","6.878","0.002","90","","90","","120","","522.2","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Calcium tris(phosphate) fluoride","Fluorapatite","?","- Ca4.938 F0.906 O11.862 P3.024 -","- Ca9.876 F1.812 O23.724 P6.048 -","2","0.166667","","Sudarsanan, K; Mackie, P E; Young, R A","","Materials Research Bulletin","1972","7","","1331","1338","10.1016/0025-5408(72)90113-4","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"5000228","10.211","0.001","10.211","0.001","7.4185","0.004","90","","90","","120","","669.9","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pentalead tris(arsenate) chloride","Mimetite","- As3 Cl O12 Pb5 -","- As3 Cl O12 Pb5 -","- As6 Cl2 O24 Pb10 -","2","0.166667","","Dai, Y - S; Hughes, J M; Moore, P B","The crystal structures of mimetite and clinomimetite, Pb5 (As O4)3 Cl","Canadian Mineralogist","1991","29","","369","376","","","","","","","0.031","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"5910057","6.06","","6.06","","23.69","","90","","90","","120","","753.427","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Finnemanite","","- As3 Cl O9 Pb5 -","- As6 Cl2 O18 Pb10 -","- As6 Cl2 O18 Pb10 -","","","","Wyckoff, R. W. G.","Page 320 from the second edition of Structure of Crystals by Wyckoff. published by The Chemical Catalog Company, INC, New York in 1931 & http://database.iem.ac.ru/mincryst/","The second edition of Structure of Crystals","1931","","","320","320","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"6000006","9.7259","","9.7259","","7.1899","","90","","90","","120","","589","","","","","","","","","","","","","3","P 63/m","","","","","","- La9.33 O26 Si6 -","","","","","","Christensen, A. N.; Hazell, R. G.; Hewat, A. W.","Synthesis, crystal growth and structure investigations of rare-earth disilicates and rare-earth oxyapatites","Acta Chemica Scandinavica","1997","51","1","37","43","10.3891/acta.chem.scand.51-0037","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000007","9.5731","","9.5731","","7.0336","","90","","90","","120","","558.23","","","","","","","","","","","","","3","P 63/m","","","","","","- Nd9.33 O26 Si6 -","","","","","","Christensen, A. N.; Hazell, R. G.; Hewat, A. W.","Synthesis, crystal growth and structure investigations of rare-earth disilicates and rare-earth oxyapatites","Acta Chemica Scandinavica","1997","51","1","37","43","10.3891/acta.chem.scand.51-0037","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000036","9.4302","","9.4302","","6.8911","","90","","90","","120","","530.72","","","","","","","","","","","","","4","P 63/m","","","","","","- Ca10 H2 O26 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000037","9.3475","0.0003","9.3475","0.0003","6.8646","0.0001","90","","90","","120","","519.5","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca10 F2 O24 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","203334","2020-10-21","18:00:00",""
"6000038","9.5902","","9.5902","","6.7666","","90","","90","","120","","538.96","","","","","","","","","","","","","4","P 63/m","","","","","","- Ca10 Cl2 O24 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000039","9.6482","","9.6482","","6.7788","","90","","90","","120","","546.48","","","","","","","","","","","","","4","P 63/m","","","","","","- Br2 Ca10 O24 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000040","9.8612","","9.8612","","7.4242","","90","","90","","120","","625.23","","","","","","","","","","","","","4","P 63/m","","","","","","- H2 O26 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000041","9.7547","","9.7547","","7.2832","","90","","90","","120","","600.18","","","","","","","","","","","","","4","P 63/m","","","","","","- F2 O24 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000042","9.9767","","9.9767","","7.3255","","90","","90","","120","","631.45","","","","","","","","","","","","","4","P 63/m","","","","","","- Cl2 O24 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000043","10.0618","","10.0618","","7.3792","","90","","90","","120","","646.98","","","","","","","","","","","","","4","P 63/m","","","","","","- Br2 O24 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000454","15.649","","15.649","","3.8412","","90","","90","","120","","814.65","","","","","","","","","","","","","3","P 63/m","","","","","","- Rh5 Si3 Sm -","","","","","","Morozkin, A. V.; Seropegin, Y. D.; Sviridov, I. A.; Bodak, O. I.","Crystallographic data for new ternary UCo~5~Si~3~-type RRh~5~Si~3~ (R=Sm, Gd-Tm) compounds","Journal of Alloys and Compounds","1998","274","1-2","L1","L5","10.1016/S0925-8388(98)00493-9","","","","","","","","","","","","","","","","","","","","","","174713","2020-10-21","18:00:00",""
"6000455","15.622","","15.622","","3.833","","90","","90","","120","","810.11","","","","","","","","","","","","","3","P 63/m","","","","","","- Gd Rh5 Si3 -","","","","","","Morozkin, A. V.; Seropegin, Y. D.; Sviridov, I. A.; Bodak, O. I.","Crystallographic data for new ternary UCo~5~Si~3~-type RRh~5~Si~3~ (R=Sm, Gd-Tm) compounds","Journal of Alloys and Compounds","1998","274","1-2","L1","L5","10.1016/S0925-8388(98)00493-9","","","","","","","","","","","","","","","","","","","","","","174713","2020-10-21","18:00:00",""
"6000456","15.621","","15.621","","3.8274","","90","","90","","120","","808.82","","","","","","","","","","","","","3","P 63/m","","","","","","- Rh5 Si3 Tb -","","","","","","Morozkin, A. V.; Seropegin, Y. D.; Sviridov, I. A.; Bodak, O. I.","Crystallographic data for new ternary UCo~5~Si~3~-type RRh~5~Si~3~ (R=Sm, Gd-Tm) compounds","Journal of Alloys and Compounds","1998","274","1-2","L1","L5","10.1016/S0925-8388(98)00493-9","","","","","","","","","","","","","","","","","","","","","","174713","2020-10-21","18:00:00",""
"6000457","15.626","","15.626","","3.8218","","90","","90","","120","","808.15","","","","","","","","","","","","","3","P 63/m","","","","","","- Dy Rh5 Si3 -","","","","","","Morozkin, A. V.; Seropegin, Y. D.; Sviridov, I. A.; Bodak, O. I.","Crystallographic data for new ternary UCo~5~Si~3~-type RRh~5~Si~3~ (R=Sm, Gd-Tm) compounds","Journal of Alloys and Compounds","1998","274","1-2","L1","L5","10.1016/S0925-8388(98)00493-9","","","","","","","","","","","","","","","","","","","","","","174713","2020-10-21","18:00:00",""
"6000458","15.608","","15.608","","3.8161","","90","","90","","120","","805.09","","","","","","","","","","","","","3","P 63/m","","","","","","- Ho Rh5 Si3 -","","","","","","Morozkin, A. V.; Seropegin, Y. D.; Sviridov, I. A.; Bodak, O. I.","Crystallographic data for new ternary UCo~5~Si~3~-type RRh~5~Si~3~ (R=Sm, Gd-Tm) compounds","Journal of Alloys and Compounds","1998","274","1-2","L1","L5","10.1016/S0925-8388(98)00493-9","","","","","","","","","","","","","","","","","","","","","","174713","2020-10-21","18:00:00",""
"6000459","15.612","","15.612","","3.8128","","90","","90","","120","","804.81","","","","","","","","","","","","","3","P 63/m","","","","","","- Er Rh5 Si3 -","","","","","","Morozkin, A. V.; Seropegin, Y. D.; Sviridov, I. A.; Bodak, O. I.","Crystallographic data for new ternary UCo~5~Si~3~-type RRh~5~Si~3~ (R=Sm, Gd-Tm) compounds","Journal of Alloys and Compounds","1998","274","1-2","L1","L5","10.1016/S0925-8388(98)00493-9","","","","","","","","","","","","","","","","","","","","","","174713","2020-10-21","18:00:00",""
"6000460","15","","15.612","","3.8128","","90","","90","","120","","773.26","","","","","","","","","","","","","3","P 63/m","","","","","","- Rh5 Si3 Tm -","","","","","","Morozkin, A. V.; Seropegin, Y. D.; Sviridov, I. A.; Bodak, O. I.","Crystallographic data for new ternary UCo~5~Si~3~-type RRh~5~Si~3~ (R=Sm, Gd-Tm) compounds","Journal of Alloys and Compounds","1998","274","1-2","L1","L5","10.1016/S0925-8388(98)00493-9","","","","","","","","","","","","","","","","","","","","","","174713","2020-10-21","18:00:00",""
"6000540","9.2197","","9.2197","","5.5352","","90","","90","","120","","407.47","","","","","","","","","","","","","3","P 63/m","","","","","","- Cl3 O12 Yb -","","","","","","Favier, F.; Pascal, J. L.; Cunin, F.; Fitch, A. N.; Vaughan, G.","Thermal behavior and X-ray powder diffraction structures of two polymorphic phases of anhydrous Yb(ClO4)(3)","Inorganic Chemistry","1998","37","","1776","1780","10.1021/ic9712683","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000590","10.081","0.001","10.081","0.001","5.8476","0.0001","90","","90","","120","","514.65","0.12","","","293","","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ba6 Cl6 F12 Mn2 Zn -","- Ba6 Cl6 F12 Mn2 Zn -","- Ba6 Cl6 F12 Mn2 Zn -","1","0.0833333","","Darriet, J.; Ducau, M.; Feist, M.; Tressaud, A.","Crystal structure of Ba~6~Mn~2~ZnF~12~Cl~6~","European Journal of Solid State and Inorganic Chemistry","1992","29","","435","443","","","x-ray","0.71069","MoKα","","","0.0221","","","0.0227","","","","","","","","","","","has coordinates","277869","2022-09-15","09:06:00",""
"6000619","9.9641","","9.9641","","7.207","","90","","90","","120","","619.67","","","","","","","","","","","","","4","P 63/m","","","","","","- Br O12 P3 Sr5 -","","","","","","Notzold, D.; Wulff, H.","Determining the crystal structure of Sr-5(PO4)(3)Br, a new compound in the apatite series, by powder diffraction modeling","Powder Diffraction","1998","13","","70","73","10.1017/S088571560000988X","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000711","9.3892","","9.3892","","6.9019","","90","","90","","120","","526.93","","","","","","","","","","","","","4","P 63/m","","","","","","- Ca10 H2 O25 P6 -","","","","","","El, Feki H; Savariault, J. M.; Ben, Salah A","Structure refinements by the Rietveld method of partially substituted hydroxyapatite: Ca9Na0.5(PO4)(4.5)(CO3)(1.5)(OH)(2)","Journal of Alloys and Compounds","1999","287","","114","120","10.1016/S0925-8388(99)00070-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000757","9.8461","","9.8461","","7.3591","","90","","90","","120","","617.85","","","","","","","","","","","","","5","P 63/m","","","","","","- H1.2 K0.6 O25.2 P6 Pb9.3 -","","","","","","El, Feki H; Naddari, T.; Savariault, J. M.; Ben, Salah A","Localization of potassium in substituted lead hydroxyapatite: Pb9.30K0.60(PO4)(6)(OH)(1.20) by X-ray diffraction","Solid State Sciences","2000","2","","725","733","10.1016/S1293-2558(00)01075-X","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"7000579","34.7146","0.0005","34.7146","0.0005","31.5499","0.0014","90","","90","","120","","32927.1","1.6","100","2","100","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C144 H553 Co27 N36 Na18 O467 P15 W81 -","- C79.2 Co27 N21 Na13.44 O405.5 P15 W81 -","- C158.4 Co54 N42 Na26.88 O811 P30 W162 -","2","0.166667","","Ritchie, Chris; Boyd, Thomas; Long, De-Liang; Ditzel, Evert; Cronin, Leroy","Grafting ligands to direct the self-assembly of Co/Ni2+ substituted polyoxometalate clusters","Dalton Transactions","2009","","9","1587","1592","10.1039/b814076f","","","0.71073","MoKα","","0.177","0.1181","","","0.2853","0.3587","","","","","","1.038","","","","has coordinates,has disorder","209564","2020-10-21","18:00:00",""
"7001821","8.4018","0.0005","8.4018","0.0005","26.022","0.002","90","","90","","120","","1590.8","0.18","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C21 H45 N11 O12 -","- C21 H39 N10 O6 -","- C42 H78 N20 O12 -","2","0.166667","","Chin, Aileen; Edgar, Mark; Harding, Charles J; McKee, Vickie; Nelson, Jane","A novel trisprotonated β-dialdiminate cryptand","Dalton Transactions","2009","","32","6315","6326","10.1039/b821237f","","","0.71073","MoKα","","0.0745","0.0697","","","0.244","0.2459","","","","","","1.289","","","","has coordinates","179716","2020-10-21","18:00:00",""
"7001905","9.4145","0.0001","9.4145","0.0001","6.8811","0.0001","90","","90","","120","","528.181","0.011","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Alkaline-earth Apatite","","","- Ca10 Cu0.2 H1.28 O25.84 P6 -","- Ca10 Cu0.2 H1.28 O25.84 P6 -","- Ca10 Cu0.2 H1.28 O25.84 P6 -","1","0.0833333","","Baikie, Tom; Ng, George M. H.; Madhavi, S.; Pramana, Stevin S.; Blake, Kevin; Elcombe, Margaret; White, T. J.","The crystal chemistry of the alkaline-earth apatites A10(PO4)6CuxOy(H)z (A = Ca, Sr and Ba)","Dalton Transactions","2009","","34","6722","6726","10.1039/b906639j","powder diffraction","neutron","1.883","neutron","","","","","","","","","","0.54","","","","","","","has coordinates","179717","2020-10-21","18:00:00",""
"7001906","9.4262","0.0001","9.4262","0.0001","6.9003","0.0001","90","","90","","120","","530.972","0.011","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Alkaline-earth Apatite","","","- Ca10 Cu0.6 H0.8 O26 P6 -","- Ca10 Cu0.6 H0.8 O26 P6 -","- Ca10 Cu0.6 H0.8 O26 P6 -","1","0.0833333","","Baikie, Tom; Ng, George M. H.; Madhavi, S.; Pramana, Stevin S.; Blake, Kevin; Elcombe, Margaret; White, T. J.","The crystal chemistry of the alkaline-earth apatites A10(PO4)6CuxOy(H)z (A = Ca, Sr and Ba)","Dalton Transactions","2009","","34","6722","6726","10.1039/b906639j","powder diffraction","neutron","1.883","neutron","","","","","","","","","","0.52","","","","","","","has coordinates","204133","2020-10-21","18:00:00",""
"7001907","9.4392","0.0002","9.4392","0.0002","6.9166","0.0001","90","","90","","120","","533.696","0.018","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Alkaline-earth Apatite","","","- Ca10 Cu0.72 H0.56 O26 P6 -","- Ca10 Cu0.72 H0.56 O26 P6 -","- Ca10 Cu0.72 H0.56 O26 P6 -","1","0.0833333","","Baikie, Tom; Ng, George M. H.; Madhavi, S.; Pramana, Stevin S.; Blake, Kevin; Elcombe, Margaret; White, T. J.","The crystal chemistry of the alkaline-earth apatites A10(PO4)6CuxOy(H)z (A = Ca, Sr and Ba)","Dalton Transactions","2009","","34","6722","6726","10.1039/b906639j","powder diffraction","neutron","1.883","neutron","","","","","","","","","","0.53","","","","","","","has coordinates","204133","2020-10-21","18:00:00",""
"7001908","9.7952","0.0001","9.7952","0.0001","7.2931","0.0001","90","","90","","120","","605.996","0.012","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Alkaline-earth Apatite","","","- Cu0.88 H0.24 O26 P6 Sr10 -","- Cu0.88 H0.232 O26 P6 Sr10 -","- Cu0.88 H0.232 O26 P6 Sr10 -","1","0.0833333","","Baikie, Tom; Ng, George M. H.; Madhavi, S.; Pramana, Stevin S.; Blake, Kevin; Elcombe, Margaret; White, T. J.","The crystal chemistry of the alkaline-earth apatites A10(PO4)6CuxOy(H)z (A = Ca, Sr and Ba)","Dalton Transactions","2009","","34","6722","6726","10.1039/b906639j","powder diffraction","neutron","1.883","neutron","","","","","","","","","","0.56","","","","","","","has coordinates","179717","2020-10-21","18:00:00",""
"7001909","10.2168","0.0002","10.2168","0.0002","7.7347","0.0002","90","","90","","120","","699.2","0.03","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Alkaline-earth Apatite","","","- Ba10 Cu0.9 H0.2 O26 P6 -","- Ba10 Cu0.9088 H0.1 O26 P6 -","- Ba10 Cu0.9088 H0.1 O26 P6 -","1","0.0833333","","Baikie, Tom; Ng, George M. H.; Madhavi, S.; Pramana, Stevin S.; Blake, Kevin; Elcombe, Margaret; White, T. J.","The crystal chemistry of the alkaline-earth apatites A10(PO4)6CuxOy(H)z (A = Ca, Sr and Ba)","Dalton Transactions","2009","","34","6722","6726","10.1039/b906639j","powder diffraction","neutron","1.883","neutron","","","","","","","","","","0.56","","","","","","","has coordinates","179717","2020-10-21","18:00:00",""
"7002206","19.5216","0.0017","19.5216","0.0017","10.5282","0.0018","90","","90","","120","","3474.7","0.7","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C12 H22.67 Cl2 Cu N8 O9 -","- C12 H12 Cl2 Cu N8 O9 -","- C72 H72 Cl12 Cu6 N48 O54 -","6","0.5","","Liu, Jing-Xin; Dong, Chun-Hong; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","From 1D zigzag chain to 1D tubular structure, weak field ligand-dependent assembly of cucurbit[6]uril-based tubular coordination polymer","Dalton Transactions","2009","","36","7344","7346","10.1039/b904041b","","","0.71073","MoKα","","0.0789","0.0741","","","0.1951","0.2015","","","","","","1.084","","","","has coordinates,has disorder","179720","2020-10-21","18:00:00",""
"7002298","13.7732","0.001","13.7732","0.001","29.544","0.003","90","","90","","120","","4853.7","0.7","120","2","120","2","","","","","","","","6","P 63/m","-P 6c","176","","{propane-1,3-diylbis[(methylimino)methylene-2,1-phenylene]}- bis(trimethylstibonium) iodide chloroform solvate","","- C25.333 H42.333 Cl I2 N2 Sb2 -","- C25.3333 H42.3333 Cl I2 N2 Sb2 -","- C152 H254 Cl6 I12 N12 Sb12 -","6","0.5","","Jura, Marek; Levason, William; Reid, Gillian; Webster, Michael","Preparation and properties of cyclic and open-chain Sb/N-donor ligands","Dalton Transactions","2009","","37","7811","7819","10.1039/b909226a","","","0.71073","MoKα","","0.0513","0.0344","","","0.0636","0.0692","","","","","","1.038","","","","has coordinates,has disorder","179720","2020-10-21","18:00:00",""
"7002465","13.79","0.002","13.79","0.002","21.995","0.004","90","","90","","120","","3622.3","1","150","2","150","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C54 H36 F6 N12 Ni2 O6 P -","- C54 H36 F6 N12 Ni2 O6 P -","- C108 H72 F12 N24 Ni4 O12 P2 -","2","0.166667","","Palacios, María A.; Rodríguez-Diéguez, Antonio; Sironi, Angelo; Herrera, Juan Manuel; Mota, Antonio J.; Cano, Joan; Colacio, Enrique","Enhanced ferromagnetic interaction in metallacyclic complexes incorporating m-phenylenediamidato bridges.","Dalton Transactions","2009","","40","8538","8547","10.1039/b903986d","","","0.71073","MoKα","","0.0635","0.049","","","0.1364","0.1435","","","","","","1.041","","","","has coordinates","179724","2020-10-21","18:00:00",""
"7003706","15.0747","0.0016","15.0747","0.0016","32.499","0.005","90","","90","","120","","6395.8","1.4","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C14.5 H18.67 Ag F6 N4 O0.83 Sb -","- C43.5 H48 Ag3 F17.99 N12 O2.5 Sb3 -","- C174 H192 Ag12 F71.96 N48 O10 Sb12 -","4","0.333333","","Liu, Hong-Ke; Huang, Xiaohua; Lu, Tianhong; Wang, Xiujian; Sun, Wei-Yin; Kang, Bei-Sheng","Discrete and infinite 1D, 2D/3D cage frameworks with inclusion of anionic species and anion-exchange reactions of Ag3L2 type receptor with tetrahedral and octahedral anions","Dalton Transactions","2008","","24","3178","3188","10.1039/b718876e","","","0.71073","MoKα","","0.0846","0.0658","","","0.1961","0.2158","","","","","","1.004","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7003874","9.7125","0.0006","9.7125","0.0006","14.1758","0.0016","90","","90","","120","","1158.08","0.17","383","2","383","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C10 H18 I3 P3 -","- C10 H18 I3 P3 -","- C20 H36 I6 P6 -","2","0.166667","","Willans, Charlotte E.; Fish, Cheryl; Green, Michael; Kilby, Richard J.; Lynam, Jason M.; Russell, Christopher A.; Whitwood, Adrian C.","Nucleophilic substitution reactions of the tricyclic triphosphorus cage P3(CBut)2: a novel route to polyphosphorus phosphenium complexes","Dalton Transactions","2008","","26","3422","3428","10.1039/b800864g","","","0.71073","MoKα","","0.0304","0.0269","","","0.0535","0.0548","","","","","","1.128","","","","has coordinates","179742","2020-10-21","18:00:00",""
"7004821","9.8914","0.0006","9.8914","","7.3184","0.0005","90","","90","","120","","620.1","0.06","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge La1.44 O4.39 Sr0.23 -","- Ge La1.44167 O4.389 Sr0.225 -","- Ge6 La8.65 O26.334 Sr1.35 -","6","0.5","","León-Reina, L; Porras-Vázquez, J M; Losilla, E. R.; Sheptyakov, D. V.; Llobet, A.; Aranda, M. A. G.","Low temperature crystal structures of apatite oxygen-conductors containing interstitial oxygen.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2058","2064","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004822","9.69541","0.00016","9.69541","","7.21843","0.00012","90","","90","","120","","587.632","0.014","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- La4.32 O13.13 Si3 Sr0.68 -","- La4.325 O13.1266 Si3 Sr0.675 -","- La8.65 O26.2532 Si6 Sr1.35 -","2","0.166667","","León-Reina, L; Porras-Vázquez, J M; Losilla, E. R.; Sheptyakov, D. V.; Llobet, A.; Aranda, M. A. G.","Low temperature crystal structures of apatite oxygen-conductors containing interstitial oxygen.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2058","2064","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004823","9.7158","0.0005","9.7158","","7.1884","0.0004","90","","90","","120","","587.65","0.04","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.55 O4.33 Si -","- La1.555 O4.3334 Si -","- La9.33 O26.0004 Si6 -","6","0.5","","León-Reina, L; Porras-Vázquez, J M; Losilla, E. R.; Sheptyakov, D. V.; Llobet, A.; Aranda, M. A. G.","Low temperature crystal structures of apatite oxygen-conductors containing interstitial oxygen.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2058","2064","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7005226","13.6489","0.0007","13.6489","0.0007","40.211","0.004","90","","90","","120","","6487.4","0.8","150","2","150","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C102 H114 Cl6 N24 Nd2 O30 -","- C102 H114 Cl5.98 N24 Nd2 O29.92 -","- C204 H228 Cl11.96 N48 Nd4 O59.84 -","2","0.166667","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.0793","0.0744","","","0.2238","0.2298","","","","","","1.09","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005227","13.8557","0.0004","13.8557","0.0004","40.129","0.003","90","","90","","120","","6671.8","0.6","150","2","150","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C102 H114 Cl6 La2 N24 O30 -","- C102 H114 Cl5.98 La2 N24 O29.92 -","- C204 H228 Cl11.96 La4 N48 O59.84 -","2","0.166667","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.1445","0.1191","","","0.3149","0.3344","","","","","","1.138","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7006168","28.3109","0.0011","28.3109","0.0011","24.9373","0.0019","90","","90","","120","","17309.6","1.6","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C47 H39 F6 N2 O2 P3 Ru -","- C47 H39 F6 N2 O2 P3 Ru -","- C564 H468 F72 N24 O24 P36 Ru12 -","12","1","","Cowley, Michael J.; Lynam, Jason M.; Whitwood, Adrian C.","Transition metal vinylidene complexes as supramolecular building blocks: nucleobase-mediated self-assembly of crystals with hexagonal symmetry.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4427","4438","10.1039/b709483c","","","0.71073","MoKα","","0.0767","0.0611","","","0.176","0.186","","","","","","1.056","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006842","15.0722","0.0001","15.0722","0.0001","25.4341","0.0003","90","","90","","120","","5003.8","0.08","173","2","173","2","","","","","","","synthesis as described","6","P 63/m","-P 6c","176","(Na(thf)6)(Na(thf)5)((Si(NCH2tBu)2C6H4)3)","","","- C92 H166 N6 Na2 O11 Si3 -","- C92.04 H138 N6 Na2 O11 Si3 -","- C184.08 H276 N12 Na4 O22 Si6 -","2","0.166667","","Gehrhus, Barbara; Hitchcock, Peter B.; Pongtavornpinyo, Ruti; Zhang, Lihong","Insights into the making of a stable silylene.","Dalton transactions (Cambridge, England : 2003)","2006","","15","1847","1857","10.1039/b514666f","","x-ray","0.7107","MoKα","","0.076","0.0671","","","0.1858","0.1932","","","","","","1.085","","","","has coordinates,has disorder","179772","2020-10-21","18:00:00",""
"7006983","9.3209","0.0009","9.3209","0.0009","11.143","0.002","90","","90","","120","","838.39","0.19","193","2","193","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C8 H21 Br3 Si3 -","- C8 H21 Br3 Si3 -","- C16 H42 Br6 Si6 -","2","0.166667","","Friesen, Dawn M.; Bowles, Owen J.; McDonald, Robert; Rosenberg, Lisa","Tuning ""kappticity"" of tripodal ligands.","Dalton transactions (Cambridge, England : 2003)","2006","","22","2671","2682","10.1039/b516127d","","","0.71073","MoKα","","0.033","0.0254","","","0.0544","0.0575","","","","","","1.145","","","","has coordinates","179773","2020-10-21","18:00:00",""
"7007139","13.959","0.003","13.959","0.003","16.292","0.004","90","","90","","120","","2749.2","1.1","298","2","298","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C18 H27 Cu8 N39 -","- C18 H27 Cu8 N36 -","- C36 H54 Cu16 N72 -","2","0.166667","","Zhang, Xian-Ming; Zhao, Yan-Fei; Wu, Hai-Shun; Batten, Stuart R.; Ng, Seik Weng","Syntheses and structures of metal tetrazole coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2006","","26","3170","3178","10.1039/b518052j","","","0.71073","MoKα","","0.1139","0.0903","","","0.224","0.2355","","","","","","1.162","","","","has coordinates","179775","2020-10-21","18:00:00",""
"7008596","10.385","0.002","10.385","0.002","24.107","0.007","90","","90","","120","","2251.6","0.9","180","2","180","2","","","","","","","","6","P 63/m","-P 6c","176","[Cu~2~(CN)L^2^](ClO~4~)~3~","","","- C37 H54 Cl3 Cu2 N9 O12 -","- C37 H54 Cl3.02 Cu2 N9 O11.96 -","- C74 H108 Cl6.04 Cu4 N18 O23.92 -","2","0.166667","","Bond, Andrew D.; Derossi, Sofia; Harding, Charles J.; McInnes, Eric J. L.; McKee, Vickie; McKenzie, Christine J.; Nelson, Jane; Wolowska, Joanna","Cascade complexation: a single cyano bridge links a pair of Cu(II) cations.","Dalton transactions (Cambridge, England : 2003)","2005","","14","2403","2409","10.1039/b504916d","","","0.71073","MoKα","","0.0938","0.056","","","0.1414","0.1616","","","","","","1.051","","","","has coordinates,has disorder","179789","2020-10-21","18:00:00",""
"7008673","10.5189","0.0001","10.5189","0.0001","10.0831","0.0002","90","","90","","120","","966.2","0.02","173","2","173","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C12 H33 O Si3 V -","- C12 H33 O0.485 Si3 V0.97 -","- C24 H66 O0.97 Si6 V1.94 -","2","0.166667","","Rosenthal, Esther C. E.; Cui, Huiling; Koch, Juliane; Escarpa Gaede, Petra; Hummert, Markus; Dechert, Sebastian","Chloride-bridged oxovanadium(V) complexes with alkoxyalkoxide ligands. Synthesis, structure, electrochemistry and reactivities.","Dalton transactions (Cambridge, England : 2003)","2005","","18","3108","3117","10.1039/b505750g","","","0.71073","MoKα","","0.0732","0.0724","","","0.1751","0.1753","","","","","","1.377","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7010325","13.541","0.003","13.541","0.003","19.136","0.005","90","","90","","120","","3038.7","1.2","233","2","233","2","","","","","","","","6","P 63/m","-P 6c","176","","Hexakis(O,O'-μ-benzoate)(μ3-oxo)tris(pyridine)triiron(III) perchlorate pyridine solvate","","- C62 H50 Cl Fe3 N4 O17 -","- C61.98 H49.98 Cl Fe3 N4.02 O17.02 -","- C123.96 H99.96 Cl2 Fe6 N8.04 O34.04 -","2","0.166667","","Sowrey, Frank E.; Tilford, Claire; Wocadlo, Sigrid; Anson, Christopher E.; Powell, Annie K.; Bennington, Stephen M.; Montfrooij, Wouter; Jayasooriya, Upali A.; Cannon, Roderick D.","Spin frustration and concealed asymmetry: structure and magnetic spectrum of [Fe3O(O2CPh)6(py)3]ClO4·py †","Journal of the Chemical Society, Dalton Transactions","2001","","6","862","","10.1039/b008121n","","","0.71069","MoKα","","0.1241","0.0429","","","0.0993","0.1207","","","","","","1.006","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7010529","14.0129","0.0013","14.0129","0.0013","23.119","0.003","90","","90","","120","","3931.5","0.7","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C80 H78 Ag2 F6 N12 O6 S2 -","- C79.99 H78 Ag2 F5.97 N12 O5.99 S1.99 -","- C159.98 H156 Ag4 F11.94 N24 O11.98 S3.98 -","2","0.166667","","Su, Cheng-Yong; Cai, Yue-Peng; Chen, Chun-Long; Zhang, Hua-Xin; Kang, Bei-Sheng","Coordination-directed assembly of trigonal and tetragonal molecular boxes encapsulating anionic guests †","Journal of the Chemical Society, Dalton Transactions","2001","","4","359","","10.1039/b010118o","","","0.71073","MoKα","","0.1245","0.0716","","","0.1935","0.2409","","","","","","1.05","","","","has coordinates","179809","2020-10-21","18:00:00",""
"7014620","10.48","0.0003","10.48","0.0003","17.8377","0.0012","90","","90","","120","","1696.65","0.13","120","2","120","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C48 H62 Cl2 Co N12 O -","- C48 H36 Cl2 Co N12 O -","- C48 H36 Cl2 Co N12 O -","1","0.0833333","","Willans, Charlotte E.; French, Sara; Anderson, Kirsty M.; Barbour, Leonard J.; Gertenbach, Jan-André; Lloyd, Gareth O.; Dyer, Robert J.; Junk, Peter C.; Steed, Jonathan W.","Tripodal imidazole frameworks: Reversible vapour sorption both with and without significant structural changes.","Dalton transactions (Cambridge, England : 2003)","2011","40","3","573","582","10.1039/c0dt01011a","","","0.71073","MoKα","","0.2316","0.1289","","","0.3595","0.3939","","","","","","1.201","","","","has coordinates,has disorder","179850","2020-10-21","18:00:00",""
"7015725","14.396","0.0002","14.396","0.0002","35.383","0.0007","90","","90","","120","","6350.52","0.18","150","2","150","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C117.6 H144 Ag4 B4 F16 N12 O14.4 -","- C117.6 H144 Ag4 B4 F16 N12 O14.4 -","- C235.2 H288 Ag8 B8 F32 N24 O28.8 -","2","0.166667","","Burrows, Andrew D.; Kelly, David J.; Mahon, Mary F.; Raithby, Paul R.; Richardson, Christopher; Stevenson, Anna J.","Silver coordination networks and cages based on a semi-rigid bis(isoxazolyl) ligand.","Dalton transactions (Cambridge, England : 2003)","2011","40","20","5483","5493","10.1039/c1dt10029g","","","0.71073","MoKα","","0.1332","0.0594","","","0.105","0.1268","","","","","","1.058","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7016705","21.9769","0.0009","21.9769","0.0009","22.5791","0.0012","90","","90","","120","","9444.3","0.7","150","2","150","2","","","","","","","","5","P 63/m","-P 6c","176","2.40H2O","","","- C139 H195 Dy11 N30 O89 -","- C132 H86 Dy11 N30 O42 -","- C264 H172 Dy22 N60 O84 -","2","0.166667","","Miao, Yan-Li; Liu, Jun-Liang; Li, Jin-Yan; Leng, Ji-Dong; Ou, Yong-Cong; Tong, Ming-Liang","Two novel Dy(8) and Dy(11) clusters with cubane [Dy(4)(μ(3)-OH)(4)](8+) units exhibiting slow magnetic relaxation behaviour.","Dalton transactions (Cambridge, England : 2003)","2011","40","39","10229","10236","10.1039/c1dt10613a","","","0.71073","MoKα","","0.1044","0.063","","","0.1742","0.2112","","","","","","1.038","","","","has coordinates","179871","2020-10-21","18:00:00",""
"7018707","9.055","0.0003","9.055","0.0003","29.545","0.002","90","","90","","120","","2097.93","0.17","130","2","130","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- Cu2 Fe5 H44 Na3 O47 S8 -","- Cu2 Fe5 H42 Na3 O47 S8 -","- Cu4 Fe10 H84 Na6 O94 S16 -","2","0.166667","","Abrahams, Brendan F.; Abrahams, Carmel T.; Haywood, Marissa G.; Hudson, Timothy A.; Moubaraki, Boujemaa; Murray, Keith S.; Robson, Richard","3d-Metal derivatives of the [Cu(I)(SO(3))(4)](7-) ion: structure and magnetism.","Dalton transactions (Cambridge, England : 2003)","2012","41","14","4091","4099","10.1039/c2dt12337a","","","0.71073","MoKα","","0.0635","0.0619","","","0.133","0.1336","","","","","","1.388","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7018958","41.285","0.008","41.285","0.008","17.489","0.003","90","","90","","120","","25815","8","200","2","200","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C44 H17 Br N0 O13 Zn4 -","- C44 H20 Br O13 Zn4 -","- C264 H120 Br6 O78 Zn24 -","6","0.5","","Kim, Min; Boissonnault, Jake A.; Allen, Corinne A.; Dau, Phuong V.; Cohen, Seth M.","Functional tolerance in an isoreticular series of highly porous metal‒organic frameworks","Dalton Transactions","2012","41","20","6277","","10.1039/c2dt30120b","","","0.71073","MoKα","","0.143","0.0713","","","0.1745","0.1991","","","","","","0.862","","","","has coordinates","179893","2020-10-21","18:00:00",""
"7018959","41.247","0.007","41.247","0.007","17.447","0.003","90","","90","","120","","25706","8","200","2","200","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C42 H17 Cl N0 O13 Zn4 -","- C42 H17 Cl O13 Zn4 -","- C252 H102 Cl6 O78 Zn24 -","6","0.5","","Kim, Min; Boissonnault, Jake A.; Allen, Corinne A.; Dau, Phuong V.; Cohen, Seth M.","Functional tolerance in an isoreticular series of highly porous metal‒organic frameworks","Dalton Transactions","2012","41","20","6277","","10.1039/c2dt30120b","","","0.71073","MoKα","","0.1271","0.0966","","","0.2456","0.2671","","","","","","1.038","","","","has coordinates","179893","2020-10-21","18:00:00",""
"7018960","41.345","0.002","41.345","0.002","17.5177","0.0009","90","","90","","120","","25933","2","200","2","200","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C43.5 H18 I N0 O13 Zn4 -","- C42.2 H16 I0.6 O13 Zn4 -","- C253.2 H96 I3.6 O78 Zn24 -","6","0.5","","Kim, Min; Boissonnault, Jake A.; Allen, Corinne A.; Dau, Phuong V.; Cohen, Seth M.","Functional tolerance in an isoreticular series of highly porous metal‒organic frameworks","Dalton Transactions","2012","41","20","6277","","10.1039/c2dt30120b","","","0.71073","MoKα","","0.1266","0.0819","","","0.2308","0.264","","","","","","0.775","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7018961","41.336","0.003","41.336","0.003","17.554","0.003","90","","90","","120","","25975","5","200","2","200","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C44 H0 Br0.5 O13 Zn4 -","- C42.5 H16 Br0.48 O13 Zn4 -","- C255 H96 Br2.88 O78 Zn24 -","6","0.5","","Kim, Min; Boissonnault, Jake A.; Allen, Corinne A.; Dau, Phuong V.; Cohen, Seth M.","Functional tolerance in an isoreticular series of highly porous metal‒organic frameworks","Dalton Transactions","2012","41","20","6277","","10.1039/c2dt30120b","","","0.71073","MoKα","","0.119","0.0716","","","0.1895","0.2129","","","","","","1.05","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7018962","41.367","0.004","41.367","0.004","17.5389","0.0017","90","","90","","120","","25992","4","200","2","200","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C44 H0 O13 Zn4 -","- C42 H18 O13.5 Zn4 -","- C252 H108 O81 Zn24 -","6","0.5","","Kim, Min; Boissonnault, Jake A.; Allen, Corinne A.; Dau, Phuong V.; Cohen, Seth M.","Functional tolerance in an isoreticular series of highly porous metal‒organic frameworks","Dalton Transactions","2012","41","20","6277","","10.1039/c2dt30120b","","","0.71073","MoKα","","0.122","0.0683","","","0.1981","0.2385","","","","","","0.78","","","","has coordinates","179893","2020-10-21","18:00:00",""
"7018963","41.351","0.004","41.351","0.004","17.5266","0.0016","90","","90","","120","","25954","4","200","2","200","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C46 H0 O15 Zn4 -","- C45 H16 O15 Zn4 -","- C270 H96 O90 Zn24 -","6","0.5","","Kim, Min; Boissonnault, Jake A.; Allen, Corinne A.; Dau, Phuong V.; Cohen, Seth M.","Functional tolerance in an isoreticular series of highly porous metal–organic frameworks","Dalton Transactions","2012","41","20","6277","","10.1039/c2dt30120b","","","0.71073","MoKα","","0.0819","0.0621","","","0.179","0.196","","","","","","0.624","","","","has coordinates,has disorder","288645","2024-01-03","15:04:00",""
"7018964","41.283","0.003","41.283","0.003","17.5145","0.0011","90","","90","","120","","25851","3","200","2","200","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C46 H0 O14 Zn4 -","- C42 H16 O14 Zn4 -","- C252 H96 O84 Zn24 -","6","0.5","","Kim, Min; Boissonnault, Jake A.; Allen, Corinne A.; Dau, Phuong V.; Cohen, Seth M.","Functional tolerance in an isoreticular series of highly porous metal‒organic frameworks","Dalton Transactions","2012","41","20","6277","","10.1039/c2dt30120b","","","0.71073","MoKα","","0.1072","0.0653","","","0.1933","0.2193","","","","","","0.709","","","","has coordinates","179893","2020-10-21","18:00:00",""
"7019254","16.9356","0.0008","16.9356","0.0008","17.9643","0.0008","90","","90","","120","","4462.1","0.4","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","[N(ArCNHPh)3Cu]2[CuI3]","","","- C92 H81 Cu3 I3 N15 -","- C92 H81.06 Cu3 I3 N15 -","- C184 H162.12 Cu6 I6 N30 -","2","0.166667","","Scepaniak, Jeremiah J.; Wu, Guang; Hayton, Trevor W.","Complexes of Cu(i) supported by a tris(ketimine) tripod.","Dalton transactions (Cambridge, England : 2003)","2012","41","26","7859","7861","10.1039/c2dt30101f","","","0.71073","MoKα","","0.0606","0.0363","","","0.0884","0.0997","","","","","","1.02","","","","has coordinates","179896","2020-10-21","18:00:00",""
"7019427","18.5633","0.0017","18.5633","0.0017","14.3967","0.0013","90","","90","","120","","4296.4","0.7","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","","tris-[3,5,7-tri(1,2,4-triazol-4-yl)-1-azaadamantane]- dicadmium(II) Chloride Octacosahydrate","","- C45 H110 Cd2 Cl4 N30 O28 -","- C45 H54 Cd2 Cl N30 O3 -","- C90 H108 Cd4 Cl2 N60 O6 -","2","0.166667","","Senchyk, Ganna A.; Lysenko, Andrey B.; Boldog, Ishtvan; Rusanov, Eduard B.; Chernega, Alexander N.; Krautscheid, Harald; Domasevitch, Konstantin V.","1,2,4-Triazole functionalized adamantanes: a new library of polydentate tectons for designing structures of coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2012","41","28","8675","8689","10.1039/c2dt30362k","","","0.71073","MoKα","","0.1148","0.0655","","","0.1426","0.1566","","","","","","0.82","","","","has coordinates","288505","2023-12-22","15:12:03",""
"7019866","15.67","0.002","15.67","0.002","37.62","0.008","90","","90","","120","","8000","2","123","2","123","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C44 H90 B2 F8 Mn7 N4 O28 -","- C44 H89.97 B2 F8 Mn7 N4 O27.99 -","- C176 H359.88 B8 F32 Mn28 N16 O111.96 -","4","0.333333","","Langley, Stuart K.; Chilton, Nicholas F.; Moubaraki, Boujemaa; Murray, Keith S.","Unusual oxidation state distributions observed for two mixed-valence heptanuclear manganese disc-like clusters.","Dalton transactions (Cambridge, England : 2003)","2012","41","32","9789","9796","10.1039/c2dt30786c","","","0.71073","MoKα","","0.0885","0.0682","","","0.1534","0.1613","","","","","","1.105","","","","has coordinates,has disorder","179902","2020-10-21","18:00:00",""
"7021777","17.8546","0.0011","17.8546","0.0011","19.9647","0.0012","90","","90","","120","","5511.8","0.6","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H153 Mn2 N3 Na2 O21 -","- C120 H153 Mn2 N3 Na2 O21 -","- C240 H306 Mn4 N6 Na4 O42 -","2","0.166667","","Barrios, Leoní A; Borilovic, Ivana; Salinas Uber, Jorge; Aguilà, David; Roubeau, Olivier; Aromí, Guillem","A new type of paddle-wheel coordination complex.","Dalton transactions (Cambridge, England : 2003)","2013","42","34","12185","12192","10.1039/c3dt51232k","","","0.7749","synchrotron","","0.077","0.0593","","","0.1536","0.1692","","","","","","1.037","","","","has coordinates","179922","2020-10-21","18:00:00",""
"7021778","17.7486","0.0004","17.7486","0.0004","19.9938","0.0004","90","","90","","120","","5454.5","0.2","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C120 H153 Co2 N3 Na2 O21 -","- C120 H153 Co2 N3 Na2 O21 -","- C240 H306 Co4 N6 Na4 O42 -","2","0.166667","","Barrios, Leoní A; Borilovic, Ivana; Salinas Uber, Jorge; Aguilà, David; Roubeau, Olivier; Aromí, Guillem","A new type of paddle-wheel coordination complex.","Dalton transactions (Cambridge, England : 2003)","2013","42","34","12185","12192","10.1039/c3dt51232k","","","0.71073","MoKα","","0.0871","0.069","","","0.1586","0.1738","","","","","","1.059","","","","has coordinates","179922","2020-10-21","18:00:00",""
"7021886","24.559","0.003","24.559","0.003","17.082","0.002","90","","90","","120","","8922.6","1.9","298","2","298","2","","","","","","","","9","P 63/m","-P 6c","176","","","","- C18 H133 K3 La6 Mn3 N3 O185 S2 V39 -","- C18 K3 La6 Mn3 N3 O170 S2 V39 -","- C36 K6 La12 Mn6 N6 O340 S4 V78 -","2","0.166667","","Liu, Ding; Lu, Ying; Li, Yang-Guang; Tan, Hua-Qiao; Chen, Wei-Lin; Zhang, Zhi-Ming; Wang, En-Bo","Assembly of trimeric polyoxovanadate aggregates based on [MnV13O38](7-) building blocks and lanthanide cations.","Dalton transactions (Cambridge, England : 2003)","2013","42","40","14445","14453","10.1039/c3dt51250a","","","0.71073","MoKα","","0.0758","0.0502","","","0.1304","0.1415","","","","","","1.066","","","","has coordinates","179923","2020-10-21","18:00:00",""
"7021887","24.707","0.004","24.707","0.004","17.215","0.003","90","","90","","120","","9101","3","293","2","293","2","","","","","","","","9","P 63/m","-P 6c","176","","","","- C18 H109.5 Ce6 K1.5 Mn3 N3 O172.5 S2 V39 -","- C18 Ce6 K1.5 Mn3 N3 O172.56 S2 V39.03 -","- C36 Ce12 K3 Mn6 N6 O345.12 S4 V78.06 -","2","0.166667","","Liu, Ding; Lu, Ying; Li, Yang-Guang; Tan, Hua-Qiao; Chen, Wei-Lin; Zhang, Zhi-Ming; Wang, En-Bo","Assembly of trimeric polyoxovanadate aggregates based on [MnV13O38](7-) building blocks and lanthanide cations.","Dalton transactions (Cambridge, England : 2003)","2013","42","40","14445","14453","10.1039/c3dt51250a","","","0.71073","MoKα","","0.0905","0.0689","","","0.1721","0.1831","","","","","","0.988","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7021888","24.603","0.003","24.603","0.003","17.343","0.003","90","","90","","120","","9091","2","293","2","293","2","","","","","","","","9","P 63/m","-P 6c","176","","","","- C18 H107 K3 Mn3 N3 Nd6 O172 S2 V39 -","- C18 K3 Mn3 N3 Nd6 O172.01 S2 V39 -","- C36 K6 Mn6 N6 Nd12 O344.02 S4 V78 -","2","0.166667","","Liu, Ding; Lu, Ying; Li, Yang-Guang; Tan, Hua-Qiao; Chen, Wei-Lin; Zhang, Zhi-Ming; Wang, En-Bo","Assembly of trimeric polyoxovanadate aggregates based on [MnV13O38](7-) building blocks and lanthanide cations.","Dalton transactions (Cambridge, England : 2003)","2013","42","40","14445","14453","10.1039/c3dt51250a","","","0.71073","MoKα","","0.095","0.0724","","","0.1957","0.2099","","","","","","1.047","","","","has coordinates","179923","2020-10-21","18:00:00",""
"7022315","13.4107","0.0003","13.4107","0.0003","27.5678","0.0007","90","","90","","120","","4293.74","0.17","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C40 H160 N8 O126.87 P34 V18 -","- C39.96 H160.04 N8.04 O126.872 P34 V18 -","- C39.96 H160.04 N8.04 O126.872 P34 V18 -","1","0.0833333","","Orive, Joseba; Larrea, Edurne S.; Fernández de Luis, Roberto; Iglesias, Marta; Mesa, José L; Rojo, Teófilo; Arriortua, María I","Amine templated open-framework vanadium(III) phosphites with catalytic properties.","Dalton transactions (Cambridge, England : 2003)","2013","42","13","4500","4512","10.1039/c2dt32286b","","","0.71073","MoKα","","0.0555","0.0479","","","0.1355","0.1393","","","","","","1.057","","","","has coordinates,has disorder","179928","2020-10-21","18:00:00",""
"7022316","13.4578","0.0002","13.4578","0.0002","27.6928","0.0007","90","","90","","120","","4343.56","0.14","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C36 H148 N6 O121.82 P34 V18 -","- C36 H154 N6 O121.82 P34 V18 -","- C36 H154 N6 O121.82 P34 V18 -","1","0.0833333","","Orive, Joseba; Larrea, Edurne S.; Fernández de Luis, Roberto; Iglesias, Marta; Mesa, José L; Rojo, Teófilo; Arriortua, María I","Amine templated open-framework vanadium(III) phosphites with catalytic properties.","Dalton transactions (Cambridge, England : 2003)","2013","42","13","4500","4512","10.1039/c2dt32286b","","","0.71073","MoKα","","0.0705","0.0613","","","0.1749","0.1816","","","","","","1.077","","","","has coordinates,has disorder","179928","2020-10-21","18:00:00",""
"7022317","13.4125","0.0001","13.4125","0.0001","27.8003","0.0003","90","","90","","120","","4331.11","0.07","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C42 H148 N6 O120.68 P34 V18 -","- C42 H154 N6 O120.68 P34 V18 -","- C42 H154 N6 O120.68 P34 V18 -","1","0.0833333","","Orive, Joseba; Larrea, Edurne S.; Fernández de Luis, Roberto; Iglesias, Marta; Mesa, José L; Rojo, Teófilo; Arriortua, María I","Amine templated open-framework vanadium(III) phosphites with catalytic properties.","Dalton transactions (Cambridge, England : 2003)","2013","42","13","4500","4512","10.1039/c2dt32286b","","","1.54184","CuKα","","0.045","0.0438","","","0.128","0.1298","","","","","","1.096","","","","has coordinates,has disorder","179928","2020-10-21","18:00:00",""
"7023207","6.8842","0.0012","6.8842","0.0012","12.066","0.003","90","","90","","120","","495.22","0.17","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C6 F Li3 N6 O6 Sr2 -","- C6 F Li3 N6 O6 Sr2 -","- C12 F2 Li6 N12 O12 Sr4 -","2","0.166667","","Kalmutzki, Markus; Ströbele, Markus; Meyer, H-Jürgen","From cyanate to cyanurate: cyclotrimerization reactions towards the novel family of metal cyanurates.","Dalton transactions (Cambridge, England : 2003)","2013","42","36","12934","12939","10.1039/c3dt51002f","","","0.71073","MoKα","","0.028","0.0222","","","0.0495","0.0519","","","","","","1.127","","","","has coordinates","179937","2020-10-21","18:00:00",""
"7023418","19.3345","0.0005","19.3345","0.0005","14.6049","0.0004","90","","90","","120","","4728.2","0.2","93","","93","","","","","","","","","7","P 63/m","-P 6c","176","","","","- C23 H29.67 B2 Cl1.67 N15 O2.33 Ru2 -","- C23 H23 B2 Cl1.67 N15 O2.33 Ru2 -","- C138 H138 B12 Cl10.02 N90 O13.98 Ru12 -","6","0.5","","Arikawa, Yasuhiro; Ikeda, Ayumi; Matsumoto, Naoki; Umakoshi, Keisuke","Reactivity of a nitrosyl ligand on dinuclear ruthenium hydrotris(pyrazolyl)borato complexes toward a NO molecule.","Dalton transactions (Cambridge, England : 2003)","2013","42","32","11626","11631","10.1039/c3dt51319j","","","0.71075","MoKα","","","0.0255","","","","0.072","","","","","","1.045","","","","has coordinates","179939","2020-10-21","18:00:00",""
"7023935","15.1265","0.0004","15.1265","0.0004","12.5331","0.001","90","","90","","120","","2483.5","0.2","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C45 H33 Cu3 Mo4 N18 O12 -","- C45 H33 Cu3 Mo4 N18 O12 -","- C90 H66 Cu6 Mo8 N36 O24 -","2","0.166667","","Zhang, Xiutang; Fan, Liming; Zhang, Wei; Ding, Yuanshuai; Fan, Weiliu; Zhao, Xian","A highly photocatalytic polyoxomolybdate compound constructed from novel-type triple helix {Mo4O12}n chains and copper(i)-organic nets.","Dalton transactions (Cambridge, England : 2003)","2013","42","47","16562","16568","10.1039/c3dt52001c","","","0.71073","MoKα","","0.0674","0.0592","","","0.1048","0.1364","","","","","","0.997","","","","has coordinates","179944","2020-10-21","18:00:00",""
"7024998","12.4061","0.0001","12.4061","0.0001","28.8478","0.0006","90","","90","","120","","3845.16","0.09","150","","150","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C58 H88 Fe6 N6 Na3 O30 -","- C57 H84 Fe6 N6 Na3 O29 -","- C114 H168 Fe12 N12 Na6 O58 -","2","0.166667","","Mason, Kevin; Gass, Ian A.; Parsons, Simon; Collins, Anna; White, Fraser J.; Slawin, Alexandra M. Z.; Brechin, Euan K.; Tasker, Peter A.","Building Fe(III) clusters with derivatised salicylaldoximes.","Dalton transactions (Cambridge, England : 2003)","2010","39","10","2727","2734","10.1039/b924143d","","","0.71073","MoKα","","0.0532","0.0297","","0.0375","0.0322","0.0322","","","","","","0.9647","","","","has coordinates","179954","2020-10-21","18:00:00",""
"7025406","13.0752","0.0003","13.0752","0.0003","25.2402","0.0009","90","","90","","120","","3736.97","0.18","173","2","173","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C10 H6 Cu0.5 N3 O6 -","- C10 H6 Cu0.5 N3.00333 O6.00667 -","- C120 H72 Cu6 N36.04 O72.08 -","12","1","","Li, Xiao-Yan; Liu, Long-Qing; Ma, Ming-Liang; Zhao, Xiao-Li; Wen, Ke","Coordination-driven self-assembly of discrete and polymeric copper(ii) and dicopper(ii) supramolecular structures based on oxacalix[2]benzene[2]pyrazines.","Dalton transactions (Cambridge, England : 2003)","2010","39","37","8646","8651","10.1039/c000180e","","","0.71073","MoKα","","0.0951","0.0842","","","0.2433","0.2658","","","","","","1.087","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7025642","17.229","0.005","17.229","0.005","23.732","0.008","90","","90","","120","","6101","3","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30 H174 Ce2 Mn6 O88 P6 -","- C30 H99 Ce2 Mn6 O88 P6 -","- C60 H198 Ce4 Mn12 O176 P12 -","2","0.166667","","Wang, Mei; Yuan, Da-Qiang; Ma, Cheng-Bing; Yuan, Ming-Jian; Hu, Ming-Qiang; Li, Na; Chen, Hui; Chen, Chang-Neng; Liu, Qiu-Tian","The use of phosphonates for constructing 3d-4f clusters at high oxidation states: synthesis and characterization of two unusual heterometallic CeMn complexes.","Dalton transactions (Cambridge, England : 2003)","2010","39","31","7276","7285","10.1039/c002474k","","","0.71073","MoKα","","","0.0332","","","0.0855","0.0876","","","","","","1.13","","","","has coordinates","179962","2020-10-21","18:00:00",""
"7026274","10.3534","0.001","10.3534","0.001","21.751","0.004","90","","90","","120","","2019.2","0.5","200","2","200","2","","","","","","","","5","P 63/m","-P 6c","176","(Bis(?3-bromo)-tris(?4-bromo)-hexakis(2,2-dimethylaziridine) - hexacopper(i))bromide","[Bis(?3-bromo)-tris(?4-bromo)-hexakis(2,2-dimethylaziridine) -hexacopper(I)]bromide","","- C24 H54 Br6 Cu6 N6 -","- C24 H54 Br6 Cu6 N6 -","- C48 H108 Br12 Cu12 N12 -","2","0.166667","","Bobka, Roman; Roedel, J. Nicolas; Wirth, Stefan; Lorenz, Ingo-Peter","Reactions of Cu(I)Br with aziridine derivatives. Synthesis, characterization and crystal structures of monomeric, dimeric and hexameric aziridine (= az) complexes of the formal type [CuBr(az)2]n (n = 1, 2) and [CuBr(az)]6.","Dalton transactions (Cambridge, England : 2003)","2010","39","42","10142","10147","10.1039/c0dt00320d","","x-ray","0.71073","MoKα","","0.0327","0.0252","","","0.0558","0.0586","","","","","","1.079","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027164","15.709","0.001","15.709","0.001","23.705","0.001","90","","90","","120","","5066","0.5","196","2","196","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C75 H66 Au6 B3 Cl9 F6 O6 P6 -","- C75 H66 Au6 B3 Cl9 F6 O6 P6 -","- C150 H132 Au12 B6 Cl18 F12 O12 P12 -","2","0.166667","","Hollatz, Christian; Schier, Annette; Riede, Jürgen; Schmidbaur, Hubert","Self-assembly of triatomic gold units as supporting frames for a large gold diphenylphosphinite cage molecule†","Journal of the Chemical Society, Dalton Transactions","1999","","2","111","","10.1039/a808570f","","","0.71073","MoKα","","0.0762","0.0363","","0.1413","0.0954","","","","1.038","1.133","1.133","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7029602","13.458","0.001","13.458","0.001","20.967","0.001","90","","90","","120","","3288.7","0.4","123","2","123","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C57.74 H16.47 Cl1.47 F30 Fe3 N3 O13 -","- C57.735 H16.47 Cl1.47 F30 Fe3 N3 O13 -","- C115.47 H32.94 Cl2.94 F60 Fe6 N6 O26 -","2","0.166667","","Onaka, Satoru; Sakai, Yoichi; Ozeki, Tomoji; Nakamoto, Tadahiro; Kobayashi, Yusuke; Takahashi, Masashi; Ogiso, Ryo; Takayama, Tsutomu; Shiotsuka, Michito","Synthesis, structure and valence-trapping vs. detrapping for new trinuclear iron pentafluoro benzoate complexes: possible recognition of organic molecules by (57)Fe Mössbauer spectroscopy.","Dalton transactions (Cambridge, England : 2003)","2014","43","18","6711","6719","10.1039/c3dt53623h","","","0.71073","MoKα","","0.056","0.0439","","","0.128","0.1349","","","","","","0.997","","","","has coordinates","180002","2020-10-21","18:00:00",""
"7030077","21.8496","0.0016","21.8496","0.0016","44.606","0.004","90","","90","","120","","18442","3","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- B6 Na14 Ni8 O122 Si2 W18 -","- B6 Na13.5967 Ni8 O107.08 Si2 W18 -","- B36 Na81.58 Ni48 O642.48 Si12 W108 -","6","0.5","","Li, Shujun; Liu, Shuxia; Tang, Qun; Liu, Yiwei; He, Danfeng; Wang, Shengtian; Shi, Zhan","Borate-templated self-assembly of multinuclear nickel(II)-containing POMs.","Dalton transactions (Cambridge, England : 2003)","2013","42","37","13319","13322","10.1039/c3dt51201k","","","0.71073","MoKα","","0.0885","0.0633","","","0.1377","0.1478","","","","","","1.099","","","","has coordinates","180006","2020-10-21","18:00:00",""
"7030336","14.306","0.004","14.306","0.004","25.13","0.007","90","","90","","120","","4454","2","296","2","296","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C54 H36 Cu6 I5 N12 P2 S2 -","- C54 H36 Cu6 I5 N12 P2 S2 -","- C108 H72 Cu12 I10 N24 P4 S4 -","2","0.166667","","Yadav, Ashok; Srivastava, Anant Kumar; Balamurugan, Ayyakkalai; Boomishankar, Ramamoorthy","A cationic copper(i) iodide cluster MOF exhibiting unusual ligand assisted thermochromism.","Dalton transactions (Cambridge, England : 2003)","2014","43","22","8166","8169","10.1039/c4dt00050a","","","0.71073","MoKα","","0.0836","0.0549","","","0.1568","0.1684","","","","","","0.991","","","","has coordinates","180009","2020-10-21","18:00:00",""
"7030750","17.237","0.002","17.237","0.002","25.135","0.004","90","","90","","120","","6467.4","1.5","150","2","150","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C98 H164 Gd7 N6 O44 -","- C98 H120 Gd7 N6 O43.98 -","- C196 H240 Gd14 N12 O87.96 -","2","0.166667","","Mazarakioti, Eleni C.; Poole, Katye M.; Cunha-Silva, Luis; Christou, George; Stamatatos, Theocharis C.","A new family of Ln7 clusters with an ideal D3h metal-centered trigonal prismatic geometry, and SMM and photoluminescence behaviors.","Dalton transactions (Cambridge, England : 2003)","2014","43","30","11456","11460","10.1039/c4dt00976b","","","0.71073","MoKα","","0.042","0.0334","","","0.0764","0.078","","","","","","1.169","","","","has coordinates,has disorder","180013","2020-10-21","18:00:00",""
"7030751","15.7469","0.0009","15.7469","0.0009","27.835","0.003","90","","90","","120","","5977.4","0.8","150","2","150","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C90 H132 N6 O36 Tb7 -","- C90 H120 N6 O36 Tb7 -","- C180 H240 N12 O72 Tb14 -","2","0.166667","","Mazarakioti, Eleni C.; Poole, Katye M.; Cunha-Silva, Luis; Christou, George; Stamatatos, Theocharis C.","A new family of Ln7 clusters with an ideal D3h metal-centered trigonal prismatic geometry, and SMM and photoluminescence behaviors.","Dalton transactions (Cambridge, England : 2003)","2014","43","30","11456","11460","10.1039/c4dt00976b","","","0.71073","MoKα","","0.0957","0.0893","","","0.218","0.2228","","","","","","1.119","","","","has coordinates","180013","2020-10-21","18:00:00",""
"7030752","15.5912","0.0007","15.5912","0.0007","28.0106","0.0013","90","","90","","120","","5896.7","0.5","150","2","150","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C93 H144 Dy7 N6 O39 -","- C93 H144 Dy7 N6 O39 -","- C186 H288 Dy14 N12 O78 -","2","0.166667","","Mazarakioti, Eleni C.; Poole, Katye M.; Cunha-Silva, Luis; Christou, George; Stamatatos, Theocharis C.","A new family of Ln7 clusters with an ideal D3h metal-centered trigonal prismatic geometry, and SMM and photoluminescence behaviors.","Dalton transactions (Cambridge, England : 2003)","2014","43","30","11456","11460","10.1039/c4dt00976b","","","0.71073","MoKα","","0.0759","0.0726","","","0.1541","0.1554","","","","","","1.275","","","","has coordinates","180013","2020-10-21","18:00:00",""
"7031589","8.9753","0.0013","8.9753","0.0013","7.7356","0.0015","90","","90","","120","","539.66","0.15","153","2","153","2","","","","","","","","5","P 63/m","-P 6c","176","Ca3B5Be6O16F","","","- B5 Be6 Ca3 F O16 -","- B5 Be6 Ca3 F O16 -","- B10 Be12 Ca6 F2 O32 -","2","0.166667","","Yao, Wenjiao; Xu, Tao; Jiang, Xingxing; Huang, Hongwei; Wang, Xiaoyang; Lin, Zheshuai; Chen, Chuangtian","Ca3Be6B5O16F: the first alkaline-earth beryllium borate with fluorine anions.","Dalton transactions (Cambridge, England : 2003)","2014","43","26","9998","10004","10.1039/c4dt00775a","","","0.71073","MoKα","","0.0264","0.0259","","","0.0641","0.0644","","","","","","1.294","","","","has coordinates","180021","2020-10-21","18:00:00",""
"7031726","10.5484","0.0015","10.5484","0.0015","6.5261","0.0009","90","","90","","120","","628.87","0.15","293","","293","","","","","","","","high pressure synthesis","5","P 63/m","-P 6c","176","","","","- Co F Na2 O4 P -","- Co F Na2 O4 P -","- Co6 F6 Na12 O24 P6 -","6","0.5","","Ben Yahia, Hamdi; Mori, Daisuke; Shikano, Masahiro; Kobayashi, Hironori; Inaguma, Yoshiyuki","Structural, magnetic, and electrochemical properties of the high pressure form of Na2Co[PO4]F.","Dalton transactions (Cambridge, England : 2003)","2014","43","36","13630","13636","10.1039/c4dt01418a","","x-ray","0.71069","MoKα","","0.0621","0.0349","","","0.0727","0.087","","","","1.2","1.2","1.17","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7032207","9.66912","0.00035","9.66912","0.00035","6.85317","0.0003","90","","90","","120","","554.88","0.04","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","ellestadite","ellestadite","","- Ca9.82 Cl1.64 O24 S3 Si3 -","- Ca9.8328 Cl1.664 O24 S3 Si3 -","- Ca9.8328 Cl1.664 O24 S3 Si3 -","1","0.0833333","","Fang, Y. N.; Ritter, Clemens; White, T. J.","Crystal chemical characteristics of ellestadite-type apatite: implications for toxic metal immobilization.","Dalton transactions (Cambridge, England : 2003)","2014","43","42","16031","16043","10.1039/c4dt02088j","powder diffraction","","1.38994","neutron","","","","","","","","","0.032","0.77","","","","","","","has coordinates","180028","2020-10-21","18:00:00",""
"7032208","9.6622","0.0003","9.6622","0.0003","6.8438","0.0002","90","","90","","120","","553.32","0.03","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","ellestadite","ellestadite","","- Ca9.84 Cl1.67 O24 P1.2 S2.4 Si2.4 -","- Ca9.8356 Cl1.672 O24 P1.212 S2.394 Si2.394 -","- Ca9.8356 Cl1.672 O24 P1.212 S2.394 Si2.394 -","1","0.0833333","","Fang, Y. N.; Ritter, Clemens; White, T. J.","Crystal chemical characteristics of ellestadite-type apatite: implications for toxic metal immobilization.","Dalton transactions (Cambridge, England : 2003)","2014","43","42","16031","16043","10.1039/c4dt02088j","powder diffraction","","1.38994","neutron","","","","","","","","","0.028","0.59","","","","","","","has coordinates","180028","2020-10-21","18:00:00",""
"7032209","9.65368","0.0005","9.65368","0.0005","6.83542","0.00042","90","","90","","120","","551.67","0.05","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","ellestadite","ellestadite","","- Ca9.84 Cl1.68 O24 P1.94 S2.03 Si2.03 -","- Ca9.8326 Cl1.68 O24 P1.938 S2.028 Si2.028 -","- Ca9.8326 Cl1.68 O24 P1.938 S2.028 Si2.028 -","1","0.0833333","","Fang, Y. N.; Ritter, Clemens; White, T. J.","Crystal chemical characteristics of ellestadite-type apatite: implications for toxic metal immobilization.","Dalton transactions (Cambridge, England : 2003)","2014","43","42","16031","16043","10.1039/c4dt02088j","powder diffraction","","1.38994","neutron","","","","","","","","","0.022","0.64","","","","","","","has coordinates","180028","2020-10-21","18:00:00",""
"7032210","9.62574","0.00039","9.62574","0.00039","6.78918","0.00036","90","","90","","120","","544.77","0.04","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","ellestadite","ellestadite","","- Ca10 Cl2 O24 P4.67 S0.66 Si0.66 -","- Ca10 Cl2 O24 P4.668 S0.666 Si0.666 -","- Ca10 Cl2 O24 P4.668 S0.666 Si0.666 -","1","0.0833333","","Fang, Y. N.; Ritter, Clemens; White, T. J.","Crystal chemical characteristics of ellestadite-type apatite: implications for toxic metal immobilization.","Dalton transactions (Cambridge, England : 2003)","2014","43","42","16031","16043","10.1039/c4dt02088j","powder diffraction","","1.38994","neutron","","","","","","","","","0.021","0.77","","","","","","","has coordinates","180028","2020-10-21","18:00:00",""
"7032211","9.62986","0.00022","9.62986","0.00022","6.78332","0.00021","90","","90","","120","","544.77","0.02","298","","298","","","","","","","","","6","P 63/m","-P 6c","176","ellestadite","ellestadite","","- Ca10 Cl2 O24 P5.46 S0.27 Si0.27 -","- Ca10 Cl2 O24 P5.454 S0.27 Si0.27 -","- Ca10 Cl2 O24 P5.454 S0.27 Si0.27 -","1","0.0833333","","Fang, Y. N.; Ritter, Clemens; White, T. J.","Crystal chemical characteristics of ellestadite-type apatite: implications for toxic metal immobilization.","Dalton transactions (Cambridge, England : 2003)","2014","43","42","16031","16043","10.1039/c4dt02088j","powder diffraction","","1.38994","neutron","","","","","","","","","0.022","0.67","","","","","","","has coordinates","180028","2020-10-21","18:00:00",""
"7032212","9.61822","0.00016","9.61822","0.00016","6.79199","0.00015","90","","90","","120","","544.148","0.018","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","apatite","ellestadite","","- Ca10 Cl2 O24 P6 -","- Ca10 Cl2 O24 P6 -","- Ca10 Cl2 O24 P6 -","1","0.0833333","","Fang, Y. N.; Ritter, Clemens; White, T. J.","Crystal chemical characteristics of ellestadite-type apatite: implications for toxic metal immobilization.","Dalton transactions (Cambridge, England : 2003)","2014","43","42","16031","16043","10.1039/c4dt02088j","powder diffraction","","1.38994","neutron","","","","","","","","","0.029","0.69","","","","","","","has coordinates","180028","2020-10-21","18:00:00",""
"7033731","13.3404","0.0004","13.3404","0.0004","24.3913","0.0009","90","","90","","120","","3759.3","0.2","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C63 H57 Mn3 N24 Na2 O13 -","- C63 H57 Mn3 N24 Na2 O13 -","- C126 H114 Mn6 N48 Na4 O26 -","2","0.166667","","Giannopoulos, Dimosthenis P.; Wilson-Konderka, Cody; Gagnon, Kevin J.; Teat, Simon J.; Escuer, Albert; Metallinos, Costa; Stamatatos, Theocharis C.","Synthesis and first use of pyridine-2,6-diylbis(pyrazine-2-ylmethanone) in metal cluster chemistry: a {Mn(III)3Na2} complex with an ideal trigonal bipyramidal geometry.","Dalton transactions (Cambridge, England : 2003)","2015","44","9","4318","4327","10.1039/c4dt03666b","","","0.7749","synchrotron","","0.0644","0.0531","","","0.17","0.1809","","","","","","1.07","","","","has coordinates,has disorder","180043","2020-10-21","18:00:00",""
"7033733","18.2711","0.0008","18.2711","0.0008","13.4431","0.0012","90","","90","","120","","3886.5","0.4","298","2","298","2","","","","","","","","5","P 63/m","-P 6c","176","","[(Me2DABCO)5(Cu15Br24)Br]","","- C8 H18 Br25 Cu15 N2 -","- C8 H17.94 Br25 Cu15 N2 -","- C16 H35.88 Br50 Cu30 N4 -","2","0.166667","","Yao, Ru-Xin; Hailili, Reshalaiti; Cui, Xin; Wang, Li; Zhang, Xian-Ming","A perfectly aligned 63 helical tubular cuprous bromide single crystal for selective photo-catalysis, luminescence and sensing of nitro-explosives.","Dalton transactions (Cambridge, England : 2003)","2015","44","7","3410","3416","10.1039/c4dt03657c","","","0.71073","MoKα","","0.1273","0.0671","","","0.1653","0.1882","","","","","","1.014","","","","has coordinates,has disorder","180043","2020-10-21","18:00:00",""
"7034085","20.606","0.002","20.606","0.002","10.6403","0.0011","90","","90","","120","","3912.7","0.7","93","","93","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C48 H111 Au3 N12 P6 Se6 -","- C48 H117 Au3 N12 P6 Se6 -","- C96 H234 Au6 N24 P12 Se12 -","2","0.166667","","Nordheider, Andreas; Hüll, Katharina; Athukorala Arachchige, Kasun S.; Slawin, Alexandra M. Z.; Woollins, J. Derek; Thirumoorthi, Ramalingam; Chivers, Tristram","Spirocyclic, macrocyclic and ladder complexes of coinage metals and mercury with dichalcogeno P2N2-supported anions.","Dalton transactions (Cambridge, England : 2003)","2015","44","12","5338","5346","10.1039/c5dt00159e","","","0.71075","MoKα","","","0.0571","","","","0.1676","","","","","","1.08","","","","has coordinates","180046","2020-10-21","18:00:00",""
"7034598","20.4115","0.0017","20.4115","0.0017","25.444","0.002","90","","90","","120","","9180.5","1.3","296","2","296","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C16 H63.33 N9 O27.67 S4.67 V5 -","- C15.9999 H63.832 N9 O27.6667 S4.66667 V5 -","- C95.9994 H382.992 N54 O166 S28 V30 -","6","0.5","","Zhou, Shuai; Wan, Hongxiang; Hu, Gonghao; Zhang, Yu; Liu, Ying; Miao, Hao; Zhu, Dunru; Xu, Yan","A new vanadium sulfate with ferrimagnetic and NLO properties constructed from novel discrete umbrella-like [V(V)(μ3-O)4V(IV)4O5(SO4)4(en)](5-) anions.","Dalton transactions (Cambridge, England : 2003)","2015","44","18","8605","8608","10.1039/c5dt01026h","","","0.71073","MoKα","","0.1113","0.0694","","","0.1817","0.2063","","","","","","1.079","","","","has coordinates,has disorder","180051","2020-10-21","18:00:00",""
"7035952","16.7612","0.0016","16.7612","0.0016","6.898","0.0009","90","","90","","120","","1678.3","0.3","100","10","100","10","","","","","","","","5","P 63/m","-P 6c","176","","","","- C24 H13 N3 O10 Zn2 -","- C24 H12.9999 N3 O9.9999 Zn2 -","- C48 H25.9998 N6 O19.9998 Zn4 -","2","0.166667","","Zhang, Xiuling; Zhang, Yong-Zheng; Zhang, Da-Shuai; Zhu, Baoyong; Li, Jian-Rong","A hydrothermally stable Zn(ii)-based metal-organic framework: structural modulation and gas adsorption.","Dalton transactions (Cambridge, England : 2003)","2015","44","35","15697","15702","10.1039/c5dt01770j","","x-ray","1.54178","CuKα","","0.0745","0.0711","","","0.1998","0.2018","","","","","","1.124","","","","has coordinates","161269","2020-10-21","18:00:00",""
"7038732","15.3657","0.0004","15.3657","0.0004","17.7122","0.0005","90","","90","","120","","3621.66","0.17","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C54 H8 Ag16 N110 O27 -","- C54 H8.16 Ag16 N110 O27 -","- C54 H8.16 Ag16 N110 O27 -","1","0.0833333","","Qu, Xiao-Ni; Zhang, Sheng; Wang, Bo-Zhou; Yang, Qi; Han, Jing; Wei, Qing; Xie, Gang; Chen, San-Ping","An Ag(i) energetic metal-organic framework assembled with the energetic combination of furazan and tetrazole: synthesis, structure and energetic performance.","Dalton transactions (Cambridge, England : 2003)","2016","45","16","6968","6973","10.1039/c6dt00218h","","","0.71073","MoKα","","0.0605","0.0524","","","0.1395","0.1447","","","","","","1.047","","","","has coordinates,has disorder","182713","2020-10-21","18:00:00",""
"7038772","20.589","0.003","20.589","0.003","34.721","0.005","90","","90","","120","","12747","3","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C76 H80 Cl2 F8 Ir2 N6 O2 -","- C76 H80 Cl2 F8 Ir2 N6 O2 -","- C456 H480 Cl12 F48 Ir12 N36 O12 -","6","0.5","","Daniels, Ruth E.; Culham, Stacey; Hunter, Michael; Durrant, Marcus C.; Probert, Michael R.; Clegg, William; Williams, J. A. Gareth; Kozhevnikov, Valery N.","When two are better than one: bright phosphorescence from non-stereogenic dinuclear iridium(iii) complexes.","Dalton transactions (Cambridge, England : 2003)","2016","45","16","6949","6962","10.1039/c6dt00881j","","","0.6889","synchrotron","","0.0839","0.0566","","","0.1098","0.1266","","","","","","1.169","","","","has coordinates,has disorder","182708","2020-10-21","18:00:00",""
"7038851","9.65586","0.00014","9.65586","0.00014","7.15289","0.00012","90","","90","","120","","577.556","0.015","300","","300","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca2.87 La7.13 O26 Si6 -","- Ca2.868 La7.132 O26 Si6 -","- Ca2.868 La7.132 O26 Si6 -","1","0.0833333","","Yufei Xia; Jian Chen; Yan-gai Liu; Maxim S. Molokeev; Ming Guan; Zhaohui Huang; Minghao Fang","Crystal structure evolution and luminescence properties of color tunable solid solution phosphors Ca2+xLa8-x(SiO4)6-x(PO4)xO2:Eu2+","Dalton Transactions","2016","45","3","1007","1015","10.1039/C5DT03786G","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.27","7.655","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7038852","9.59484","0.00058","9.59484","0.00058","7.08819","0.00046","90","","90","","120","","565.12","0.06","300","","300","","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ca4.47 La5.53 O26 P2.47 Si3.53 -","- Ca4.466 La5.534 O26 P2.472 Si3.528 -","- Ca4.466 La5.534 O26 P2.472 Si3.528 -","1","0.0833333","","Yufei Xia; Jian Chen; Yan-gai Liu; Maxim S. Molokeev; Ming Guan; Zhaohui Huang; Minghao Fang","Crystal structure evolution and luminescence properties of color tunable solid solution phosphors Ca2+xLa8-x(SiO4)6-x(PO4)xO2:Eu2+","Dalton Transactions","2016","45","3","1007","1015","10.1039/C5DT03786G","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.17","8.474","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7038853","9.53251","0.00043","9.53251","0.00043","7.02062","0.00036","90","","90","","120","","552.49","0.05","300","","300","","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ca6.52 La3.48 O26 P4.52 Si1.48 -","- Ca6.5252 La3.4748 O26 P4.524 Si1.476 -","- Ca6.5252 La3.4748 O26 P4.524 Si1.476 -","1","0.0833333","","Yufei Xia; Jian Chen; Yan-gai Liu; Maxim S. Molokeev; Ming Guan; Zhaohui Huang; Minghao Fang","Crystal structure evolution and luminescence properties of color tunable solid solution phosphors Ca2+xLa8-x(SiO4)6-x(PO4)xO2:Eu2+","Dalton Transactions","2016","45","3","1007","1015","10.1039/C5DT03786G","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.79","7.874","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7038854","9.4606","0.00018","9.4606","0.00018","6.9356","0.00013","90","","90","","120","","537.591","0.018","300","","300","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca8.28 La1.72 O26 P6 -","- Ca8.281 La1.719 O26 P6 -","- Ca8.281 La1.719 O26 P6 -","1","0.0833333","","Yufei Xia; Jian Chen; Yan-gai Liu; Maxim S. Molokeev; Ming Guan; Zhaohui Huang; Minghao Fang","Crystal structure evolution and luminescence properties of color tunable solid solution phosphors Ca2+xLa8-x(SiO4)6-x(PO4)xO2:Eu2+","Dalton Transactions","2016","45","3","1007","1015","10.1039/C5DT03786G","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.78","7.598","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7042751","19.7716","0.0009","19.7716","0.0009","16.5975","0.0015","90","","90","","120","","5619","0.6","173","2","173","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C69 H96 Ge9 K4 N6 O39 W3 -","- C69 H96 Ge9 K4 N6 O39 W3 -","- C138 H192 Ge18 K8 N12 O78 W6 -","2","0.166667","","Wang, LuLu; Wang, Yi; li, zhenyu; Ruan, Huapeng; Xu, Li","[Ge9{M(CO)5}3]4-: Electrophilic Addition of M(CO)5 and [E9]4- Zintl anions (M = Cr, Mo, W) †","Dalton Trans.","2017","","","","","10.1039/C7DT01123G","","","0.71073","MoKα","","0.0681","0.0646","","","0.1277","0.1296","","","","","","1.184","","","","has coordinates","195682","2020-10-21","18:00:00",""
"7043737","13.9631","0.0004","13.9631","0.0004","21.1354","0.0014","90","","90","","120","","3568.7","0.3","298","2","298.15","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C48 H67.5 N18 Na2.5 Ni2 O25 -","- C48 H46 N18 Na2.5 Ni2 O25.0003 -","- C96 H92 N36 Na5 Ni4 O50.0006 -","2","0.166667","","Palacios, Maria A.; Morlieras, Jessica; Herrera, Juan Manuel; Mota, Antonio J.; Brechin, Euan K.; Triki, Smail; Colacio, Enrique","Synthetic ability of dinuclear mesocates containing 1,3-bis(diazinecarboxamide)benzene bridging ligands to form complexes of increased nuclearity. Crystal structures, magnetic properties and theoretical studies.","Dalton Trans.","2017","","","","","10.1039/C7DT02288C","","","0.71073","MoKα","","0.0593","0.0524","","","0.1582","0.165","","","","","","1.085","","","","has coordinates,has disorder","198908","2020-10-21","18:00:00",""
"7043990","16.2194","0.0007","16.2194","0.0007","26.9621","0.0015","90","","90","","120","","6142.6","0.5","200","2","200","","","","","","","","","5","P 63/m","-P 6c","176","","","","- C51 H75 Eu N4 O3 -","- C51 H75 Eu N4 O3 -","- C204 H300 Eu4 N16 O12 -","4","0.333333","","Lionetti, Davide; Day, Victor W.; Blakemore, James","Noncovalent immobilization and surface characterization of lanthanide complexes on carbon electrodes","Dalton Trans.","2017","","","","","10.1039/C7DT02577G","","","1.54178","CuKα","","0.0526","0.0482","","","0.1107","0.1126","","","","","","1.146","","","","has coordinates,has disorder","199832","2020-10-21","18:00:00",""
"7044387","15.1951","0.0011","15.1951","0.0011","23.091","0.002","90","","90","","120","","4617.2","0.6","296","2","296","2","","","","","","","","5","P 63/m","-P 6c","176","","InOF-15","","- C10.5 H6.5 In0.5 N O2.67 -","- C10.5 H6.5 In0.5 N O2.66667 -","- C126 H78 In6 N12 O32 -","12","1","","Qian, Jinjie; Li, Qipeng; Liang, Linfeng; Li, Ting-Ting; Hu, Yue; Huang, Shaoming","A microporous MOF with open metal sites and Lewis basic sites for selective CO2 capture","Dalton Trans.","2017","","","","","10.1039/C7DT03255B","","","0.71073","MoKα","","0.0518","0.0402","","","0.1277","0.133","","","","","","1.079","","","","has coordinates","201574","2020-10-21","18:00:00",""
"7045938","20.8723","0.0018","20.8723","0.0018","35.981","0.004","90","","90","","120","","13575","2","123","2","123","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C53 H137 In16 N15 O6 S35 Zn4 -","- C48.9983 H84.9966 In16 N12.9996 S35 Zn4 -","- C195.993 H339.986 In64 N51.9986 S140 Zn16 -","4","0.333333","","Yang, Dan-Dan; Li, Wei; Xiong, Wei-Wei; Li, Jian-Rong; Huang, Xiao-Ying","Ionothermal synthesis of discrete supertetrahedral Tn (n = 4, 5) clusters with tunable components, band gaps, and fluorescence properties.","Dalton transactions (Cambridge, England : 2003)","2018","47","17","5977","5984","10.1039/c8dt00524a","","","0.71073","MoKα","","0.0664","0.0623","","","0.1598","0.1639","","","","","","1.011","","","","has coordinates,has disorder","229547","2020-10-21","18:00:00",""
"7045939","20.851","0.006","20.851","0.006","36.27","0.015","90","","90","","120","","13656","8","123","2","123","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C53 H137 In16 Mn4 N15 O6 S35 -","- C48.9983 H84.9966 In16 Mn4 N12.9996 S35 -","- C195.993 H339.986 In64 Mn16 N51.9986 S140 -","4","0.333333","","Yang, Dan-Dan; Li, Wei; Xiong, Wei-Wei; Li, Jian-Rong; Huang, Xiao-Ying","Ionothermal synthesis of discrete supertetrahedral Tn (n = 4, 5) clusters with tunable components, band gaps, and fluorescence properties.","Dalton transactions (Cambridge, England : 2003)","2018","47","17","5977","5984","10.1039/c8dt00524a","","","0.71073","MoKα","","0.1113","0.1015","","","0.1684","0.1737","","","","","","1.011","","","","has coordinates,has disorder","229547","2020-10-21","18:00:00",""
"7045940","20.945","0.003","20.945","0.003","36.312","0.007","90","","90","","120","","13796","4","123","2","123","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C53 H137 Cd4 In16 N15 O6 S35 -","- C48.9983 H84.9966 Cd4 In16 N12.9996 S35 -","- C195.993 H339.986 Cd16 In64 N51.9986 S140 -","4","0.333333","","Yang, Dan-Dan; Li, Wei; Xiong, Wei-Wei; Li, Jian-Rong; Huang, Xiao-Ying","Ionothermal synthesis of discrete supertetrahedral Tn (n = 4, 5) clusters with tunable components, band gaps, and fluorescence properties.","Dalton transactions (Cambridge, England : 2003)","2018","47","17","5977","5984","10.1039/c8dt00524a","","","0.71073","MoKα","","0.0723","0.0692","","","0.1279","0.1298","","","","","","1.012","","","","has coordinates,has disorder","229547","2020-10-21","18:00:00",""
"7046617","18.438","0.004","18.438","0.004","18.792","0.004","90","","90","","120","","5533","2","293.15","","293.15","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C72 H84 Cl2 Cu9 N32 O24 -","- C72 H84 Cl2 Cu9 N32 O24 -","- C144 H168 Cl4 Cu18 N64 O48 -","2","0.166667","","Zheng, Tian-Rui; Qian, Lin-Lu; Li, Min; Wang, Zhi-Xiang; Li, Ke; Zhang, Ya-Qian; Li, Bao-Long; Wu, Bing","A bifunctional cationic metal-organic framework based on unprecedented nonanuclear copper(ii) cluster for high dichromate and chromate trapping and highly efficient photocatalytic degradation of organic dyes under visible light irradiation.","Dalton transactions (Cambridge, England : 2003)","2018","47","27","9103","9113","10.1039/c8dt01685b","","","0.71075","MoKα","","0.0543","0.0475","","","0.1162","0.1205","","","","","","1.072","","","","has coordinates,has disorder","229330","2020-10-21","18:00:00",""
"7049065","13.811","0.003","13.811","0.003","7.338","0.002","90","","90","","120","","1212.2","0.5","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C3 H18 F9 Gd O18 S3 -","- C3 H18 F9 Gd O18 S3 -","- C6 H36 F18 Gd2 O36 S6 -","2","0.166667","","Janicki, Rafał; Mondry, Anna","Structural and thermodynamic aspects of hydration of Gd(iii) systems.","Dalton transactions (Cambridge, England : 2003)","2019","48","10","3380","3391","10.1039/c8dt04869j","","","0.71073","MoKα","","0.0236","0.0202","","","0.0447","0.0469","","","","","","1.037","","","","has coordinates","223806","2020-10-21","18:00:00",""
"7049375","13.198","0.005","13.198","0.005","23.606","0.009","90","","90","","120","","3561","2","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C60 H72 Br6 N6 Ni3 -","- C60 H72 Br6 N6 Ni3 -","- C120 H144 Br12 N12 Ni6 -","2","0.166667","","Shen, Lingyi; Zhao, Yanxia; Luo, Qiong; Li, Qian-Shu; Liu, Bin; Redshaw, Carl; Wu, Biao; Yang, Xiao-Juan","Cyclotrimerization of alkynes catalyzed by a self-supported cyclic tri-nuclear nickel(0) complex with α-diimine ligands.","Dalton transactions (Cambridge, England : 2003)","2019","48","14","4643","4649","10.1039/c9dt00819e","","","0.71073","MoKα","","0.1348","0.0952","","","0.183","0.1967","","","","","","1.144","","","","has coordinates","224298","2020-10-21","18:00:00",""
"7049454","9.4001","0.0001","9.4001","0.0001","6.8744","0.0001","90","","90","","120","","526.054","0.011","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","","hydroxyapatite, Tb-doped","","- Ca4.755 O13 P3 Tb0.245 -","- Ca4.7549 O13 P3 Tb0.2448 -","- Ca9.5098 O26 P6 Tb0.4896 -","2","0.166667","","Kazin, Pavel E.; Zykin, Mikhail A.; Magdysyuk, Oxana V.; Utochnikova, Valentina V.; Gorbachev, Evgeny A.; Kremer, Reinhard K.; Schnelle, Walter; Felser, Claudia; Jansen, Martin","TbO<sup>+</sup> in a calcium apatite matrix featuring a triple trigger-type relaxation of magnetization.","Dalton transactions (Cambridge, England : 2003)","2019","48","16","5299","5307","10.1039/c9dt01120j","powder diffraction","x-ray","0.23369","synchrotron","","0.0423","0.0338","","0.0365","0.0354","","","","0.37","","","","","","","has coordinates","224189","2020-10-21","18:00:00",""
"7051718","13.645","0.002","13.645","0.002","22.394","0.001","90","","90","","120","","3610.8","0.8","150","2","150","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C54 H73 N13 O26 Zn2 -","- C54 H36 N12 O6 Zn2 -","- C108 H72 N24 O12 Zn4 -","2","0.166667","","Palacios, MaAngeles; Rodríguez-Diéguez, Antonio; Sironi, Angelo; Herrera, Juan Manuel; Mota, Antonio J.; Moreno, Virtudes; Cano, Joan; Colacio, Enrique","Double and triple stranded mesocates containing the bis(bidentate) bridging ligand 1,3-bis(pyridine-2-carboxamide)benzene. Structure, properties and DNA interaction","New Journal of Chemistry","2009","33","9","1901","","10.1039/b905330a","","","0.71073","MoKα","","0.0765","0.0606","","","0.1894","0.206","","","","","","0.852","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051719","13.6913","0.0019","13.6913","0.0019","22.13","0.004","90","","90","","120","","3592.5","1","150","2","150","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C54 H69 Cl N12 Ni2 O25 -","- C54 H36 N12 Ni2 O6 -","- C108 H72 N24 Ni4 O12 -","2","0.166667","","Palacios, MaAngeles; Rodríguez-Diéguez, Antonio; Sironi, Angelo; Herrera, Juan Manuel; Mota, Antonio J.; Moreno, Virtudes; Cano, Joan; Colacio, Enrique","Double and triple stranded mesocates containing the bis(bidentate) bridging ligand 1,3-bis(pyridine-2-carboxamide)benzene. Structure, properties and DNA interaction","New Journal of Chemistry","2009","33","9","1901","","10.1039/b905330a","","","0.71073","MoKα","","0.0585","0.0482","","","0.1638","0.1683","","","","","","1.108","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7054460","13.9035","0.001","13.9035","0.001","33.499","0.005","90","","90","","120","","5608","1","296","2","296","2","","","","","","","","8","P 63/m","-P 6c","176","0012ljm","","","- C6 H26 As2 N9 Na9 Ni3 O73 W18 -","- C6 H25.92 As2 N9 Na9 Ni3 O73 W18 -","- C12 H51.84 As4 N18 Na18 Ni6 O146 W36 -","2","0.166667","","Liu, Jia-min; Wang, Lu; Yu, Kai; Su, Zhan-hua; Wang, Chun-xiao; Wang, Chun-mei; Zhou, Bai-bin","Synthesis, crystal structure and properties of sandwich type compounds based on {AsW9} and a hexa-nuclear unit with three supporting TM‒triazole complexes","New J. Chem.","2015","39","2","1139","","10.1039/C4NJ01138D","","","0.71073","MoKα","","0.0759","0.0574","","","0.0928","0.1091","","","","","","1.074","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054461","13.9494","0.0008","13.9494","0.0008","33.76","0.004","90","","90","","120","","5689.1","0.8","296","2","296","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C6 H37 As2 Mn3 N9 Na9 O78.5 W18 -","- C6 H36.96 As2 Mn3 N9 Na9 O78.5 W18 -","- C12 H73.92 As4 Mn6 N18 Na18 O157 W36 -","2","0.166667","","Liu, Jia-min; Wang, Lu; Yu, Kai; Su, Zhan-hua; Wang, Chun-xiao; Wang, Chun-mei; Zhou, Bai-bin","Synthesis, crystal structure and properties of sandwich type compounds based on {AsW9} and a hexa-nuclear unit with three supporting TM‒triazole complexes","New J. Chem.","2015","39","2","1139","","10.1039/C4NJ01138D","","","0.71073","MoKα","","0.0682","0.0433","","","0.1012","0.119","","","","","","1.045","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054462","13.9307","0.0005","13.9307","0.0005","33.554","0.003","90","","90","","120","","5639.2","0.6","296","2","296","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C6 H34 As2 Co3 N9 Na9 O77 W18 -","- C6 H30.96 As2 Co3 N9 Na9 O77 W18 -","- C12 H61.92 As4 Co6 N18 Na18 O154 W36 -","2","0.166667","","Liu, Jia-min; Wang, Lu; Yu, Kai; Su, Zhan-hua; Wang, Chun-xiao; Wang, Chun-mei; Zhou, Bai-bin","Synthesis, crystal structure and properties of sandwich type compounds based on {AsW9} and a hexa-nuclear unit with three supporting TM‒triazole complexes","New J. Chem.","2015","39","2","1139","","10.1039/C4NJ01138D","","","0.71073","MoKα","","0.0686","0.0457","","","0.0932","0.1013","","","","","","1.051","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7055906","19.963","0.005","19.963","0.005","15.819","0.005","90","","90","","120","","5460","3","273","2","273","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C34 H33 Cl2 N2 O P Ru S2 -","- C34 H31 Cl2 N2 O P Ru S2 -","- C204 H186 Cl12 N12 O6 P6 Ru6 S12 -","6","0.5","","Saha, Pinaki; Samanta, Debasish; Ghosh, Prasanta","Glyoxalbis(2-methylmercaptoanil) complexes of nickel and ruthenium: radical versus non-radical states","New J. Chem.","2017","41","3","1149","","10.1039/C6NJ02903E","","","0.71073","MoKα","","0.0704","0.0532","","","0.1523","0.1773","","","","","","1.061","","","","has coordinates,has disorder","191707","2020-10-21","18:00:00",""
"7057922","20.054","0.003","20.054","0.003","30.43","0.005","90","","90","","120","","10598","3","292","2","292.54","","","","","","","","","5","P 63/m","-P 6c","176","","","","- C52.5 H65.5 N16 O17.5 Zn4 -","- C33 H15 N9 O12 Zn4 -","- C132 H60 N36 O48 Zn16 -","4","0.333333","","Xie, Wei; Yao, Chan; Shao, Kui-Zhan; Xu, Yan-Hong; Su, Zhong-Min","Controllable synthesis of isoreticular pillared-layer MOFs based on N-rich triangular prism building units: gas adsorption and luminescent properties","New Journal of Chemistry","2018","42","24","20056","","10.1039/C8NJ04260H","","","0.71073","MoKα","","0.0459","0.0348","","","0.085","0.0915","","","","","","1.04","","","","has coordinates,has disorder","230173","2020-10-21","18:00:00",""
"7059626","17.3782","0.0008","17.3782","0.0008","5.8377","0.0003","90","","90","","120","","1526.8","0.13","296","2","296","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- F63 K18 Ta5.18 Zr4.82 -","- F63 K18 Ta5.18 Zr4.82 -","- F63 K18 Ta5.18 Zr4.82 -","1","0.0833333","","Boča, Miroslav; Molokeev, Maxim; Rakhmatullin, Aydar; Kubíková, Blanka; Netriová, Zuzana","The structure of the metastable K18Ta5Zr5F63 phase","New Journal of Chemistry","2020","44","22","9264","9270","10.1039/D0NJ02428G","","","0.71073","MoKα","","0.0873","0.0855","","","0.2241","0.2251","","","","","","1.223","","","","has coordinates","257669","2020-10-21","18:00:00",""
"7060421","14.6919","0.0005","14.6919","0.0005","6.9649","0.0003","90","","90","","120","","1301.97","0.08","120","2","120","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C27 H34 S3 Si -","- C27 H34 S3 Si -","- C54 H68 S6 Si2 -","2","0.166667","","Anisimov, Anton A.; Temnikov, Maxim N.; Krizhanovskiy, Ilya; Timoshina, Ekaterina I.; Milenin, Sergey A.; Peregudov, Alexander S.; Dolgushin, Fedor M.; Muzafarov, Aziz M.","A thiol‒ene click reaction with preservation of the Si‒H bond: a new approach for the synthesis of functional organosilicon compounds","New Journal of Chemistry","2021","45","13","5764","5769","10.1039/D1NJ00411E","","","0.71073","MoKα","","0.033","0.0324","","","0.0838","0.0843","","","","","","1.045","","","","has coordinates","264926","2021-05-05","08:55:57",""
"7100264","15.0206","0.0017","15.0206","0.0017","16.869","0.0016","90","","90","","120","","3296.1","0.6","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C64 H110 N6 Na O4 Si3 -","- C63.96 H78 N6 Na O4 Si3 -","- C127.92 H156 N12 Na2 O8 Si6 -","2","0.166667","","","","Chemical Communications","2005","","","","","10.1039/b509310d","","","","","","","","","","","","","","","","","","","","","has coordinates","277870","2022-09-15","11:09:05",""
"7100850","9.47294","0.00022","9.47294","0.00022","17.57073","0.00051","90","","90","","120","","1365.49","0.074","295","","295","","","","","","","","","6","P 63/m","-P 6c","176","tricloro-hexaacetonyl-bisplatinum(iv) potassium salt","","","- C18 H30 Cl3 K O6 Pt2 -","- C18 H30 Cl3 K O6 Pt2 -","- C36 H60 Cl6 K2 O12 Pt4 -","2","0.166667","","J. Vicente; A. Arcas; J.M. Fernandez-Hernandez; A. Sironi","An unprecedented process involving a normal and redox transmetallation reactions between Hg and Pt, affording the unexpected K[PtIV2(CH2C(O)Me)6(mu-Cl)3] complex. The key role of X-ray powder diffraction in unravelling its nature and structure.","Chemical Communications","2005","","","","","10.1039/b416261g","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101659","11.454","0.005","11.454","0.005","10.16","0.005","90","","90","","120","","1154.4","0.9","298","2","296","2","","","","","","","","5","P 63/m","-P 6c","176","tris-o-phenylenedioxyspirocyclotriphosphazene","","","- C18 H12 N3 O6 P3 -","- C18 H12 N3 O6 P3 -","- C36 H24 N6 O12 P6 -","2","0.166667","","Comotti, Angiolina; Bracco, Silvia; Ferretti, Lisa; Mauri, Michele; Simonutti, Roberto; Sozzani, Piero","A single-crystal imprints macroscopic orientation on xenon atoms.","Chemical communications (Cambridge, England)","2007","","4","350","352","10.1039/b612002d","","","0.71069","MoKα","","0.192","0.0856","","","0.1246","0.3027","","","","","","1.447","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7102564","22.9483","0.0011","22.9483","0.0011","16.198","0.0012","90","","90","","120","","7387.4","0.7","90","1","90","1","","","","","","","","4","P 63/m","-P 6c","176","","","","- C168 H172 N12 O26 -","- C168 H172.02 N12 O26 -","- C336 H344.04 N24 O52 -","2","0.166667","","Ma, Bao-Qing; Coppens, Philip","Symmetry induced supramolecular assembly of a resorcinarene trimeric molecular box.","Chemical communications (Cambridge, England)","2004","","8","932","933","10.1039/b315091g","","","0.71073","MoKα","","0.1096","0.0656","","","0.1676","0.1962","","","","","","1.07","","","","has coordinates","180127","2020-10-21","18:00:00",""
"7102565","22.9898","0.001","22.9898","0.001","16.4458","0.001","90","","90","","120","","7527.6","0.7","90","1","90","1","","","","","","","","4","P 63/m","-P 6c","176","","","","- C176 H188 N12 O26 -","- C176.04 H148.02 N12 O26 -","- C352.08 H296.04 N24 O52 -","2","0.166667","","Ma, Bao-Qing; Coppens, Philip","Symmetry induced supramolecular assembly of a resorcinarene trimeric molecular box.","Chemical communications (Cambridge, England)","2004","","8","932","933","10.1039/b315091g","","","0.71073","MoKα","","0.2297","0.0914","","","0.2247","0.3206","","","","","","1.022","","","","has coordinates","180127","2020-10-21","18:00:00",""
"7102566","23.0604","0.0011","23.0604","0.0011","16.2247","0.0013","90","","90","","120","","7472.1","0.8","90","1","90","1","","","","","","","","4","P 63/m","-P 6c","176","","","","- C168 H196 N12 O26 -","- C168 H184.02 N12 O26 -","- C336 H368.04 N24 O52 -","2","0.166667","","Ma, Bao-Qing; Coppens, Philip","Symmetry induced supramolecular assembly of a resorcinarene trimeric molecular box.","Chemical communications (Cambridge, England)","2004","","8","932","933","10.1039/b315091g","","","0.71073","MoKα","","0.0876","0.0547","","","0.14","0.1714","","","","","","1.029","","","","has coordinates","180127","2020-10-21","18:00:00",""
"7103052","10.7052","0.0002","10.7052","0.0002","22.9656","0.0007","90","","90","","120","","2279.28","0.09","90","2","90","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C10 H17 Cl Fe2 N12.5 O15 -","- C9 H12 Cl Fe2 N12 O13.995 -","- C36 H48 Cl4 Fe8 N48 O55.98 -","4","0.333333","","Bai, Yue-Ling; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun; Zheng, Shao-Liang; Oshida, Kazuyoshi; Einaga, Yasuaki","Pressure effects and Mössbauer spectroscopic studies on a 3D mixed-valence iron spin-crossover complex with NiAs topology.","Chemical communications (Cambridge, England)","2008","","15","1753","1755","10.1039/b718456e","","","0.71073","MoKα","","0.0526","0.0456","","","0.1274","0.1333","","","","","","1.113","","","","has coordinates,has disorder","180132","2020-10-21","18:00:00",""
"7103053","10.7401","0.0003","10.74","","23.0238","0.0006","90","","90","","120","","2299.98","0.09","150","2","150","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C10 H17 Cl Fe2 N12.5 O15 -","- C9 H12 Cl Fe2 N12 O13.99 -","- C36 H48 Cl4 Fe8 N48 O55.96 -","4","0.333333","","Bai, Yue-Ling; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun; Zheng, Shao-Liang; Oshida, Kazuyoshi; Einaga, Yasuaki","Pressure effects and Mössbauer spectroscopic studies on a 3D mixed-valence iron spin-crossover complex with NiAs topology.","Chemical communications (Cambridge, England)","2008","","15","1753","1755","10.1039/b718456e","","","0.71073","MoKα","","0.0582","0.0502","","","0.1539","0.1623","","","","","","1.144","","","","has coordinates,has disorder","180132","2020-10-21","18:00:00",""
"7103054","10.8575","0.0002","10.858","","23.1037","0.0004","90","","90","","120","","2358.69","0.06","210","2","210","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C10 H17 Cl Fe2 N12.5 O15 -","- C9 H12 Cl Fe2 N12 O13.995 -","- C36 H48 Cl4 Fe8 N48 O55.98 -","4","0.333333","","Bai, Yue-Ling; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun; Zheng, Shao-Liang; Oshida, Kazuyoshi; Einaga, Yasuaki","Pressure effects and Mössbauer spectroscopic studies on a 3D mixed-valence iron spin-crossover complex with NiAs topology.","Chemical communications (Cambridge, England)","2008","","15","1753","1755","10.1039/b718456e","","","0.71073","MoKα","","0.0587","0.0509","","","0.1762","0.1829","","","","","","1.206","","","","has coordinates,has disorder","180132","2020-10-21","18:00:00",""
"7103055","10.8858","0.0002","10.886","","23.1388","0.0005","90","","90","","120","","2374.61","0.07","270","2","270","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C10 H17 Cl Fe2 N12.5 O15 -","- C9 H12 Cl Fe2 N12 O13.995 -","- C36 H48 Cl4 Fe8 N48 O55.98 -","4","0.333333","","Bai, Yue-Ling; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun; Zheng, Shao-Liang; Oshida, Kazuyoshi; Einaga, Yasuaki","Pressure effects and Mössbauer spectroscopic studies on a 3D mixed-valence iron spin-crossover complex with NiAs topology.","Chemical communications (Cambridge, England)","2008","","15","1753","1755","10.1039/b718456e","","","0.71073","MoKα","","0.0596","0.0509","","","0.1489","0.1561","","","","","","1.138","","","","has coordinates,has disorder","180132","2020-10-21","18:00:00",""
"7103056","11.036","0.006","11.036","","22.991","0.015","90","","90","","120","","2425.2","1.9","330","2","330","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C10 H17 Cl Fe2 N12.5 O15 -","- C9 H12 Cl Fe2 N12 O14.005 -","- C36 H48 Cl4 Fe8 N48 O56.02 -","4","0.333333","","Bai, Yue-Ling; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun; Zheng, Shao-Liang; Oshida, Kazuyoshi; Einaga, Yasuaki","Pressure effects and Mössbauer spectroscopic studies on a 3D mixed-valence iron spin-crossover complex with NiAs topology.","Chemical communications (Cambridge, England)","2008","","15","1753","1755","10.1039/b718456e","","","0.71073","MoKα","","0.0666","0.0564","","","0.1713","0.1799","","","","","","1.131","","","","has coordinates,has disorder","180132","2020-10-21","18:00:00",""
"7103324","12.5396","0.0003","12.5396","0.0003","13.9133","0.0006","90","","90","","120","","1894.65","0.1","294","2","294","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C15 H34 Cl2 Cu9 N21 O17.5 -","- C15 H34.14 Cl2 Cu9 N21 O17.53 -","- C30 H68.28 Cl4 Cu18 N42 O35.06 -","2","0.166667","","Huang, Xiao-Chun; Luo, Wei; Shen, Yu-Feng; Lin, Xin-Jian; Li, Dan","A metal-organic framework containing discrete single-walled nanotubes based on curved trinuclear [Cu3(micro3-O)(micro-OH)(triazolate)2]+ building blocks.","Chemical communications (Cambridge, England)","2008","","34","3995","3997","10.1039/b808240e","","","0.71073","MoKα","","0.0306","0.0295","","","0.0813","0.0825","","","","","","1.038","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7103371","20.3002","0.001","20.3002","0.001","22.1","0.002","90","","90","","120","","7887","0.9","149","2","150","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C85 H229 Ge20 Li3 O7 Si19 -","- C84.99 H229.05 Ge20 Li3 O6.99 Si19 -","- C169.98 H458.1 Ge40 Li6 O13.98 Si38 -","2","0.166667","","Schenk, Christian; Schnepf, Andreas","Ge(14)[Ge(SiMe(3))(3)](5)Li(3)(THF)(6): the largest metalloid cluster compound of germanium: on the way to fullerene-like compounds?","Chemical communications (Cambridge, England)","2008","","38","4643","4645","10.1039/b808279k","","","0.8","synchrotron","","0.0567","0.0457","","","0.112","0.1161","","","","","","1.067","","","","has coordinates,has disorder","180136","2020-10-21","18:00:00",""
"7103387","19.0945","0.0016","19.0945","0.0016","11.0133","0.0009","90","","90","","120","","3477.5","0.5","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C5 H23 As3 N2 O19 V3 -","- C5 H16 As3 N2 O19 V3 -","- C30 H96 As18 N12 O114 V18 -","6","0.5","","Berrocal, Teresa; Mesa, José L; Pizarro, José L; Bazán, Begoña; Iglesias, Marta; Aguayo, Andrés T; Arriortua, María I; Rojo, Teófilo","Microporous vanadyl-arsenate with the template incorporated exhibiting sorption and catalytic properties.","Chemical communications (Cambridge, England)","2008","","39","4738","4740","10.1039/b807250g","","","0.71073","MoKα","","0.0693","0.0403","","","0.0669","0.0725","","","","","","0.876","","","","has coordinates","180136","2020-10-21","18:00:00",""
"7103395","16.559","0.0018","16.559","0.0018","8.4752","0.0009","90","","90","","120","","2012.6","0.4","190","2","190","2","","","","","","","","5","P 63/m","-P 6c","176","Benzene-1,3,5-tricarboxylic acid tris(4-iodophenyl) ester pyridine solvate","Benzene-1,3,5-tricarboxylic acid tris(4-iodophenyl) ester pyridine solvate","","- C42 H30 I3 N3 O6 -","- C42 H30 I3 N3 O6 -","- C84 H60 I6 N6 O12 -","2","0.166667","","Pigge, F Christopher; Vangala, Venu R; Kapadia, Pradeep P; Swenson, Dale C; Rath, Nigam P","Hexagonal crystalline inclusion complexes of 4-iodophenoxy trimesoate.","Chemical communications (Cambridge, England)","2008","","39","4726","4728","10.1039/b809592b","","","0.71073","MoKα","","0.0563","0.047","","","0.1313","0.1383","","","","","","1.061","","","","has coordinates,has disorder","180136","2020-10-21","18:00:00",""
"7103396","16.5473","0.0017","16.5473","0.0017","8.438","0.0009","90","","90","","120","","2000.9","0.4","200","2","200","2","","","","","","","","4","P 63/m","-P 6c","176","Benzene-1,3,5-tricarboxylic acid tris(4-iodophenyl) ester benzene solvate","Benzene-1,3,5-tricarboxylic acid tris(4-iodophenyl) ester benzene solvate","","- C36 H24 I3 O6 -","- C36 H24 I3 O6 -","- C72 H48 I6 O12 -","2","0.166667","","Pigge, F Christopher; Vangala, Venu R; Kapadia, Pradeep P; Swenson, Dale C; Rath, Nigam P","Hexagonal crystalline inclusion complexes of 4-iodophenoxy trimesoate.","Chemical communications (Cambridge, England)","2008","","39","4726","4728","10.1039/b809592b","","","0.71073","MoKα","","0.0466","0.0385","","","0.1037","0.1101","","","","","","1.056","","","","has coordinates,has disorder","180136","2020-10-21","18:00:00",""
"7104968","12.7445","0.001","12.7445","0.001","19.393","0.002","90","","90","","120","","2727.9","0.4","100","0.5","100","0.5","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30 H61 Cl8 N8 O2.5 S3 -","- C30 H56 Cl8 N8 S3 -","- C60 H112 Cl16 N16 S6 -","2","0.166667","","Saeed, Musabbir A; Fronczek, Frank R; Hossain, Md Alamgir","Encapsulated chloride coordinating with two in?in protons of bridgehead amines in an octaprotonated azacryptand.","Chemical communications (Cambridge, England)","2009","","42","6409","6411","10.1039/b916099j","","","0.71073","MoKα","","0.048","0.039","","","0.096","0.1","","","","","","1.106","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7105038","15.0249","0.0011","15.0249","0.0011","24.422","0.002","90","","90","","120","","4774.6","0.6","173","0.1","173","0.1","","","","","","","","4","P 63/m","-P 6c","176","","","","- C81 H90 Fe2 N12 -","- C81 H90 Fe2 N12 -","- C162 H180 Fe4 N24 -","2","0.166667","","Zhang, Zhan; Dolphin, David","A triple-stranded helicate and mesocate from the same metal and ligand.","Chemical communications (Cambridge, England)","2009","","45","6931","6933","10.1039/b913231g","","","0.71069","MoKα","","0.0517","0.0379","","","0.1066","0.1148","","","","","","1.167","","","","has coordinates,has disorder","180154","2020-10-21","18:00:00",""
"7105040","15.0431","0.0008","15.0431","0.0008","24.4","0.002","90","","90","","120","","4781.8","0.6","173","0.1","173","0.1","","","","","","","","4","P 63/m","-P 6c","176","","","","- C81 H90 Co2 N12 -","- C81 H90 Co2 N12 -","- C162 H180 Co4 N24 -","2","0.166667","","Zhang, Zhan; Dolphin, David","A triple-stranded helicate and mesocate from the same metal and ligand.","Chemical communications (Cambridge, England)","2009","","45","6931","6933","10.1039/b913231g","","","0.71073","MoKα","","0.0408","0.0332","","","0.088","0.0906","","","","","","1.087","","","","has coordinates,has disorder","180154","2020-10-21","18:00:00",""
"7105431","30.7308","0.0012","30.7308","0.0012","18.522","0.0015","90","","90","","120","","15148.4","1.5","173","2","173","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C16.67 H85.67 Mn4.33 N5.33 Na0 O81 P2 W15 -","- C12 H11 Mn4.33333 N3 O75.5 P2 W15 -","- C72 H66 Mn26 N18 O453 P12 W90 -","6","0.5","","Fang, Xikui; Speldrich, Manfred; Schilder, Helmut; Cao, Rui; O'Halloran, Kevin P; Hill, Craig L; Kögerler, Paul","Switching slow relaxation in a Mn(III)(3)Mn(IV) cluster: an example of grafting single-molecule magnets onto polyoxometalates.","Chemical communications (Cambridge, England)","2010","46","16","2760","2762","10.1039/b925947c","","","0.71073","MoKα","","0.1131","0.0532","","","0.1135","0.1383","","","","","","1.019","","","","has coordinates,has disorder","180158","2020-10-21","18:00:00",""
"7106417","32.3426","0.0008","32.3426","0.0008","10.6928","0.0004","90","","90","","120","","9686.6","0.5","120","2","120","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- As12 F27 O99.69 V36 -","- As12 F27 O99.69 V36 -","- As24 F54 O199.38 V72 -","2","0.166667","","Eleni Kotsapa; Mark T. Weller","Vanadium fluoroarsenates-folding sheets into highly corrugated layers and crystalline arrays of large inorganic tubes","Chem.Commun.","2011","47","21","6132","6134","10.1039/c1cc11513h","","","0.71073","MoKα","","0.1736","0.1006","","","0.2663","0.295","","","","","","0.945","","","","has coordinates,has disorder","180168","2020-10-21","18:00:00",""
"7106550","12.0292","0.0004","12.0292","0.0003","32.9777","0.0007","90","","90","","120","","4132.61","0.19","233","2","233","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30 H90 I10 Na4 O15 S15 -","- C30 H90 I10 Na4 O15 S15 -","- C60 H180 I20 Na8 O30 S30 -","2","0.166667","","Alvaro Duarte-Ruiz; Nelson Nunez-Dallos; Luis Garzon-Tovar; Klaus Wurst; Eliseo Avella-Moreno; Fernando Gomez-Baquero","Synthesis and structure of [Na4(DMSO)15][(I3)3(I)]. Self-assembly of hexacoordinated sodium","Chem.Commun.","2011","47","","7110","","10.1039/c1cc11898f","","","0.71073","MoKα","","0.0548","0.0352","","","0.0833","0.0902","","","","","","1.081","","","","has coordinates","180169","2020-10-21","18:00:00",""
"7107642","16.5789","0.0008","16.5789","0.0008","19.1248","0.0009","90","","90","","120","","4552.4","0.4","120","","120","","","","","","","","","4","P 63/m","-P 6c","176","","","","- C42 H45 N4.5 O9 -","- C40.5 H45 N3.75 O9 -","- C162 H180 N15 O36 -","4","0.333333","","Noriko Fujimoto; Mio Matsumura; Isao Azumaya; Shizuka Nishiyama; Hyuma Masu; Hiroyuki Kagechika; Aya Tanatani","Molecular chirality and chiral capsule-type dimer formation of cyclic triamides via hydrogen-bonding interactions","Chem.Commun.","2012","48","","4809","","10.1039/c2cc18177k","","","0.71073","MoKα","","0.0932","0.0797","","","0.2654","0.2769","","","","","","1.088","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7107873","16.643","0.002","16.643","0.002","15.319","0.003","90","","90","","120","","3674.7","1","173","2","173","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C48 H108 N12 P6 Se6 -","- C48 H60 N12 P6 Se6 -","- C96 H120 N24 P12 Se12 -","2","0.166667","","Tristram Chivers; Andreas Nordheider; Ramalingam Thirumoorthi; Ignacio Vargas-Baca; J. Derek Woollins","Planar P6E6 (E = Se, S) macrocycles incorporating P2N2 scaffolds","Chem.Commun.","2012","48","","6346","","10.1039/c2cc32809g","","","0.71073","MoKα","","0.0916","0.0606","","","0.1553","0.178","","","","","","1.084","","","","has coordinates,has disorder","180182","2020-10-21","18:00:00",""
"7107875","16.54","0.0007","16.54","0.0007","15.533","0.0004","90","","90","","120","","3680.1","0.2","173","2","173","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C54 H114 N12 P6 S6 -","- C54 H57 N12 P6 S6 -","- C108 H114 N24 P12 S12 -","2","0.166667","","Tristram Chivers; Andreas Nordheider; Ramalingam Thirumoorthi; Ignacio Vargas-Baca; J. Derek Woollins","Planar P6E6 (E = Se, S) macrocycles incorporating P2N2 scaffolds","Chem.Commun.","2012","48","","6346","","10.1039/c2cc32809g","","","0.71073","MoKα","","0.1082","0.0807","","","0.1912","0.2134","","","","","","1.076","","","","has coordinates,has disorder","180182","2020-10-21","18:00:00",""
"7108529","24.592","0.004","24.592","0.004","18.919","0.004","90","","90","","120","","9909","3","173","2","173","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C129 H129 Ag9 F18 N36 O24 S6 -","- C125 H111 Ag9 F6 N36 O12 S2 -","- C250 H222 Ag18 F12 N72 O24 S4 -","2","0.166667","","Xin He; Cai-Yan Gao; Liang Zhao; Mei-Xiang Wang","Designed synthesis of a metal cluster-pillared coordination cage","Chem.Commun.","2012","48","","10877","","10.1039/c2cc36250c","","","0.71073","MoKα","","0.1163","0.0935","","","0.2725","0.2928","","","","","","1.089","","","","has coordinates,has disorder","180189","2020-10-21","18:00:00",""
"7110030","20.171","0.003","20.171","0.003","26.197","0.005","90","","90","","120","","9231","3","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C79 H48 N2 O36 Ti2 Zn6 -","- C79 H42 N2 O36 Ti2 Zn6 -","- C158 H84 N4 O72 Ti4 Zn12 -","2","0.166667","","Keunil Hong; Hyungphil Chun","Unprecedented and highly symmetric (6,8)-connected topology in a porous metal-organic framework through a Zn-Ti heterometallic approach","Chem.Commun.","2013","49","","10953","","10.1039/c3cc46761a","","","0.69999","Synchrotron","","0.1081","0.085","","","0.2453","0.2647","","","","","","0.997","","","","has coordinates","180214","2020-10-21","18:00:00",""
"7110278","12.68","0.002","12.68","0.002","12.6287","0.0013","90","","90","","120","","1758.4","0.4","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C18 H48 Cl9 Cu3 N9 -","- C18 H51 Cl9 Cu3 N9 -","- C36 H102 Cl18 Cu6 N18 -","2","0.166667","","Seeber, Georg; K�gerler, Paul; Kariuki, Benson M.; Cronin, Leroy","Supramolecular assembly of ligand-directed triangular {CuII3Cl} clusters with spin frustration and spin-chain behaviourElectronic supplementary information (ESI) available: full synthetic and analytical details. See http://www.rsc.org/suppdata/cc/b4/b402487g/","Chemical Communications","2004","","14","1580","1581","10.1039/b402487g","","","0.71073","MoKα","","0.0838","0.0511","","","0.1104","0.1326","","","","","","1.155","","","","has coordinates","180216","2020-10-21","18:00:00",""
"7110279","12.6961","0.0002","12.6961","0.0002","12.6511","0.0002","90","","90","","120","","1766.04","0.05","200","2","200","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C18 H48 Br2 Cl7 Cu3 N9 -","- C18 H51 Br2 Cl7 Cu3 N9 -","- C36 H102 Br4 Cl14 Cu6 N18 -","2","0.166667","","Seeber, Georg; K�gerler, Paul; Kariuki, Benson M.; Cronin, Leroy","Supramolecular assembly of ligand-directed triangular {CuII3Cl} clusters with spin frustration and spin-chain behaviourElectronic supplementary information (ESI) available: full synthetic and analytical details. See http://www.rsc.org/suppdata/cc/b4/b402487g/","Chemical Communications","2004","","14","1580","1581","10.1039/b402487g","","","1.5418","CuKα","","0.062","0.0563","","","0.1805","0.1858","","","","","","1.089","","","","has coordinates","180216","2020-10-21","18:00:00",""
"7110325","24.2682","0.0006","24.2682","0.0006","29.4699","0.0015","90","","90","","120","","15030.9","0.9","193","2","193","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C213 H171 Cl9 Co13 N62 O84 -","- C213 H159 Cl9 Co13 N62.01 O83.97 -","- C426 H318 Cl18 Co26 N124.02 O167.94 -","2","0.166667","","Milway, Victoria A.; Thompson, Laurence K.; Miller, David O.","Self-assembly by ligand disassembly?–formation of an unusual dodecanuclear [Co(II)~6~Co(III)~6~] cluster","Chemical Communications (Cambridge, United Kingdom)","2004","","16","1790","1791","10.1039/b405131a","","","0.71073","MoKα","","0.1415","0.0937","","","0.2713","0.3347","","","","","","1.111","","","","has coordinates","275111","2022-05-06","15:31:54",""
"7110771","9.5074","0.0002","9.5074","0.0002","29.7005","0.0004","90","","90","","120","","2324.97","0.08","150","2","150","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C38 H54 F6 N8 O6 S2 Tl2 -","- C38 H54 F6 N8 O6 S2 Tl2 -","- C76 H108 F12 N16 O12 S4 Tl4 -","2","0.166667","","Howarth, Oliver W.; Nelson, Jane; McKee, Vickie","Steric constraint generating large through-space 1H–203,205Tl coupling in a dithallium(I) cryptate","Chemical Communications","2000","","1","21","","10.1039/a908476b","","","0.6885","Synchrotron","","0.0542","0.0357","","","0.0788","0.0835","","","","","","1.06","","","","has coordinates,has disorder","288183","2023-12-08","14:43:00",""
"7111362","25.675","0.002","25.675","0.002","19.115","0.002","90","","90","","120","","10912.5","1.7","296","1","296","1","","","","","","","","6","P 63/m","-P 6c","176","","","","- C60 H14 F36 P2 Pt2 S4 -","- C60 H14 F36 P2 Pt2 S4 -","- C360 H84 F216 P12 Pt12 S24 -","6","0.5","","Villanueva, Luis; Arroyo, Maribel; Bern�s, Sylvain; Torrens, Hugo","Conversion of [Pt(SRf)2(PPh2 ? n(C6F5)n + 1)2] ( n = 0 or 1, Rf?C6HF4-4) through carbon?fluorine bond activation to [Pt(SRf)2(1,2-C6F4(SRf)-(PPh2))] and chiral [Pt(SRf)2(1,2-C6F4(SRf)(PPh(C6F5)))]Electronic Supplementary Information (ESI) available: experimental procedures and spectral data for all new compounds and crystallographic data for 5, 8 and 10. http://www.rsc.org/suppdata/cc/b4/b407328b/","Chemical Communications","2004","","17","1942","1943","10.1039/b407328b","","x-ray","0.71073","MoKα","","0.118","0.0542","","","0.1255","0.1528","","","","","","1.006","","","","has coordinates","180227","2020-10-21","18:00:00",""
"7111746","14.44","0.0002","14.44","0.0002","35.399","0.0006","90","","90","","120","","6392.28","0.17","150","2","150","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C58 H70 Ag2 Cl2 N6 O15 -","- C58.02 H69.93 Ag2 Cl2 N6 O15.005 -","- C232.08 H279.72 Ag8 Cl8 N24 O60.02 -","4","0.333333","","Burrows, Andrew D.; Frost, Christopher G.; Mahon, Mary F.; Raithby, Paul R.; Richardson, Christopher; Stevenson, Anna J.","Solid state interconversion of cages and coordination networks via conformational change of a semi-rigid ligand","Chemical Communications","2010","46","28","5064","5066","10.1039/c0cc00826e","","","0.71073","MoKα","","0.1196","0.0455","","","0.1075","0.1343","","","","","","0.937","","","","has coordinates","180231","2020-10-21","18:00:00",""
"7112112","50.71","0.007","50.71","0.007","62.92","0.013","90","","90","","120","","140122","4","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C54 H30 N4 O17 Zn4 -","- C54 H30 N4 O17 Zn4 -","- C972 H540 N72 O306 Zn72 -","18","1.5","","Ronny Grunker; Volodymyr Bon; Philipp Muller; Ulrich Stoeck; Simon Krause; Uwe Mueller; Irena Senkovska; Stefan Kaskel","A new metal-organic framework with ultra-high surface area","Chem.Commun.","2014","50","","3450","","10.1039/c4cc00113c","","x-ray","0.88561","synchrotron","","0.124","0.0691","","","0.1805","0.1994","","","","","","0.738","","","","has coordinates","255443","2020-10-21","18:00:00",""
"7112218","14.5144","0.0004","14.5144","0.0004","15.2404","0.0006","90","","90","","120","","2780.51","0.15","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C12 H54 Dy N11 O45 Zn6 -","- C12 H36 Dy N11 O44.98 Zn6 -","- C24 H72 Dy2 N22 O89.96 Zn12 -","2","0.166667","","Gang Xiong; Xiang-Yang Qin; Peng-Fei Shi; Yin-Ling Hou; Jian-Zhong Cui; Bin Zhao","New strategy to construct single-ion magnets: a unique Dy@Zn6 cluster exhibiting slow magnetic relaxation","Chem.Commun.","2014","50","","4255","","10.1039/C3CC49342C","","","0.7107","MoKα","","0.0347","0.0305","","","0.0813","0.0842","","","","","","1.085","","","","has coordinates","180236","2020-10-21","18:00:00",""
"7112219","14.4193","0.0006","14.4193","0.0006","15.0388","0.0007","90","","90","","120","","2707.9","0.2","122.1","0.1","122.1","0.1","","","","","","","","6","P 63/m","-P 6c","176","","","","- C12 H54 Er N11 O45 Zn6 -","- C12 H36 Er N11 O44.98 Zn6 -","- C24 H72 Er2 N22 O89.96 Zn12 -","2","0.166667","","Gang Xiong; Xiang-Yang Qin; Peng-Fei Shi; Yin-Ling Hou; Jian-Zhong Cui; Bin Zhao","New strategy to construct single-ion magnets: a unique Dy@Zn6 cluster exhibiting slow magnetic relaxation","Chem.Commun.","2014","50","","4255","","10.1039/C3CC49342C","","","0.7107","MoKα","","0.0434","0.0377","","","0.0919","0.0961","","","","","","1.061","","","","has coordinates","180236","2020-10-21","18:00:00",""
"7113042","13.4541","0.0009","13.4541","0.0009","27.755","0.002","90","","90","","120","","4350.9","0.5","294","2","294","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C18 H81.86 B0.43 N3 O60.43 P16.57 V9 -","- B0.432 H30.06 O55.5 P16.568 V9 -","- B0.864 H60.12 O111 P33.136 V18 -","2","0.166667","","Huang, Hui-Lin; Wang, Sue-Lein","An extraordinary boron-mediated 16R-channel-containing trivalent vanadium phosphite with unique solid state redox properties.","Chemical communications (Cambridge, England)","2010","46","33","6141","6143","10.1039/c0cc01105c","","","0.71073","MoKα","","0.0453","0.0414","","","0.1174","0.1205","","","","","","1.062","","","","has coordinates,has disorder","180244","2020-10-21","18:00:00",""
"7114209","18.7889","0.0008","18.7889","0.0008","19.0882","0.0008","90","","90","","120","","5835.8","0.4","200","2","200","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C86 H128 Cs4 Cu12 N8 O66 -","- C81.98 H71.94 Cs4 Cu12 N8.01 O63.5 -","- C163.96 H143.88 Cs8 Cu24 N16.02 O127 -","2","0.166667","","Murugesu, Muralee; Anson, Christopher E.; Powell, Annie K.","Engineering of ferrimagnetic Cu12-cluster arrays through supramolecular interactionsElectronic supplementary information (ESI) available: χT vs. T plot for K+ salt 1b at magnetic fields of 1 and 10 kOe. See http://www.rsc.org/suppdata/cc/b2/b201585b/","Chemical Communications","2002","","10","1054","","10.1039/b201585b","","","0.71073","MoKα","","0.1295","0.1013","","","0.1974","0.2085","","","","","","1.196","","","","has coordinates,has disorder","180256","2020-10-21","18:00:00",""
"7114214","14.7809","0.0007","14.7809","0.0007","31.453","0.0019","90","","90","","120","","5951.1","0.5","200","2","200","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C90 H140 Cs2 Cu12 N6 O62 -","- C89 H71.94 Cs2 Cu12 N6 O62 -","- C178 H143.88 Cs4 Cu24 N12 O124 -","2","0.166667","","Murugesu, Muralee; Anson, Christopher E.; Powell, Annie K.","Engineering of ferrimagnetic Cu12-cluster arrays through supramolecular interactionsElectronic supplementary information (ESI) available: χT vs. T plot for K+ salt 1b at magnetic fields of 1 and 10 kOe. See http://www.rsc.org/suppdata/cc/b2/b201585b/","Chemical Communications","2002","","10","1054","","10.1039/b201585b","","","0.71073","MoKα","","0.1581","0.0852","","","0.2092","0.2302","","","","","","0.941","","","","has coordinates","180256","2020-10-21","18:00:00",""
"7114403","14.536","0.002","14.536","0.002","23.211","0.005","90","","90","","120","","4247.3","1.2","301","2","301","2","","","","","","","","7","P 63/m","-P 6c","176","","Complex 1(ClO4)3","","- C89 H72 Cl3 N6 O12 P3 Pt3 -","- C89 H63 Cl3 N6 O12 P3 Pt3 -","- C178 H126 Cl6 N12 O24 P6 Pt6 -","2","0.166667","","Lu, Wei; Zhu, Nianyong; Che, Chi-Ming","Tethered trinuclear cyclometalated platinum(ii) complexes: from crystal engineering to tunable emission energyElectronic supplementary information (ESI) available: schemetic drawings for 1‒4, perspective view of cation of 4(ClO4)3·1.5Et2O·CH3CN and refinement details for X-ray crystallography. See http://www.rsc.org/suppdata/cc/b2/b200723a/","Chemical Communications","2002","","8","900","","10.1039/b200723a","","","0.71069","MoKα","","0.0683","0.0525","","","0.1454","0.1517","","","","","","1.096","","","","has coordinates,has disorder","180258","2020-10-21","18:00:00",""
"7114537","14.4433","0.0008","14.4433","0.0008","22.593","0.0018","90","","90","","120","","4081.7","0.5","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","2,4,6-Tris-(4-nitrophenoxy)-1,3,5-triazine, Hexamethylbenzene solvate","","- C75 H54 N18 O27 -","- C74.91 H36 N18 O27 -","- C149.82 H72 N36 O54 -","2","0.166667","","Jetti, Ram K. R.; Thallapally, Praveen K.; Nangia, Ashwini; Lam, Chi-Keung; Mak, Thomas C. W.","2,4,6-Tris(4-nitrophenoxy)-1,3,5-triazine: a hexagonal host framework stabilised by the NO2-trimer supramolecular synthon","Chemical Communications","2002","","9","952","","10.1039/b200152g","","","0.71073","MoKα","","0.1093","0.0747","","","0.2163","0.2646","","","","","","1.06","","","","has coordinates","180259","2020-10-21","18:00:00",""
"7115086","28.6458","0.0019","28.6458","0.0019","28.165","0.003","90","","90","","120","","20015","3","173","2","173","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C18.2 H5.49 Cu1.37 O6.86 -","- C17.6 H5.48571 Cu1.37143 O6.85714 -","- C616 H192 Cu48 O240 -","35","2.91667","","Moulton, Brian; Lu, Jianjiang; Mondal, Arunendu; Zaworotko, Michael J.","Nanoballs: nanoscale faceted polyhedra with large windows and cavities","Chemical Communications","2001","","9","863","","10.1039/b102714j","","","0.71073","MoKα","","0.1837","0.1116","","","0.3083","0.3416","","","","","","1.317","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115314","11.7036","0.0005","11.7036","0.0005","13.5561","0.0008","90","","90","","120","","1608.07","0.14","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C4.5 H5 B0.5 N3 Pu0.17 -","- C4.5 H5 B0.5 N3 Pu0.166667 -","- C54 H60 B6 N36 Pu2 -","12","1","","N. Magnani; E. Colineau; J.-C. Griveau; C. Apostolidis; O. Walter; R. Caciuffo","A plutonium-ased single-molecule magnet","Chem.Commun.","2014","50","","8171","","10.1039/C4cc03400G","","","0.71073","MoKα","","0.0178","0.0149","","","0.0311","0.0318","","","","","","1.065","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7116178","32.897","0.005","32.897","0.005","13.939","0.003","90","","90","","120","","13064","4","293","2","293","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C8 H16 N11 Ni5 O38 P S3 W9 -","- C8 H13 N11 Ni5 O38 P S3 W9 -","- C48 H78 N66 Ni30 O228 P6 S18 W54 -","6","0.5","","Cao, Gao-Juan; Liu, Jing-Dong; Zhuang, Ting-Ting; Cai, Xiu-Hong; Zheng, Shou-Tian","A polyoxometalate-organic supramolecular nanotube with high chemical stability and proton-conducting properties.","Chemical communications (Cambridge, England)","2015","51","11","2048","2051","10.1039/c4cc08445d","","","0.71073","MoKα","","0.0919","0.0531","","","0.0992","0.1089","","","","","","1.068","","","","has coordinates,has disorder","180275","2020-10-21","18:00:00",""
"7116775","17.4123","0.0005","17.4123","0.0005","17.8443","0.0007","90","","90","","120","","4685.4","0.3","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C36 H27 Mg3 Na5 O81 U9 -","- C36 H27 Mg3 Na5 O81 U9 -","- C72 H54 Mg6 Na10 O162 U18 -","2","0.166667","","M. Basile; D. K. Unruh; K. Gojdas; E. Flores; L. Streicher; T. Z. Forbes","Chemical controls on uranyl citrate speciation and the self-assembly of nanoscale macrocycles and sandwich complexes in aqueous solutions","Chem.Commun.","2015","51","","5306","","10.1039/C4cc08657K","","","0.71073","MoKα","","0.0368","0.0299","","","0.0774","0.0834","","","","","","1.001","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7117021","6.2993","0.0008","6.2993","0.0008","3.6057","0.0006","90","","90","","120","","123.91","0.03","293","2","100","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Gd H3 O3 -","- Gd H3 O3 -","- Gd2 H6 O6 -","2","0.166667","","Yan Yang; Qian-Chong Zhang; Yin-Yin Pan; La-Sheng Long; Lan-Sun Zheng","Magnetocaloric effect and thermal conductivity of Gd(OH)3 and Gd2O(OH)4(H2O)2","Chem.Commun.","2015","51","","7317","","10.1039/C5cc01254F","","","0.71073","MoKα","","0.0687","0.0681","","","0.1613","0.1634","","","","","","1.118","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7117400","20.64","0.004","20.64","0.004","14.742","0.005","90","","90","","120","","5439","2","296","2","296","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C18 H76 Cu9 N36 O88 P2 W18 -","- C18 H66 Cu9 N36 O88 P2 W18 -","- C36 H132 Cu18 N72 O176 P4 W36 -","2","0.166667","","Yan-Qing Jiao; Hong-Ying Zang; Xin-Long Wang; En-Long Zhou; Bai-Qiao Song; Chun-Gang Wang; Kui-Zhan Shao; Zhong-Min Su","Self-assembled arrays of polyoxometalate-based metal-organic nanotubes for proton conduction and magnetism","Chem.Commun.","2015","51","","11313","","10.1039/C5cc03357H","","","0.71069","MoKα","","0.0789","0.0527","","","0.1283","0.1476","","","","","","1.051","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7117422","15.9267","0.0003","15.9267","0.0003","24.086","0.0009","90","","90","","120","","5291.1","0.2","150.01","0.11","150.01","0.11","","","","","","","","4","P 63/m","-P 6c","176","","","","- C118 H143 Mg3 N12 -","- C118.001 H143.002 Mg3 N12 -","- C236.003 H286.003 Mg6 N24 -","2","0.166667","","Jani O. Moilanen; Benjamin M. Day; Thomas Pugh; Richard A. Layfield","Open-shell doublet character in a hexaazatrinaphthylene trianion complex","Chem.Commun.","2015","51","","11478","","10.1039/C5cc04004C","","x-ray","0.71073","MoKα","","0.0687","0.0555","","","0.1473","0.1548","","","","","","1.118","","","","has coordinates,has disorder","140005","2020-10-21","18:00:00",""
"7118103","18.9177","0.0004","18.9177","0.0004","17.466","0.0004","90","","90","","120","","5413.3","0.2","95","2","95","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C99 H129 O3 P3 Pt3 -","- C99 H129 O3 P3 Pt3 -","- C198 H258 O6 P6 Pt6 -","2","0.166667","","Laura Ortega-Moreno; Riccardo Peloso; Celia Maya; Andres Suarez; Ernesto Carmona","Platinum(0) olefin complexes of a bulky terphenylphosphine ligand. Synthetic, structural and reactivity studies","Chem.Commun.","2015","51","","17008","","10.1039/C5cc07308A","","","0.56086","AgKα","","0.0302","0.0237","","","0.076","0.083","","","","","","0.644","","","","has coordinates","210357","2020-10-21","18:00:00",""
"7118355","16.8444","0.001","16.8444","0.001","12.6713","0.0008","90","","90","","120","","3113.6","0.3","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C69 H87 Fe3 N6 S3 -","- C63 H81 Fe3 N6 S3 -","- C126 H162 Fe6 N12 S6 -","2","0.166667","","Lee, Yousoon; Jeon, Ie-Rang; Abboud, Khalil A.; García-Serres, Ricardo; Shearer, Jason; Murray, Leslie J.","A [3Fe-3S](3+) cluster with exclusively μ-sulfide donors.","Chemical communications (Cambridge, England)","2016","52","6","1174","1177","10.1039/c5cc07813j","","","0.71073","MoKα","","0.0591","0.0444","","","0.1218","0.1284","","","","","","1.041","","","","has coordinates","173622","2020-10-21","18:00:00",""
"7119730","10.2846","0.0002","10.2846","0.0002","20.0277","0.0005","90","","90","","120","","1834.58","0.07","100","2","100","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C27 H16 Er3 O19 -","- C24 H12 Er3 O19 -","- C48 H24 Er6 O38 -","2","0.166667","","Wei, Na; Zuo, Rong-Xia; Zhang, Yu-Yang; Han, Zheng-Bo; Gu, Xue-Jun","Robust high-connected rare-earth MOFs as efficient heterogeneous catalysts for CO2 conversion.","Chemical communications (Cambridge, England)","2017","53","22","3224","3227","10.1039/c7cc00363c","","","1.54184","CuKα","","0.0859","0.0781","","","0.2205","0.2266","","","","","","1.194","","","","has coordinates","194942","2020-10-21","18:00:00",""
"7119731","10.3534","0.0003","10.3534","0.0003","24.6485","0.0007","90","","90","","120","","2288.16","0.11","100","2","100","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C39 H22 Er3 O19 -","- C39 H18 Er3 O19 -","- C78 H36 Er6 O38 -","2","0.166667","","Wei, Na; Zuo, Rong-Xia; Zhang, Yu-Yang; Han, Zheng-Bo; Gu, Xue-Jun","Robust high-connected rare-earth MOFs as efficient heterogeneous catalysts for CO2 conversion.","Chemical communications (Cambridge, England)","2017","53","22","3224","3227","10.1039/c7cc00363c","","","1.54184","CuKα","","0.1149","0.1129","","","0.2642","0.2653","","","","","","1.129","","","","has coordinates","194942","2020-10-21","18:00:00",""
"7119742","14.666","0.002","14.666","0.002","12.2227","0.0015","90","","90","","120","","2276.8","0.5","298","2","298","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C42 H63 N9 O9 -","- C42 H63 N9 O9 -","- C84 H126 N18 O18 -","2","0.166667","","Karak, Suvendu; Kumar, Sushil; Bera, Saibal; Díaz, David Díaz; Banerjee, Subhrashis; Vanka, Kumar; Banerjee, Rahul","Interplaying anions in a supramolecular metallohydrogel to form metal organic frameworks.","Chemical communications (Cambridge, England)","2017","53","26","3705","3708","10.1039/c7cc00539c","","","1.54184","CuKα","","0.2057","0.1063","","","0.2656","0.3536","","","","","","1.02","","","","has coordinates,has disorder","194967","2020-10-21","18:00:00",""
"7122560","14.3872","0.0003","14.3872","0.0003","24.9442","0.0004","90","","90","","120","","4471.5","0.15","120","0.1","120","0.1","","","","","","","","7","P 63/m","-P 6c","176","","","","- C60 H54 B4 F16 Fe2 N24 O6 -","- C60 H54 B3.9996 F15.999 Fe2 N24 O6 -","- C120 H108 B7.9992 F31.998 Fe4 N48 O12 -","2","0.166667","","Wilson, Benjamin H.; Scott, Hayley S.; Qazvini, Omid T.; Telfer, Shane G.; Mathonière, Corine; Clérac, Rodolphe; Kruger, Paul E.","A supramolecular porous material comprising Fe(ii) mesocates.","Chemical communications (Cambridge, England)","2018","54","95","13391","13394","10.1039/c8cc07227b","","x-ray","1.54184","CuKα","","0.0919","0.0912","","","0.2683","0.269","","","","","","1.1","","","","has coordinates,has disorder","228532","2020-10-21","18:00:00",""
"7123432","17.3339","0.0003","17.3339","0.0003","23.8668","0.0004","90","","90","","120","","6210.37","0.18","173","2","173","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C81 H111 N17 O3 -","- C81 H111 N17 O3 -","- C162 H222 N34 O6 -","2","0.166667","","Wang, Fei; Sikma, Eric; Duan, Zhiming; Sarma, Tridib; Lei, Chuanhu; Zhang, Zhan; Humphrey, Simon M.; Sessler, Jonathan L.","Shape-persistent pyrrole-based covalent organic cages: synthesis, structure and selective gas adsorption properties","Chemical Communications","2019","","","","","10.1039/C9CC02490E","","","1.54184","CuKα","","0.0592","0.0521","","","0.1644","0.1715","","","","","","1.068","","","","has coordinates,has disorder","215119","2020-10-21","18:00:00",""
"7124383","14.1114","0.0019","14.1114","0.0019","31.276","0.004","90","","90","","120","","5393.6","1.2","123","2","123","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C24.33 H16.33 Co0.67 Ir0.67 N2 O5.33 P0.33 -","- C24.3333 H16.3336 Co0.666667 Ir0.666667 N2 O5.33337 P0.3333 -","- C146 H98.0016 Co4 Ir4 N12 O32.0002 P1.9998 -","6","0.5","","Liao, Chwen-Haw; Fan, Kun; Bao, Song-Song; Fan, Hao; Wang, Xizhang; Hu, Zheng; Kurmoo, Mohamedally; Zheng, Li-Min","From a layered iridium(III)-cobalt(II) organophosphonate to an efficient oxygen-evolution-reaction electrocatalyst","Chemical Communications","2019","","","","","10.1039/C9CC06164A","","","0.71073","MoKα","","0.0582","0.0474","","","0.1406","0.151","","","","","","1.004","","","","has coordinates","219519","2020-10-21","18:00:00",""
"7126051","10.131","0.0004","10.131","0.0004","5.9315","0.0003","90","","90","","120","","527.23","0.04","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ba3 Cl3 F6 In -","- Ba3 Cl3 F6 In -","- Ba6 Cl6 F12 In2 -","2","0.166667","","Jiang, Xiaoqing; Wu, Hongping; Yu, Hongwei; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng","In[Ba<sub>3</sub>Cl<sub>3</sub>F<sub>6</sub>]: a novel infrared-transparent molecular sieve constructed by halides.","Chemical communications (Cambridge, England)","2020","56","22","3297","3300","10.1039/d0cc00455c","","","0.71073","MoKα","","0.0212","0.0194","","","0.0413","0.0419","","","","","","1.249","","","","has coordinates","250163","2020-10-21","18:00:00",""
"7128413","15.469","0.004","15.469","0.004","14.15","0.006","90","","90","","120","","2932.3","1.6","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C12 H15.33 Co1.67 N2 O9.33 S -","- C12 H8 Co1.66667 N2 O9.33317 S -","- C72 H48 Co10 N12 O55.999 S6 -","6","0.5","","Du, Shaowu; Cui, Meiyan; He, Zhangzhen","A pentanuclear {Co<sub>5</sub>} cluster motif forming a capped breathing kagomé lattice.","Chemical communications (Cambridge, England)","2021","57","54","6616","6619","10.1039/d1cc01987b","","","0.71073","MoKα","","0.0511","0.0507","","","0.1265","0.1268","","","","","","1.248","","","","has coordinates,has disorder","268601","2021-09-06","09:38:15",""
"7129489","24.0801","0.0004","24.0801","0.0004","25.4757","0.0004","90","","90","","120","","12793","0.4","150","2","149.99","","","","","","","","","7","P 63/m","-P 6c","176","","","","- C36 H106.2 Cu12 N36 Nb21 O111 Te15 -","- C36 H156 Cu12 N36 Nb21 O102 Te15 -","- C72 H312 Cu24 N72 Nb42 O204 Te30 -","2","0.166667","","Cheng, Mengyuan; Liu, Yufeng; Li, Nan; Shi, Jingwen; Du, Weixin; Zhang, Dongdi; Yang, Guoping; Wang, Guan; Niu, Jingyang","Two novel telluroniobates with efficient catalytic activity for the imidation/amidation reaction","Chemical Communications","2022","","","","","10.1039/D1CC06781H","","","0.71073","MoKα","","0.0527","0.0401","","","0.0996","0.11","","","","","","1.04","","","","has coordinates,has disorder","271790","2022-01-04","22:51:46",""
"7129567","12.143","0.003","12.143","0.003","11.827","0.004","90","","90","","120","","1510.3","0.7","193","","193","","","","","","","","","3","P 63/m","-P 6c","176","","","","- C38 H20 S6 -","- C38 H20 S6 -","- C76 H40 S12 -","2","0.166667","","Tang, Shuxuan; Ruan, Huapeng; Hu, Zhao-Bo; Zhao, Yue; Song, You; Wang, Xinping","A Cationic Sulfur-Hydrocarbon Triradical with an Excited Quartet State","Chemical Communications","2022","","","","","10.1039/D1CC06904G","","","0.71073","MoKα","","0.1841","0.1345","","","0.2684","0.2978","","","","","","1.044","","","","has coordinates","272040","2022-01-14","22:49:01",""
"7131563","10.9156","0.0007","10.9156","0.0007","26.8948","0.0018","90","","90","","120","","2775.2","0.3","100","2","100","2","","","","","","","","9","P 63/m","-P 6c","176","","","","- C12 H36 As6 Au3 Cl N Na3 O27 Pt2 -","- C12 H36 As6 Au3 Cl N Na3 O27 Pt2 -","- C24 H72 As12 Au6 Cl2 N2 Na6 O54 Pt4 -","2","0.166667","","Zhang, Jiayao; Bhattacharya, Saurav; Müller, Anja B; Kiss, Levente; Silvestru, Cristian; Kuhnert, Nikolai; Kortz, Ulrich","Mixed noble metal-oxo clusters: platinum(IV)-gold(III) oxoanion [Pt<sup>IV</sup><sub>2</sub>Au<sup>III</sup><sub>3</sub>O<sub>6</sub>((CH<sub>3</sub>)<sub>2</sub>AsO<sub>2</sub>)<sub>6</sub>]<sup/>.","Chemical communications (Cambridge, England)","2023","59","39","5918","5921","10.1039/d3cc00243h","","","0.71073","MoKα","","0.0331","0.0274","","","0.0685","0.0723","","","","","","0.891","","","","has coordinates,has disorder","284192","2023-06-05","03:42:33",""
"7132310","21.0549","0.0006","21.0549","0.0006","31.7103","0.0014","90","","90","","120","","12174.1","0.7","150","","150","","","","","","","","","7","P 63/m","-P 6c","176","","","","- C138 H135 F36 N51 O36 Pb6 S12 -","- C138 H135 F36 N51 O36 Pb6 S12 -","- C276 H270 F72 N102 O72 Pb12 S24 -","2","0.166667","","Wang, Hai-Ping; Eichhöfer, Andreas; Gu, Zhi-Gang; Gruber, Nathalie; Stadler, Adrian-Mihail","Anion-encapsulating, discrete prism and extended frusta, from trimetallated triangular macrocycles and linkers.","Chemical communications (Cambridge, England)","2023","","","","","10.1039/d3cc00137g","","","1.34143","GaKα","","0.1104","0.0696","","","0.1968","0.2213","","","","","","0.945","","","","has coordinates,has disorder","287473","2023-11-07","23:00:36",""
"7132314","21.0367","0.0009","21.0367","0.0009","31.8231","0.0016","90","","90","","120","","12196.3","1","120","2","120","2","","","","","","","","12","P 63/m","-P 6c","176","","","","- C131 H126 F39 N48 O33 P Pb6 S11 en lv so t -","- C131 H126 F39 N48 O33 P Pb6 S11 -","- C262 H252 F78 N96 O66 P2 Pb12 S22 -","2","0.166667","","Wang, Hai-Ping; Eichhöfer, Andreas; Gu, Zhi-Gang; Gruber, Nathalie; Stadler, Adrian-Mihail","Anion-encapsulating, discrete prism and extended frusta, from trimetallated triangular macrocycles and linkers.","Chemical communications (Cambridge, England)","2023","","","","","10.1039/d3cc00137g","","","0.71073","MoKα","","0.1028","0.0789","","","0.1945","0.2101","","","","","","1.066","","","","has coordinates,has disorder","287473","2023-11-07","23:00:37",""
"7150120","15.358","0.0004","15.358","0.0004","20.1237","0.0012","90","","90","","120","","4110.6","0.3","130","2","130","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- C39 H24 O3 -","- C39 H24 O3 -","- C234 H144 O18 -","6","0.5","","Wooi, Goh Yit; White, Jonathan M.","Structural manifestations of the cheletropic reaction.","Organic & biomolecular chemistry","2005","3","6","972","974","10.1039/b417538g","","","0.71073","MoKα","","0.0966","0.0497","","","0.0773","0.0881","","","","","","0.887","","","","has coordinates","180287","2020-10-21","18:00:00",""
"7202278","18.2141","0.0005","18.2141","0.0005","7.6303","0.0003","90","","90","","120","","2192.24","0.12","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","Dimethyl(pyruvic-thiosemicarbazonate)tin(IV) THF solvate","","","- C10 H19 N3 O3 S Sn -","- C10 H19 N3 O3 S Sn -","- C60 H114 N18 O18 S6 Sn6 -","6","0.5","","Kovala-Demertzi, Dimitra; Wiecek, Joanna; Plakatouras, John C.; Ciunik, Zbigniew","Self-assembly of dialkyltin(IV) moieties and a thiosemicarbone to a trinuclear macrocycle and the unprecedented formation of two pseudo-polymorphs with different cavities","CrystEngComm","2008","10","10","1291","","10.1039/b809216h","","","0.71073","MoKα","","0.0378","0.0259","","","0.0529","0.055","","","","","","1.094","","","","has coordinates,has disorder","180353","2020-10-21","18:00:00",""
"7202315","16.1966","0.0004","16.1966","0.0004","34.0682","0.0019","90","","90","","120","","7739.8","0.5","150","2","150","2","","","","","","","","8","P 63/m","-P 6c","176","tris(acetonitrile)chlorobis(tris(4-(3-pyridyl)phenylester) cyclotriguaiacylene)-trisilver(i) tetrafluoroborate acetonitrile clathrate","tris(acetonitrile)chlorobis(tris{4-(3-pyridyl)phenylester) cyclotriguaiacylene)- trisilver(I) tetrafluoroborate acetonitrile clathrate","","- C132 H108 Ag3 B2 Cl F8 N12 O18 -","- C131.96 H90 Ag3 Cl N12 O18 -","- C263.92 H180 Ag6 Cl2 N24 O36 -","2","0.166667","","Ronson, Tanya K.; Hardie, Michaele J.","Extended 36 and 63 arrays of capsule motifs using ligand tris{4-(3-pyridyl)phenylester}cyclotriguaiacylene","CrystEngComm","2008","10","12","1731","","10.1039/b810090j","","","0.71073","MoKα","","0.129","0.0892","","","0.2991","0.3413","","","","","","1.319","","","","has coordinates","180354","2020-10-21","18:00:00",""
"7202316","15.7496","0.0002","15.7496","0.0002","35.0891","0.0011","90","","90","","120","","7537.8","0.3","150","2","150","2","","","","","","","","8","P 63/m","-P 6c","176","tris(acetonitrile)chlorobis(tris(4-(3- pyridyl)phenylester)cyclotriguaiacylene)-trisilver(i) hexafluoroarsenate","tris(acetonitrile)chlorobis(tris{4-(3-pyridyl)phenylester)cyclotriguaiacylene)- trisilver(I) hexafluoroarsenate","","- C126 H99 Ag3 As2 Cl F12 N9 O18 -","- C126 H90 Ag3 As1.99 Cl N9 O18 -","- C252 H180 Ag6 As3.98 Cl2 N18 O36 -","2","0.166667","","Ronson, Tanya K.; Hardie, Michaele J.","Extended 36 and 63 arrays of capsule motifs using ligand tris{4-(3-pyridyl)phenylester}cyclotriguaiacylene","CrystEngComm","2008","10","12","1731","","10.1039/b810090j","","","0.71073","MoKα","","0.1204","0.0959","","","0.263","0.2816","","","","","","1.115","","","","has coordinates","180354","2020-10-21","18:00:00",""
"7202317","16.247","0.0006","16.247","0.0006","34.382","0.003","90","","90","","120","","7859.7","0.8","150","2","150","2","","","","","","","","6","P 63/m","-P 6c","176","tris(acetonitrile)chlorobis(tris(4-(3- pyridyl)phenylester)cyclotriguaiacylene)-trisilver(i) perchlorate acetonitrile clathrate","tris(acetonitrile)chlorobis(tris{4-(3-pyridyl)phenylester)cyclotriguaiacylene)- trisilver(I) perchlorate acetonitrile clathrate","","- C128 H102 Ag3 Cl3 N10 O26 -","- C128 H90 Ag3 Cl2 N10 O22 -","- C256 H180 Ag6 Cl4 N20 O44 -","2","0.166667","","Ronson, Tanya K.; Hardie, Michaele J.","Extended 36 and 63 arrays of capsule motifs using ligand tris{4-(3-pyridyl)phenylester}cyclotriguaiacylene","CrystEngComm","2008","10","12","1731","","10.1039/b810090j","","","0.71073","MoKα","","0.1031","0.0641","","","0.1805","0.1986","","","","","","1.087","","","","has coordinates,has disorder","180354","2020-10-21","18:00:00",""
"7203767","9.7347","0.0007","9.7347","","7.2531","0.0006","90","","90","","120","","595.25","0.07","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- La1.33 O4.33 Si Sr0.33 -","- La1.33333 O4.33353 Si Sr0.333333 -","- La8 O26.0012 Si6 Sr2 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.11","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203768","9.77167","0.00028","9.77167","","7.21223","0.00021","90","","90","","120","","596.4","0.02","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.56 O4.33 Si -","- La1.56067 O4.33313 Si -","- La9.364 O25.9988 Si6 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.95","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203769","9.8527","0.0017","9.8527","","7.2714","0.0013","90","","90","","120","","611.31","0.15","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge0.5 La1.56 O4.33 Si0.5 -","- Ge0.5 La1.55533 O4.3334 Si0.5 -","- Ge3 La9.332 O26.0004 Si3 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.98","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203770","9.9422","0.0006","9.9422","","7.3358","0.0004","90","","90","","120","","627.98","0.05","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge La1.33 O4.33 Sr0.33 -","- Ge La1.33333 O4.3334 Sr0.333333 -","- Ge6 La8 O26.0004 Sr2 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.4","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203771","9.81164","0.00032","9.81164","","7.23354","0.00024","90","","90","","120","","603.07","0.03","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.56 O4.35 Si -","- La1.56067 O4.35473 Si -","- La9.364 O26.1284 Si6 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.71","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203772","9.91268","0.00012","9.91268","","7.31937","0.0001","90","","90","","120","","622.854","0.011","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge La1.33 O4.33 Sr0.33 -","- Ge La1.33333 O4.33327 Sr0.333333 -","- Ge6 La8 O25.9996 Sr2 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.75","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203773","9.8335","0.0004","9.8335","","7.25285","0.00032","90","","90","","120","","607.37","0.04","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge0.5 La1.56 O4.33 Si0.5 -","- Ge0.5 La1.55533 O4.33327 Si0.5 -","- Ge3 La9.332 O25.9996 Si3 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","2.06","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203774","9.728","0.006","9.728","","7.19","0.004","90","","90","","120","","589.3","0.5","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.55 O4.33 Si -","- La1.55467 O4.33347 Si -","- La9.328 O26.0008 Si6 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","129.07","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203775","9.71191","0.00008","9.71191","","7.23956","0.00007","90","","90","","120","","591.36","0.008","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- La1.33 O4.33 Si Sr0.33 -","- La1.33333 O4.33353 Si Sr0.333333 -","- La8 O26.0012 Si6 Sr2 -","6","0.5","","León-Reina, Laura; Losilla, Enrique R.; Martínez-Lara, Maria; Bruque, Sebastián; Llobet, Anna; Sheptyakov, Denis V.; Aranda, Miguel A. G.","Interstitial oxygen in oxygen-stoichiometric apatites","Journal of Materials Chemistry","2005","15","25","2489","","10.1039/b503374h","powder diffraction","","","","","","","","","","","","","1.7","","","","","","","has coordinates","180368","2020-10-21","18:00:00",""
"7203811","9.71816","","9.71816","","7.28267","","90","","90","","120","","595.648","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","?","- F2.00006 O24.0002 P6.00006 Sr10.0001 -","- F2.00006 O24.0002 P6.00006 Sr10.0001 -","","","","Kabbour, Houria; Cario, Laurent; Boucher, Florent","Rational design of new inorganic compounds with the ZrSiCuAs structure type using 2D building blocks","Journal of Materials Chemistry","2005","15","34","3525","","10.1039/b506031a","powder diffraction","","","X-ray","","","","","","","","","9.8973","","","","","","","","has coordinates","180369","2020-10-21","18:00:00",""
"7204443","13.178","0.006","13.178","0.006","11.091","0.005","90","","90","","120","","1668","1.3","100","2","100","2","","","","","","","","3","P 63/m","-P 6c","176","N,N-dihydrodimethylphenazine","","","- C14 H14 N2 -","- C14 H16 N2 -","- C84 H96 N12 -","6","0.5","","Holzapfel, Marco; Lambert, Christoph; Selinka, Carola; Stalke, Dietmar","Organic mixed valence compounds with N,N-dihydrodimethylphenazine redox centres","Journal of the Chemical Society, Perkin Transactions 2","2002","","9","1553","","10.1039/b204392k","","","0.71073","MoKα","","0.0402","0.0342","","","0.0939","0.0968","","","","","","1.069","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7204802","9.93931","0.00013","9.93931","","7.28485","0.0001","90","","90","","120","","623.252","0.012","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ge La1.6 O4.45 -","- Ge La1.6 O4.4472 -","- Ge6 La9.6 O26.6832 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","x-ray","0.400269","","","","","","","","","0.04954","","66.75","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204803","9.76655","0.00018","9.76655","","7.20962","0.00014","90","","90","","120","","595.56","0.016","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.59 O4.38 Si -","- La1.59133 O4.37667 Si -","- La9.548 O26.26 Si6 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","neutron","1.88604","","","","","","","","","0.05287","","","","","","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204804","9.72566","0.00004","9.72566","","7.18636","0.00004","90","","90","","120","","588.678","0.004","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.59 O4.36 Si -","- La1.59133 O4.36133 Si -","- La9.548 O26.168 Si6 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","","1.5406","Kα~1~","","","","","","","","0.03241","","91.35","","","","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7204805","10.00745","0.00028","10.00745","","7.33341","0.00022","90","","90","","120","","636.04","0.03","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ge La1.6 O4.41 -","- Ge La1.6 O4.409 -","- Ge6 La9.6 O26.454 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","neutron","1.88604","","","","","","","","","0.41286","","2.42","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204806","9.9658","0.00019","9.9658","","7.3116","0.00016","90","","90","","120","","628.879","0.018","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ge La1.6 O4.43 -","- Ge La1.6 O4.42833 -","- Ge6 La9.6 O26.57 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","","","","","","","","","","","","","2.09","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7204808","9.80882","0.0002","9.80882","","7.23353","0.00016","90","","90","","120","","602.718","0.018","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.59 O4.37 Si -","- La1.59133 O4.37367 Si -","- La9.548 O26.242 Si6 -","6","0.5","","Laura León-Reina; Enrique R. Losilla; María Martínez-Lara; Sebastián Bruque; Miguel A. G. Aranda","Interstitial oxygen conduction in lanthanum oxy-apatite electrolytes","J. Mater. Chem.","2004","14","7","1142","1149","10.1039/b315257j","powder diffraction","neutron","1.88604","","","","","","","","","0.04755","","1.99","","","","","","","has coordinates","180379","2020-10-21","18:00:00",""
"7207284","9.91022","0.00013","9.91022","0.00013","7.32094","0.00014","90","","90","","120","","622.679","0.017","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ge6 La7.93 O26 Sr2 -","- Ge6 La7.9312 O26 Sr2 -","- Ge6 La7.9312 O26 Sr2 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.424","","","","","","","has coordinates","288312","2023-12-14","15:05:57",""
"7207285","9.90847","0.00018","9.90847","0.00018","7.32192","0.00016","90","","90","","120","","622.54","0.02","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ge5.84 La7.93 O26 Sr2 V0.16 -","- Ge5.8446 La7.9308 O26 Sr2 V0.1554 -","- Ge5.8446 La7.9308 O26 Sr2 V0.1554 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.388","","","","","","","has coordinates","288312","2023-12-14","15:06:16",""
"7207286","9.90941","0.00013","9.90941","0.00013","7.32414","0.00015","90","","90","","120","","622.849","0.017","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ge5.58 La7.99 O26 Sr2 V0.42 -","- Ge5.5848 La7.9884 O26 Sr2.0004 V0.4152 -","- Ge5.5848 La7.9884 O26 Sr2.0004 V0.4152 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.44","","","","","","","has coordinates","288312","2023-12-14","15:06:29",""
"7207287","9.87089","0.00015","9.87089","0.00015","7.22428","0.00017","90","","90","","120","","609.59","0.019","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ca2 Ge6 La7.8 O26 -","- Ca1.998 Ge6 La7.794 O26 -","- Ca1.998 Ge6 La7.794 O26 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.526","","","","","","","has coordinates","288312","2023-12-14","15:06:35",""
"7207288","9.86956","0.00014","9.86956","0.00014","7.22553","0.00016","90","","90","","120","","609.531","0.018","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ca2 Ge5.62 La7.82 O26 V0.38 -","- Ca1.998 Ge5.6214 La7.83 O26 V0.3786 -","- Ca1.998 Ge5.6214 La7.83 O26 V0.3786 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.489","","","","","","","has coordinates","288312","2023-12-14","15:06:43",""
"7207289","9.87087","0.00016","9.87087","0.00016","7.22604","0.00019","90","","90","","120","","609.74","0.02","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ca2 Ge5.35 La7.88 O26 V0.65 -","- Ca1.998 Ge5.3454 La7.874 O26 V0.6546 -","- Ca1.998 Ge5.3454 La7.874 O26 V0.6546 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.416","","","","","","","has coordinates","288312","2023-12-14","15:07:52",""
"7207290","9.97963","0.00016","9.97963","0.00016","7.41046","0.00017","90","","90","","120","","639.15","0.02","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ba2 Ge6 La7.88 O26 -","- Ba2.004 Ge6 La7.876 O26 -","- Ba2.004 Ge6 La7.876 O26 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.478","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7207291","9.97623","0.00015","9.97623","0.00015","7.41273","0.00016","90","","90","","120","","638.913","0.019","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ba2 Ge5.66 La7.88 O26 V0.34 -","- Ba2.004 Ge5.6628 La7.884 O26 V0.3372 -","- Ba2.004 Ge5.6628 La7.884 O26 V0.3372 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.444","","","","","","","has coordinates","190010","2020-10-21","18:00:00",""
"7207292","9.97861","0.00017","9.97861","0.00017","7.41128","0.00018","90","","90","","120","","639.09","0.02","298","","298","","","","","","","","","5","P 63/m","-P 6c","176","Germanate electrolyte Apatite","","","- Ba2 Ge5.29 La7.67 O26 V0.71 -","- Ba1.996 Ge5.292 La7.668 O26 V0.708 -","- Ba1.996 Ge5.292 La7.668 O26 V0.708 -","1","0.0833333","","Li, Henan; Baikie, Tom; Pramana, Stevin S.; Shin, J. Felix; Slater, Peter R.; Brink, Frank; Hester, James; Wallwork, Kia; White, Tim J.","Synthesis and characterisation of vanadium doped alkaline earth lanthanum germanate oxyapatite electrolyte","Journal of Materials Chemistry","2012","22","6","2658","","10.1039/c1jm13752b","powder diffraction","neutron","1.622","Neutron","","","","","","","","","","1.518","","","","","","","has coordinates","190010","2020-10-21","18:00:00",""
"7207401","24.803","0.0005","24.803","0.0005","16.3693","0.0003","90","","90","","120","","8721.1","0.3","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C96 H66 Co12 N15 O46 -","- C96 H66 Co12 N15 O46 -","- C192 H132 Co24 N30 O92 -","2","0.166667","","Chen, Qing; Xue, Wei; Wang, Bao-Ying; Zeng, Ming-Hua; Chen, Xiao-Ming","Unprecedented binodal (7,9)-connected network based on distinct tricobalt(ii) clusters: structure, topology and cooperative magnetism","CrystEngComm","2012","14","6","2009","","10.1039/c2ce06020e","","","0.71075","MoKα","","0.0806","0.0703","","","0.2174","0.2371","","","","","","1.047","","","","has coordinates,has disorder","180405","2020-10-21","18:00:00",""
"7208074","8.8941","0.0013","8.8941","0.0013","6.3353","0.0013","90","","90","","120","","434.01","0.13","295","2","295","2","","","2620000","","","","","3","P 63/m","-P 6c","176","chloroethane","chloroethane","","- C2 H5 Cl -","- C2 H5 Cl -","- C12 H30 Cl6 -","6","0.5","","Podsiadło, Marcin; Bujak, Maciej; Katrusiak, Andrzej","Chemistry of density: extension and structural origin of Carnelley's rule in chloroethanes","CrystEngComm","2012","14","13","4496","","10.1039/c2ce25097g","","","0.71073","MoKα","","0.0226","0.0215","","","0.05","0.0515","","","","","","1.182","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208075","8.8116","0.0012","8.8116","0.0012","6.2705","0.0013","90","","90","","120","","421.64","0.12","295","2","295","2","","","3040000","","","","","3","P 63/m","-P 6c","176","chloroethane","chloroethane","","- C2 H5 Cl -","- C2 H5 Cl -","- C12 H30 Cl6 -","6","0.5","","Podsiadło, Marcin; Bujak, Maciej; Katrusiak, Andrzej","Chemistry of density: extension and structural origin of Carnelley's rule in chloroethanes","CrystEngComm","2012","14","13","4496","","10.1039/c2ce25097g","","","0.71073","MoKα","","0.0175","0.0172","","","0.044","0.0442","","","","","","1.096","","","","has coordinates","180411","2020-10-21","18:00:00",""
"7208300","12.606","0.003","12.606","0.003","19.668","0.004","90","0.015","90","0.018","120","0.019","2706.7","1.2","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30 H42 N6 Na8 Ni2 O33 -","- C30 H12 N6 Na7.98 Ni2 O33.02 -","- C60 H24 N12 Na15.96 Ni4 O66.04 -","2","0.166667","","Dul, Marie-Claire; Lescouëzec, Rodrigue; Chamoreau, Lise-Marie; Journaux, Yves; Carrasco, Rosa; Castellano, María; Ruiz-García, Rafael; Cano, Joan; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina; Fabelo, Oscar; Pardo, Emilio","Self-assembly, metal binding ability, and magnetic properties of dinickel(ii) and dicobalt(ii) triple mesocates","CrystEngComm","2012","14","17","5639","","10.1039/c2ce25434d","","x-ray","0.71073","MoKα","","0.1043","0.0767","","","0.1925","0.214","","","","","","1.126","","","","has coordinates","180414","2020-10-21","18:00:00",""
"7208301","12.625","0.002","12.625","0.002","19.867","0.002","90","","90","","120","","2742.4","0.7","250","2","250","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C30 H46 Co2 N6 Na8 O35 -","- C30 H12 Co2 N6 Na7.98 O35.03 -","- C60 H24 Co4 N12 Na15.96 O70.06 -","2","0.166667","","Dul, Marie-Claire; Lescouëzec, Rodrigue; Chamoreau, Lise-Marie; Journaux, Yves; Carrasco, Rosa; Castellano, María; Ruiz-García, Rafael; Cano, Joan; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina; Fabelo, Oscar; Pardo, Emilio","Self-assembly, metal binding ability, and magnetic properties of dinickel(ii) and dicobalt(ii) triple mesocates","CrystEngComm","2012","14","17","5639","","10.1039/c2ce25434d","","","0.71073","MoKα","","0.1107","0.0809","","","0.239","0.2621","","","","","","1.134","","","","has coordinates","180414","2020-10-21","18:00:00",""
"7210226","16.9317","0.0008","16.9317","0.0008","22.0782","0.0019","90","","90","","120","","5481.4","0.6","291","2","291","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C72 H76 Cl3 Cu7 N24 O8 S8 W2 -","- C72 H75.96 Cl3 Cu7 N24 O8 S8 W2 -","- C144 H151.92 Cl6 Cu14 N48 O16 S16 W4 -","2","0.166667","","Qin, Ling; Pan, Zhaorui; Qian, Liwu; Li, Yizhi; Guo, Zijian; Zheng, Hegen","Anion-selectivity of cationic cluster‒organic nanospheres based on a nest-shaped [MS4Cu3X3] clustermonomer with a ditopic ligand","CrystEngComm","2013","15","25","5016","","10.1039/c3ce40542g","","","0.71073","MoKα","","0.073","0.048","","","0.0907","0.0953","","","","","","1.05","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7210227","16.817","0.002","16.817","0.002","22.226","0.006","90","","90","","120","","5443.6","1.7","291","2","291","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C72 H76 Cl3 Cu7 Mo2 N24 O8 S8 -","- C72 H75.9996 Cl3 Cu7 Mo2 N24 O8 S8 -","- C144 H151.999 Cl6 Cu14 Mo4 N48 O16 S16 -","2","0.166667","","Qin, Ling; Pan, Zhaorui; Qian, Liwu; Li, Yizhi; Guo, Zijian; Zheng, Hegen","Anion-selectivity of cationic cluster‒organic nanospheres based on a nest-shaped [MS4Cu3X3] clustermonomer with a ditopic ligand","CrystEngComm","2013","15","25","5016","","10.1039/c3ce40542g","","","0.71073","MoKα","","0.0653","0.0514","","","0.1257","0.132","","","","","","1.094","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7210228","17.0636","0.0014","17.0636","0.0014","22.372","0.003","90","","90","","120","","5641.3","1","291","2","291","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C72 H74 Br3 Cu7 N24 O7 S8 W2 -","- C72 H74.0004 Br3 Cu7 N24 O7 S8 W2 -","- C144 H148.001 Br6 Cu14 N48 O14 S16 W4 -","2","0.166667","","Qin, Ling; Pan, Zhaorui; Qian, Liwu; Li, Yizhi; Guo, Zijian; Zheng, Hegen","Anion-selectivity of cationic cluster‒organic nanospheres based on a nest-shaped [MS4Cu3X3] clustermonomer with a ditopic ligand","CrystEngComm","2013","15","25","5016","","10.1039/c3ce40542g","","","0.71073","MoKα","","0.0837","0.0542","","","0.1097","0.1186","","","","","","1.077","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7211444","5.5732","0.0006","5.5732","0.0006","25.339","0.004","90","","90","","120","","681.6","0.15","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- H2 I4 K4 O27 V4 Zn4 -","- I4 K4 O27 V4 Zn4 -","- I4 K4 O27 V4 Zn4 -","1","0.0833333","","Yang, Bing-Ping; Xu, Xiang; Huang, Chao; Mao, Jiang-Gao","K4TM4(V2O7)2(IO3)4(H2O) (TM = Zn, Ni, Co): a series of quinary mixed metal‒vanadium(v)‒iodates","CrystEngComm","2013","15","48","10464","","10.1039/c3ce41653d","","","0.71073","MoKα","","0.0387","0.0347","","","0.07","0.0717","","","","","","1.23","","","","has coordinates","180445","2020-10-21","18:00:00",""
"7211445","5.5379","0.0002","5.5379","0.0002","25.931","0.002","90","","90","","120","","688.72","0.06","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- H2 I4 K4 Ni4 O27 V4 -","- I4 K3.992 Ni4 O27 V4 -","- I4 K3.992 Ni4 O27 V4 -","1","0.0833333","","Yang, Bing-Ping; Xu, Xiang; Huang, Chao; Mao, Jiang-Gao","K4TM4(V2O7)2(IO3)4(H2O) (TM = Zn, Ni, Co): a series of quinary mixed metal‒vanadium(v)‒iodates","CrystEngComm","2013","15","48","10464","","10.1039/c3ce41653d","","","0.71073","MoKα","","0.0521","0.0512","","","0.0968","0.0972","","","","","","1.391","","","","has coordinates","180445","2020-10-21","18:00:00",""
"7211446","5.584","0.0002","5.584","0.0002","25.991","0.002","90","","90","","120","","701.85","0.06","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- Co4 H2 I4 K4 O27 V4 -","- Co4 I4 K4.002 O27 V4 -","- Co4 I4 K4.002 O27 V4 -","1","0.0833333","","Yang, Bing-Ping; Xu, Xiang; Huang, Chao; Mao, Jiang-Gao","K4TM4(V2O7)2(IO3)4(H2O) (TM = Zn, Ni, Co): a series of quinary mixed metal‒vanadium(v)‒iodates","CrystEngComm","2013","15","48","10464","","10.1039/c3ce41653d","","","0.71073","MoKα","","0.0279","0.027","","","0.0689","0.0697","","","","","","1.212","","","","has coordinates","180445","2020-10-21","18:00:00",""
"7211904","12.6031","0.0009","12.6031","0.0009","22.563","0.003","90","","90","","120","","3103.7","0.5","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C18 H66 Cl N12 Ni2 O38 V15 -","- C18 H60 Cl N12 Ni2 O38 V15 -","- C36 H120 Cl2 N24 Ni4 O76 V30 -","2","0.166667","","Yi, Zhihui; Yu, Xiaoyang; Xia, Wujiong; Zhao, Liyan; Yang, Chao; Chen, Qian; Wang, XiaoLin; Xu, Xianzhu; Zhang, Xiao","Influence of the steric hindrance of organic amines on the supramolecular network based on polyoxovanadates","CrystEngComm","2010","12","1","242","","10.1039/b916793p","","","0.71073","MoKα","","0.0706","0.0678","","","0.2038","0.207","","","","","","1.075","","","","has coordinates","180450","2020-10-21","18:00:00",""
"7212351","11.741","0.0006","11.741","0.0006","13.3199","0.0013","90","","90","","120","","1590.16","0.19","294","2","294","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C2.5 H1.5 Mn0.75 N2 O2 -","- C2.5 H1.5 Mn0.75 N2 O2 -","- C30 H18 Mn9 N24 O24 -","12","1","","Liao, Ju-Hsiou; Chen, Wan-Ting; Tsai, Cherng-Shiaw; Yang, Ching-Chun; Wang, Chih-Chieh","Synthesis, structure and hydrogen adsorption of a novel porous metal‒organic framework, Mn9(btt)2(HCOO)12·0.7DMF·0.9H2O, where btt = 1,3,5-benzenetristetrazolate","CrystEngComm","2010","12","10","3033","","10.1039/b925769a","","","0.71073","MoKα","","0.0524","0.049","","","0.1004","0.1019","","","","","","1.201","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212905","9.432573","0.000222","9.432573","0.000222","6.883337","0.000169","90","","90","","120","","530.38","0.02","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca9.8 Cd0.2 O26 P6 -","- Ca9.802 Cd0.198 O26 P6 -","- Ca9.802 Cd0.198 O26 P6 -","1","0.0833333","","Terra, J.; Gonzalez, G. B.; Rossi, A. M.; Eon, J. G.; Ellis, D. E.","Theoretical and experimental studies of substitution of cadmium into hydroxyapatite.","Physical chemistry chemical physics : PCCP","2010","12","47","15490","15500","10.1039/c0cp01032d","powder diffraction","","0.13846","Synchrotron","","","","","","","","","1.9171","1.1198","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212906","9.422709","0.000213","9.422709","0.000213","6.865845","0.000162","90","","90","","120","","527.93","0.02","298","","298","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca8.77 Cd1.23 O26 P6 -","- Ca8.778 Cd1.222 O26 P6 -","- Ca8.778 Cd1.222 O26 P6 -","1","0.0833333","","Terra, J.; Gonzalez, G. B.; Rossi, A. M.; Eon, J. G.; Ellis, D. E.","Theoretical and experimental studies of substitution of cadmium into hydroxyapatite.","Physical chemistry chemical physics : PCCP","2010","12","47","15490","15500","10.1039/c0cp01032d","powder diffraction","","0.13846","Synchrotron","","","","","","","","","1.6859","1.1167","","","","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7213603","13.3014","0.0003","13.3014","0.0003","5.9918","0.0002","90","","90","","120","","918.08","0.04","120","2","120","2","","","","","","","","6","P 63/m","-P 6c","176","3","","","- C15 H15 Ag Cl N3 O8 -","- C15 H15 Ag Cl N3 O8 -","- C30 H30 Ag2 Cl2 N6 O16 -","2","0.166667","","Puttreddy, Rakesh; Steel, Peter J.","Pyridine N-oxide: a hyperdentate argentophile","CrystEngComm","2014","16","4","556","","10.1039/c3ce42030b","","","0.71073","MoKα","","0.0454","0.0412","","","0.1019","0.1051","","","","","","1.169","","","","has coordinates","180467","2020-10-21","18:00:00",""
"7214004","8.2519","0.0003","8.2519","0.0003","7.6934","0.0004","90","","90","","120","","453.69","0.03","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- H3 In2 O9 P3 -","- H3 In2 O9 P3 -","- H6 In4 O18 P6 -","2","0.166667","","Wang, Xuelei; Yan, Yan; Wu, Junbiao; Zhang, Chuanqi; Li, Jiyang","Solvothermal syntheses and structures of four indium‒phosphite coordination polymers","CrystEngComm","2014","16","11","2266","","10.1039/c3ce42059k","","","0.71073","MoKα","","0.018","0.0175","","","0.0433","0.0437","","","","","","1.233","","","","has coordinates","180471","2020-10-21","18:00:00",""
"7215673","25.5089","0.0009","25.5089","0.0009","34.3318","0.0017","90","","90","","120","","19346.9","1.4","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C104 H458 Cl29 Dy25 Ni2 O364 -","- C96 H158 Cl5 Dy25 Ni2 O184 -","- C192 H316 Cl10 Dy50 Ni4 O368 -","2","0.166667","","Liu, Da-Peng; Peng, Jun-Bo; Lin, Xin-Ping; Huang, Que; Kong, Xiang-Jian; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","Myo-inositol supported heterometallic Dy24M2 (M = Ni, Mn) cages","CrystEngComm","2014","16","25","5527","","10.1039/c4ce00362d","","","0.71073","MoKα","","0.1879","0.0893","","","0.1902","0.2274","","","","","","0.853","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215674","25.525","0.0011","25.525","0.0011","34.3906","0.0014","90","","90","","120","","19404.5","1.4","173","2","173","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C104 H458 Cl29 Dy25 Mn2 O364 -","- C96 H158 Cl5 Dy25 Mn2 O184 -","- C192 H316 Cl10 Dy50 Mn4 O368 -","2","0.166667","","Liu, Da-Peng; Peng, Jun-Bo; Lin, Xin-Ping; Huang, Que; Kong, Xiang-Jian; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","Myo-inositol supported heterometallic Dy24M2 (M = Ni, Mn) cages","CrystEngComm","2014","16","25","5527","","10.1039/c4ce00362d","","","0.71073","MoKα","","0.2094","0.0877","","","0.1767","0.2193","","","","","","0.82","","","","has coordinates","180487","2020-10-21","18:00:00",""
"7215684","9.434668","0.000279","9.434669","0.000279","6.8893","0.00021","90","","90","","120","","531.08","0.03","298","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca9.921 O26 P6 Sr0.079 -","- Ca9.918 O26 P6 Sr0.082 -","- Ca9.918 O26 P6 Sr0.082 -","1","0.0833333","","Terra, Joice; Dourado, Erico Rodrigues; Eon, Jean-Guillaume; Ellis, Donald E.; Gonzalez, Gabriela; Rossi, Alexandre Malta","The structure of strontium-doped hydroxyapatite: an experimental and theoretical study.","Physical chemistry chemical physics : PCCP","2009","11","3","568","577","10.1039/b802841a","powder diffraction","","0.13845","synchrotron","","","","","","","","","2.1246","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215685","9.452039","0.000276","9.452039","0.000276","6.904128","0.000208","90","","90","","120","","534.18","0.03","298","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca9.569 O26 P6 Sr0.431 -","- Ca9.566 O26 P6 Sr0.434 -","- Ca9.566 O26 P6 Sr0.434 -","1","0.0833333","","Terra, Joice; Dourado, Erico Rodrigues; Eon, Jean-Guillaume; Ellis, Donald E.; Gonzalez, Gabriela; Rossi, Alexandre Malta","The structure of strontium-doped hydroxyapatite: an experimental and theoretical study.","Physical chemistry chemical physics : PCCP","2009","11","3","568","577","10.1039/b802841a","powder diffraction","","0.13845","synchrotron","","","","","","","","","1.9122","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215686","9.48686","0.000238","9.48686","0.000238","6.941954","0.000181","90","","90","","120","","541.07","0.02","298","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca8.542 O26 P6 Sr1.458 -","- Ca8.546 O26 P6 Sr1.454 -","- Ca8.546 O26 P6 Sr1.454 -","1","0.0833333","","Terra, Joice; Dourado, Erico Rodrigues; Eon, Jean-Guillaume; Ellis, Donald E.; Gonzalez, Gabriela; Rossi, Alexandre Malta","The structure of strontium-doped hydroxyapatite: an experimental and theoretical study.","Physical chemistry chemical physics : PCCP","2009","11","3","568","577","10.1039/b802841a","powder diffraction","","0.13845","synchrotron","","","","","","","","","2.0634","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7215687","9.470575","0.000243","9.470575","0.000243","6.92324","0.000185","90","","90","","120","","537.77","0.02","298","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca9.045 O26 P6 Sr0.955 -","- Ca9.048 O26 P6 Sr0.952 -","- Ca9.048 O26 P6 Sr0.952 -","1","0.0833333","","Terra, Joice; Dourado, Erico Rodrigues; Eon, Jean-Guillaume; Ellis, Donald E.; Gonzalez, Gabriela; Rossi, Alexandre Malta","The structure of strontium-doped hydroxyapatite: an experimental and theoretical study.","Physical chemistry chemical physics : PCCP","2009","11","3","568","577","10.1039/b802841a","powder diffraction","","0.13845","synchrotron","","","","","","","","","1.8913","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7216764","13.2544","0.0002","13.2544","0.0002","15.6722","0.0004","90","","90","","120","","2384.41","0.08","293","2","293","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C3.42 H0 Al2 F2 Mn0.56 N0 O11.84 P3 -","- C3.44 Al2 F2 Mn0.56 O11.8363 P3 -","- C20.64 Al12 F12 Mn3.36 O71.018 P18 -","6","0.5","","Liu, Hao; Tian, Zhijian; Gies, H.; Wei, Ying; Marler, Bernd; Wang, Lei; Wang, Yasong; Li, Dawei","Mn2+ Cation-Directed Ionothermal Synthesis of an Open-Framework Fluorinated Aluminium Phosphite-Phosphate","RSC Advances","2014","","","","","10.1039/c4ra05350h","","","0.71073","MoKα","","0.0607","0.0471","","","0.1202","0.1277","","","","","","1.262","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217894","9.4232","0.0002","9.4232","0.0002","6.8833","0.0002","90","","90","","120","","529.33","0.02","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Calcium phosphate(V) hydroxide (10.08/5.9/2.32)","","- Ca10.084 H3.39 O27.15 P5.94 -","- Ca10.084 H2.556 O27.148 P5.94 -","- Ca10.084 H2.556 O27.148 P5.94 -","","","","Espanol, Montserrat; Portillo, Joaquim; Manero, Jose-Maria; Ginebra, Maria-Pau","Investigation of the hydroxyapatite obtained as hydrolysis product of α-tricalcium phosphate by transmission electron microscopy","CrystEngComm","2010","12","10","3318","3326","10.1039/c001754j","","","","","","0.0604","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7221244","10.526","","10.526","","7.737","","90","","90","","120","","742.386","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ba5 S (As O4)2 S O4","","- As2 Ba5 O12 S2 -","- As2.001 Ba5 O12 S1.999 -","- As4.002 Ba10 O24 S3.998 -","2","0.166667","","Schiff-Francois, A.; Savelsberg, G.; Schaefer, H.","Ueber Schwefelapatite: Ba5 S (As O4)2 S O4, Sr5 S (As O4)2 S O4 und Sr5 S (P O4)2 S O4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1979","34","","764","765","","","","","","","","","","","","","","","","","","","","","","has coordinates","146130","2020-10-21","18:00:00",""
"7221277","9.7405","","9.7405","","7.004","","90","","90","","120","","575.492","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ca10 (V O4)6 (O H)2","","- Ca10 H2 O26 V6 -","- Ca10 O26 V6 -","- Ca10 O26 V6 -","1","0.0833333","","Bauer Boechat, C.; Eon, J.G.; da Silva San Gil, R.A.; Malta Rossi, A.; de Castro Perez, C.A.","Structure of vanadate in calcium phosphate and vanadate apatite solid solutions","Physical Chemistry Chemical Physics","2000","2","","4225","4230","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222443","18.0026","0.0005","18.0026","0.0005","13.3316","0.0002","90","","90","","120","","3741.82","0.16","293","2","293","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C12 H72 Be12 N8 O54 P16 -","- C12 H60 Be12 N8 O48 P16 -","- C24 H120 Be24 N16 O96 P32 -","2","0.166667","","Wang, Guo-Ming; Li, Jin-Hua; Wei, Li; Han, Song-De; Zhao, Xiao-Meng; Bao, Zhen-Zhen","An open-framework beryllium phosphite with extra-large 18-ring channels","CrystEngComm","2015","17","44","8414","","10.1039/C5CE01507C","","","0.71073","MoKα","","0.0929","0.0783","","","0.1518","0.1593","","","","","","1.228","","","","has coordinates","171044","2020-10-21","18:00:00",""
"7222799","15.1683","","15.1683","","8.8708","","90","","90","","120","","1767.53","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ba13.3498 Al30.6996 Si5.3004 O70","","- Al30.6996 Ba13.3498 O70 Si5.3004 -","- Al30.6996 Ba13.35 O70 Si5.3004 -","- Al30.6996 Ba13.35 O70 Si5.3004 -","1","0.0833333","","Rief, A.; Kubel, F.; Hagemann, H.","Optical and structural properties of a Eu(II)-doped silico-aluminate with channel structure and partial site occupation","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","1535","1542","","","","","","","","","","","","","","","","","","","","","","has coordinates","165006","2020-10-21","18:00:00",""
"7222914","6.24","","6.24","","3.53","","90","","90","","120","","119.035","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Y (O H)3","","- H3 O3 Y -","- O3 Y -","- O6 Y2 -","2","0.166667","","Schubert, K.; Seitz, A.","Kristallstruktur von Y(OH)~3~","Zeitschrift für Naturforschung A","1946","1","6","321","321","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222999","14.8002","0.0016","14.8002","0.0016","24.789","0.003","90","","90","","120","","4702.5","0.9","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C72 H50 Ag11 Co2 I15 N12 O -","- C72 H48 Ag11.0001 Co2 I15 N12 O -","- C144 H96 Ag22.0002 Co4 I30 N24 O2 -","2","0.166667","","Yu, Tanlai; Fu, Yangbo; Wang, Yilin; Hao, Pengfei; Shen, Junju; Fu, Yunlong","Hierarchical symmetry transfer and flexible charge matching in five [M(phen)3]2+directed iodoargentates with 1 to 3D frameworks","CrystEngComm","2015","17","45","8752","","10.1039/C5CE01692D","","","0.71073","MoKα","","0.1406","0.1329","","","0.2941","0.2981","","","","","","1.288","","","","has coordinates,has disorder","173758","2020-10-21","18:00:00",""
"7223001","14.868","0.003","14.868","0.003","25.012","0.004","90","","90","","120","","4788.3","1.6","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C144 H100 Ag24 Cu4 I33 N24 O2 -","- C144 H96 Ag24 Cu4 I33 N24 O2 -","- C144 H96 Ag24 Cu4 I33 N24 O2 -","1","0.0833333","","Yu, Tanlai; Fu, Yangbo; Wang, Yilin; Hao, Pengfei; Shen, Junju; Fu, Yunlong","Hierarchical symmetry transfer and flexible charge matching in five [M(phen)3]2+directed iodoargentates with 1 to 3D frameworks","CrystEngComm","2015","17","45","8752","","10.1039/C5CE01692D","","","0.71073","MoKα","","0.2204","0.1696","","","0.3761","0.4104","","","","","","1.033","","","","has coordinates","173758","2020-10-21","18:00:00",""
"7223003","14.8402","0.0004","14.8402","0.0004","24.9918","0.0008","90","","90","","120","","4766.6","0.2","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C144 H100 Ag24 Co4 I33 N24 O2 -","- C144 H96 Ag24 Co4 I33 N24 O2 -","- C144 H96 Ag24 Co4 I33 N24 O2 -","1","0.0833333","","Yu, Tanlai; Fu, Yangbo; Wang, Yilin; Hao, Pengfei; Shen, Junju; Fu, Yunlong","Hierarchical symmetry transfer and flexible charge matching in five [M(phen)3]2+directed iodoargentates with 1 to 3D frameworks","CrystEngComm","2015","17","45","8752","","10.1039/C5CE01692D","","","0.71073","MoKα","","0.0901","0.0724","","","0.2319","0.2486","","","","","","1.156","","","","has coordinates","173758","2020-10-21","18:00:00",""
"7223244","17.556","0.003","17.556","0.003","6.2713","0.001","90","","90","","120","","1673.9","0.5","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- Mo18 Nd4 O72 Th6 -","- Mo18 Nd4.076 O72 Th6 -","- Mo18 Nd4.076 O72 Th6 -","1","0.0833333","","Xiao, Bin; Schlenz, Hartmut; Bosbach, Dirk; Suleimanov, Evgeny V.; Alekseev, Evgeny V.","The structural effects of alkaline- and rare-earth element incorporation into thorium molybdates","CrystEngComm","2016","18","1","113","","10.1039/C5CE02040A","","","0.71073","MoKα","","0.0914","0.0414","","","0.1117","0.1435","","","","","","1.14","","","","has coordinates","175973","2020-10-21","18:00:00",""
"7224690","9.43197","0.00015","9.43197","0.00015","6.92605","0.00012","90","","90","","120","","533.606","0.015","300","","300","","","","","","","","","6","P 63/m","-P 6c","176","","","","- Ca8.88 F2 La1.12 O24 P5 Si -","- Ca8.884 F2 La1.116 O24 P5 Si -","- Ca8.884 F2 La1.116 O24 P5 Si -","1","0.0833333","","Haikun Liu; Libing Liao; Maxim S. Molokeev; Qingfeng Guo; Yuanyuan Zhang; Lefu Mei","A novel single-phase white light emitting phosphor Ca9La(PO4)5(SiO4)F2:Dy3+: synthesis, crystal structure and luminescence properties","RSC Advances","2016","6","0","24577","24583","10.1039/c5ra23348h","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.63","1.691","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7224691","9.42716","0.00015","9.42716","0.00015","6.92158","0.00012","90","","90","","120","","532.718","0.015","300","","300","","","","","","","","","7","P 63/m","-P 6c","176","","","","- Ca8.98 Dy0.11 F2 La0.92 O24 P5 Si -","- Ca8.9758 Dy0.10242 F2 La0.9212 O24 P5 Si -","- Ca8.9758 Dy0.10242 F2 La0.9212 O24 P5 Si -","1","0.0833333","","Haikun Liu; Libing Liao; Maxim S. Molokeev; Qingfeng Guo; Yuanyuan Zhang; Lefu Mei","A novel single-phase white light emitting phosphor Ca9La(PO4)5(SiO4)F2:Dy3+: synthesis, crystal structure and luminescence properties","RSC Advances","2016","6","0","24577","24583","10.1039/c5ra23348h","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.11","1.53","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"7227153","14.989","0.002","14.989","0.002","28.467","0.006","90","","90","","120","","5538.8","1.6","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C54 H106 Cl N36 Ni3 O53 V15 -","- C54 H72 Cl N36 Ni3 O53.0001 V15 -","- C108 H144 Cl2 N72 Ni6 O106 V30 -","2","0.166667","","Guo, Hai-Yang; Zhang, Ting-Ting; Lin, Po-Han; Xiao-Zhang, Xiao-Zhang; Cui, Xiao-Bing; Huo, Qi-Sheng; Xu, Ji-Qing","Preparation, structure and characterization of a series of vanadates","CrystEngComm","2017","19","2","265","","10.1039/C6CE02205G","","","0.71073","MoKα","","0.0815","0.0625","","","0.1776","0.1928","","","","","","1.088","","","","has coordinates","191545","2020-10-21","18:00:00",""
"7227674","15.5682","0.0006","15.5682","0.0006","6.8268","0.0003","90","","90","","120","","1432.93","0.1","100","2","99.99","","","","","","","","","4","P 63/m","-P 6c","176","","","","- C27 H39 N3 O9 -","- C27 H39 N3 O9 -","- C54 H78 N6 O18 -","2","0.166667","","Lynes, Amy D.; Hawes, Chris S.; Ward, Edward N.; Haffner, Benjamin; Möbius, Matthias E.; Byrne, Kevin; Schmitt, Wolfgang; Pal, Robert; Gunnlaugsson, Thorfinnur","Benzene-1,3,5-tricarboxamide n-alkyl ester and carboxylic acid derivatives: tuneable structural, morphological and thermal properties","CrystEngComm","2017","19","10","1427","","10.1039/C7CE00206H","","","1.54178","CuKα","","0.0615","0.0533","","","0.1608","0.1674","","","","","","1.064","","","","has coordinates,has disorder","195020","2020-10-21","18:00:00",""
"7229642","9.7371","0.0002","9.7371","0.0002","22.4924","0.0005","90","","90","","120","","1846.82","0.07","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","potassium manganese(II) oxalatophosphite","","- C2 H6 K2 Mn2 O12 P2 -","- C2 H6 K2 Mn2 O12 P2 -","- C12 H36 K12 Mn12 O72 P12 -","6","0.5","","Orive, Joseba; Sivasamy, Ramesh; Fernández de Luis, Roberto; Mosquera, Edgar; Arriortua, María I.","K2MnII2(H2O)2C2O4(HPO3)2: a new 2D manganese(ii) oxalatophosphite with double-layered honeycomb sheets stabilized by potassium ions","CrystEngComm","2018","20","3","301","","10.1039/C7CE01637A","","x-ray","0.71073","MoKα","","0.0259","0.0241","","","0.0529","0.054","","","","","","1.053","","","","has coordinates","229160","2020-10-21","18:00:00",""
"7230736","8.972","0.0013","8.972","0.0013","21.077","0.004","90","","90","","120","","1469.3","0.4","293","2","293.15","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C18 H32 Co F N13 O7 -","- C18 H31.9999 Co F N13 O7 -","- C36 H63.9998 Co2 F2 N26 O14 -","2","0.166667","","Jian, Fang Fang; Liu, E.; Ma, Jun Ying","Interesting fluorine anion water clusters [F−·(H2O)n] in metal complex crystals","CrystEngComm","2018","20","27","3849","","10.1039/C8CE00532J","","","0.71073","MoKα","","0.0542","0.0398","","","0.1113","0.12","","","","","","1.053","","","","has coordinates","228914","2020-10-21","18:00:00",""
"7231032","20.84368","0.00081","20.84368","0.00081","24.3675","0.0025","90","","90","","120","","9168.3","1.1","","","298","","","","","","","","","4","P 63/m","-P 6c","176","","Hf-CAU-39","Hf-CAU-39","- C72 Hf12 N24 O104.38 -","- C72 Hf12 N24 O104.38 -","- C144 Hf24 N48 O208.76 -","2","0.166667","","Waitschat, Steve; Reinsch, Helge; Arpacioglu, Merve; Stock, Norbert","Direct water-based synthesis and characterization of new Zr/Hf-MOFs with dodecanuclear clusters as IBUs","CrystEngComm","2018","20","35","5108","","10.1039/C8CE00949J","","","1.5406","","","","","","","","","","","","","","","","","","has coordinates","229125","2020-10-21","18:00:00",""
"7233207","9.7993","0.0004","9.7993","0.0004","7.2938","0.0003","90","","90","","120","","606.56","0.04","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cu0.476 O12.83 P3 Sr5 -","- Cu0.476 O12.83 P3 Sr5 -","- Cu0.952 O25.66 P6 Sr10 -","2","0.166667","","Kazin, Pavel E.; Zykin, Mikhail A.; Jesche, Anton; Seidler, Maximilian L.; Tafeenko, Victor A.; Eliseev, Andrey A.; Trusov, Lev A.; Jansen, Martin","Manifestation of strong magnetic and giant Raman anisotropy in single crystals of Cu for H substituted strontium hydroxyapatite","CrystEngComm","2019","21","33","4976","","10.1039/C9CE00923J","","x-ray","0.71073","MoKα","","0.0537","0.0262","","","0.0254","0.0278","","","","1.1","1.1","0.97","","","","has coordinates","223529","2020-10-21","18:00:00",""
"7233419","10.38775","","10.38775","","5.69198","","90","","90","","120","","531.909","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Y Ca3 (Al O)3 (B O3)4","","- Al3 B4 Ca3 O15 Y -","- Al3 B4 Ca2.999 O15 Y1.001 -","- Al6 B8 Ca5.998 O30 Y2.002 -","2","0.166667","","Yue, Cheng; Zhu, Dachuan; Yan, Qun; Pu, Yong","A red-emitting Sr3La(1−x)Eux(AlO)3(BO3)4 phosphor with high thermal stability and color purity for near-UV-excited wLEDs","RSC Advances","2019","9","45","26364","","10.1039/C9RA05017E","","","","","","","","","","","","","","","","","","","","","has coordinates","217667","2020-10-21","18:00:00",""
"7233922","20.811","0.003","20.811","0.003","22.62","0.003","90","","90","","120","","8484","2","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C48 H84 Cl8 Cu12 N36 O64 -","- C48 H36 Cl8 Cu12 N36 O64 -","- C96 H72 Cl16 Cu24 N72 O128 -","2","0.166667","","Ferrer, Sacramento; Hernández-Gil, Javier; Valverde-Muñoz, Francisco Javier; Lloret, Francisco; Castiñeiras, Alfonso","Hexanuclear Cu3O‒3Cu triazole-based units as novel core motifs for high nuclearity copper(ii) frameworks","RSC Advances","2019","9","50","29357","","10.1039/C9RA05922A","","","0.71073","MoKα","","0.1125","0.0798","","","0.2308","0.2547","","","","","","1.041","","","","has coordinates","218413","2020-10-21","18:00:00",""
"7234398","8.148","0.0012","8.148","0.0012","9.394","0.0019","90","","90","","120","","540.11","0.16","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Au7 Sn3 Y3 -","- Au7 Sn3 Y3 -","- Au14 Sn6 Y6 -","2","0.166667","","Alessia Provino; Simon Steinberg; Volodymyr Smetana; Ruta Kulkarni; Sudesh K. Dhar; Pietro Manfrinetti; Anja-Verena Mudring","Gold-rich R3Au7Sn3: establishing the interdependence between electronic features and physical properties","Journal of Materials Chemistry C","2015","3","","8311","8321","10.1039/C5TC00884K","","","0.71073","MoKα","","0.0455","0.0295","","","0.0597","0.0645","","","","","","1.049","","","","has coordinates","219116","2020-10-21","18:00:00",""
"7234399","8.185","0.003","8.185","0.003","9.415","0.003","90","","90","","120","","546.2","0.3","296","2","296","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Au7 Gd3 Sn3 -","- Au7 Gd3 Sn3 -","- Au14 Gd6 Sn6 -","2","0.166667","","Alessia Provino; Simon Steinberg; Volodymyr Smetana; Ruta Kulkarni; Sudesh K. Dhar; Pietro Manfrinetti; Anja-Verena Mudring","Gold-rich R3Au7Sn3: establishing the interdependence between electronic features and physical properties","Journal of Materials Chemistry C","2015","3","","8311","8321","10.1039/C5TC00884K","","","0.71073","MoKα","","0.0394","0.0295","","","0.0593","0.0622","","","","","","1.096","","","","has coordinates","219116","2020-10-21","18:00:00",""
"7235036","9.67202","0.000084","9.67202","0.000084","7.25393","0.000071","90","","90","","120","","587.677","0.009","300","","300","","","","","","","","","5","P 63/m","-P 6c","176","","","","- Ca O12 P2 Si Sr4 -","- Ca0.022 O4.21467 P0.881 Si0.119 Sr1.64467 -","- Ca0.132 O25.288 P5.286 Si0.714 Sr9.868 -","6","0.5","","Manli Zhang; Zhiguo Xia; Maxim S. Molokeev; Lin Shi; Quanlin Liu","New insight into the crystal structure of Sr4Ca(PO4)2SiO4 and the photoluminescence tuning of Sr4Ca(PO4)2SiO4:Ce3+,Na+,Eu2+ phosphors","Journal of Materials Chemistry C","2016","4","","9078","9084","10.1039/C6TC03373C","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.93","2.19","","","","","","","has coordinates","227701","2020-10-21","18:00:00",""
"7236180","20.772","0.009","20.772","0.009","21.053","0.001","90","","90","","120","","7867","5","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C36 H54 Cr3 Cu3 N13 O49 -","- C36 H24 Cr3 Cu3 N6 O28 -","- C72 H48 Cr6 Cu6 N12 O56 -","2","0.166667","","Yang, Qing-Yuan; Chen, Kai-Jie; Schoedel, Alexander; Wojtas, Lukasz; Perry IV, John J.; Zaworotko, Michael J.","Network diversity through two-step crystal engineering of a decorated 6-connected primary molecular building block","CrystEngComm","2016","18","44","8578","","10.1039/C6CE01544A","","","1.54178","CuKα","","0.0887","0.0726","","","0.2137","0.2411","","","","","","1.089","","","","has coordinates","234716","2020-10-21","18:00:00",""
"7237228","19.4081","0.0015","19.4081","0.0015","24.197","0.002","90","","90","","120","","7893.3","1.1","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C102 H60 Co6 N18 O25 -","- C102 H60 Co6 N18 O25 -","- C204 H120 Co12 N36 O50 -","2","0.166667","","Xue, Ying-Ying; Li, Shu-Ni; Jiang, Yu-Cheng; Hu, Man-Cheng; Zhai, Quan-Guo","Quest for 9-connected robust metal‒organic framework platforms based on [M3(O/OH)(COO)6(pyridine)3] clusters as excellent gas separation and asymmetric supercapacitor materials","Journal of Materials Chemistry A","2019","7","9","4640","","10.1039/C8TA09080G","","","1.54178","CuKα","","0.1003","0.0594","","","0.0836","0.0901","","","","","","0.968","","","","has coordinates","237504","2020-10-21","18:00:00",""
"7237229","19.2359","0.0013","19.2359","0.0013","24.063","0.002","90","","90","","120","","7710.9","1","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C102 H60 N18 Ni6 O25 -","- C102 H60 N18 Ni6 O25 -","- C204 H120 N36 Ni12 O50 -","2","0.166667","","Xue, Ying-Ying; Li, Shu-Ni; Jiang, Yu-Cheng; Hu, Man-Cheng; Zhai, Quan-Guo","Quest for 9-connected robust metal‒organic framework platforms based on [M3(O/OH)(COO)6(pyridine)3] clusters as excellent gas separation and asymmetric supercapacitor materials","Journal of Materials Chemistry A","2019","7","9","4640","","10.1039/C8TA09080G","","","1.54178","CuKα","","0.1218","0.0714","","","0.1662","0.1893","","","","","","0.9","","","","has coordinates","237504","2020-10-21","18:00:00",""
"7240209","7.8692","0.0005","7.8692","0.0005","7.0721","0.0006","90","","90","","120","","379.26","0.05","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Al1.17 O6.33 P1.83 -","- Al1.16667 O6.416 P1.8334 -","- Al3.5 O19.248 P5.5002 -","3","0.25","","Hao, Yucheng; Pan, Yang; Lin, Yuan; He, Linbo; Ge, Guangjie; Ruan, Yu; Zhou, Haida; Xue, Yang; Koirala, Kisan","Highly Porous Aluminophosphates with Unique Three Dimensional Open Framework Structures from Mild Hydrothermal Syntheses","CrystEngComm","2020","","","","","10.1039/D0CE00075B","","","0.71073","MoKα","","0.0362","0.0254","","","0.0515","0.0538","","","","","","1.076","","","","has coordinates","249769","2020-10-21","18:00:00",""
"7240789","20.36","0.007","20.36","0.007","25.461","0.011","90","","90","","120","","9140","6","93","2","93","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C162 H288 Cl18 N12 O78 -","- C240 H276 N12 O60 -","- C240 H276 N12 O60 -","1","0.0833333","","Shimoyama, Daisuke; Sekiya, Ryo; Maekawa, Hiroyuki; Kudo, Hiroto; HAINO, Takeharu","One-dimensional arrangement of NORIA in the solid-state","CrystEngComm","2020","","","","","10.1039/D0CE00650E","","","0.71073","MoKα","","0.2802","0.1895","","","0.5185","0.5845","","","","","","1.997","","","","has coordinates","253506","2020-10-21","18:00:00",""
"7240792","20.144","0.005","20.144","0.005","25.29","0.007","90","","90","","120","","8887","4","93","2","93","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C165 H234 Cl18 N12 O48 -","- C282 H324 N12 O60 -","- C282 H324 N12 O60 -","1","0.0833333","","Shimoyama, Daisuke; Sekiya, Ryo; Maekawa, Hiroyuki; Kudo, Hiroto; HAINO, Takeharu","One-dimensional arrangement of NORIA in the solid-state","CrystEngComm","2020","","","","","10.1039/D0CE00650E","","","0.71073","MoKα","","0.2126","0.1692","","","0.5562","0.6065","","","","","","2.862","","","","has coordinates,has disorder","253506","2020-10-21","18:00:00",""
"7241191","6.1202","0.0005","6.1202","0.0005","3.6957","0.0003","90","","90","","120","","119.883","0.017","173","2","173","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Bi F3 H2 O -","- Bi F3 H2.0004 O -","- Bi2 F6 H4.0008 O2 -","2","0.166667","","Liu, Xian; Yang, Can; Wu, Qi; Sun, Juan; Liang, Fei","From BiF3 to BiF3·H2O: Diverse Bi(Ⅲ) Coordination for Structural Transformation and Birefringence Regulation","CrystEngComm","2020","","","","","10.1039/D0CE01213K","","","0.71073","MoKα","","0.0419","0.0371","","","0.0878","0.0921","","","","","","1.298","","","","has coordinates","256237","2020-10-21","18:00:00",""
"7241402","9.3081","0.0002","9.3081","0.0002","6.67419","0.00018","90","","90","","120","","500.78","0.02","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Dy4 Mg O13 Si3 -","- Dy4 Mg O13 Si3 -","- Dy8 Mg2 O26 Si6 -","2","0.166667","","Kazin, Pavel E.; Zykin, Mikhail A.; Trusov, Lev A.; Vasiliev, Alexander V.; Kremer, Reinhard K.; Dinnebier, Robert E.; Jansen, Martin","Dysprosium magnesium silicate apatite featuring field and temperature stable slow magnetization relaxation","RSC Advances","2020","10","62","37588","37595","10.1039/D0RA07069F","powder diffraction","x-ray","1.5406","CuKalpha1","","0.0294","0.0282","","0.0318","0.0317","","","","1.43","","","","","","","has coordinates","258418","2020-10-21","18:00:00",""
"7241664","13.202","0.007","13.202","0.007","6.454","0.004","90","","90","","120","","974.2","0.9","93","2","93","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C3.67 H4.17 N0.5 O1.17 -","- C3.6667 H4.1668 N0.5 O1.1667 -","- C44.0004 H50.0016 N6 O14.0004 -","12","1","","Awatani, Ayano; Suzuki, Masaaki","Circular linkage of intramolecular multi-hydrogen bonding frameworks through nucleophilic substitutions of β-dicarbonyls onto cyanuric chloride and subsequent tautomerisation","RSC Advances","2020","10","64","39033","39036","10.1039/D0RA07677E","","","1.54187","CuKα","","0.0564","0.0502","","","0.1146","0.1171","","","","","","1.013","","","","has coordinates,has disorder","259581","2020-12-06","08:37:36",""
"7242265","9.39175","0.00004","9.39175","0.00004","6.8552","0.00003","90","","90","","120","","523.653","0.004","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","","terbium calcium silicate oxide apatite","","- Ca2 O26 Si6 Tb8 -","- Ca2.0022 O26 Si6 Tb7.9978 -","- Ca2.0022 O26 Si6 Tb7.9978 -","1","0.0833333","","Zykin, Mikhail A.; Dyakonov, Andrey K.; Eliseev, Artem A.; Trusov, Lev A.; Kremer, Reinhard K.; Dinnebier, Robert E.; Jansen, Martin; Kazin, Pavel E.","Tb-based silicate apatites showing slow magnetization relaxation with identical parameters for the Tb3+ and Dy3+ counter ions","RSC Advances","2021","11","12","6926","6933","10.1039/D1RA00613D","powder diffraction","x-ray","1.5406","CuKalpha1","","0.0131","0.0127","","0.0193","0.0193","","","","1.85","","","","","","","has coordinates","261954","2021-02-15","05:10:22",""
"7243636","32.1757","0.0018","32.1757","0.0018","13.5257","0.0011","90","","90","","120","","12126.8","1.4","293","2","293","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C360 H312 Cu15 I19 N24 O48 S24 -","- C360 H312 Cu15 I19 N24 O48 S24 -","- C360 H312 Cu15 I19 N24 O48 S24 -","1","0.0833333","","Hu, Chu-Xing; Xuan, Ya-Hui; Jiang, Zi-Hao; Lu, Tao; Yang, Jie; Yuan, Hui; Tian, You-Ping; Sun, Zheng-Guang; Jiang, Xuan-Feng","Self-assembly of cuprous iodide cluster-based calix[4]resorcinarenes and photocatalytic properties","CrystEngComm","2021","23","40","7179","7185","10.1039/D1CE01069G","","","1.54184","CuKα","","0.2253","0.1534","","","0.323","0.3443","","","","","","1.032","","","","has coordinates,has disorder","270442","2021-11-06","19:56:52",""
"7244078","12.071","0.003","12.071","0.003","12.118","0.002","90","","90","","120","","1529.1","0.6","296","2","296.15","","","","","","","","","7","P 63/m","-P 6c","176","","","","- B9 Cd3 H3 K Na5 O38 P6 -","- B9 Cd3 H3 K Na5 O38 P6 -","- B18 Cd6 H6 K2 Na10 O76 P12 -","2","0.166667","","Feng, Yuquan; Lv, Linxia; Bi, Dongqin; Zhong, Zhiguo; Li, Jing; Yue, Zilong; Zeng, Zhaoge; Zhang, Shuhan; Meng, Zhaohui","Efficient degradation of reactive brilliant red on the first open-framework borate-rich cadmium borophosphate","CrystEngComm","2022","24","3","479","483","10.1039/D1CE01449H","","","0.71073","MoKα","","0.095","0.0919","","","0.2092","0.2105","","","","","","1.071","","","","has coordinates","272634","2022-02-04","19:25:35",""
"7245738","5.985309","0.000027","5.985309","","3.52072","0.00005","90","","90","","120","","109.228","0.0016","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Eu0.02 F Na0.53 Y0.45 -","- Eu0.0216667 F Na0.533333 Y0.445 -","- Eu0.13 F6 Na3.2 Y2.67 -","6","0.5","","Ling, Shaokun; Chen, Chang; Meng, Kai; Yan, Yifeng; Ming, Junyun; Liao, Sen; Huang, Yingheng","A crystal defect led zero thermal quenching β-NaYF4 : Eu3+,Dy3+ red emitting phosphor","RSC Advances","2022","12","47","30803","30816","10.1039/D2RA05674G","powder diffraction","","","","","","","","","","","","","1.38","","","","","","","has coordinates","278852","2022-10-28","01:25:32",""
"7245917","12.1692","0.0005","12.1692","0.0005","18.022","0.0011","90","","90","","120","","2311.31","0.19","170","2","170","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C15 H38 Cl4 Gd7 N3 O32 -","- C15 H38 Cl4 Gd7 N3 O32 -","- C30 H76 Cl8 Gd14 N6 O64 -","2","0.166667","","Cao, Shouying; Fan, Chenpeng; Lu, Mengwen; Li, Meng; Zhou, Yuhang; Wang, Hongxia; Lin, Qingfang; Liang, Lili","Two heptanuclear cluster-based 3D metal–organic frameworks with a good magnetocaloric effect","CrystEngComm","2023","25","2","309","313","10.1039/D2CE01350A","","","0.71073","MoKα","","0.0415","0.0327","","","0.0746","0.0798","","","","","","1.073","","","","has coordinates,has disorder","281442","2023-03-04","18:17:10",""
"7245918","12.0761","0.0003","12.0761","0.0003","17.8609","0.0005","90","","90","","120","","2255.73","0.1","100","","100","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C15 H38 Cl4 Dy7 N3 O32 -","- C15 H38 Cl4.003 Dy7 N3 O32 -","- C30 H76 Cl8.006 Dy14 N6 O64 -","2","0.166667","","Cao, Shouying; Fan, Chenpeng; Lu, Mengwen; Li, Meng; Zhou, Yuhang; Wang, Hongxia; Lin, Qingfang; Liang, Lili","Two heptanuclear cluster-based 3D metal–organic frameworks with a good magnetocaloric effect","CrystEngComm","2023","25","2","309","313","10.1039/D2CE01350A","","x-ray","0.71073","MoKα","","0.0427","0.0373","","","0.0889","0.092","","","","","","1.134","","","","has coordinates,has disorder","281442","2023-03-04","18:17:11",""
"7246010","9.9148","","9.9148","","7.48","","90","","90","","120","","636.796","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pentalead Tris(phosphate(V)) Iodide","","- I O12 P3 Pb5 -","- I O12 P3 Pb5 -","- I2 O24 P6 Pb10 -","2","0.166667","","Dazem, Cyrielle L. F.; Inge, A. Ken; Luneau, Dominique; Öhrström, Lars; Nenwa, Justin","Synthesis, structure and magnetic properties of two bis(oxalato)cuprate(ii) salts with pyridinium type counter ions","CrystEngComm","2023","25","10","1479","1485","10.1039/D2CE01513G","","","","","","","","","","","","","","","","","","","","","has coordinates","282314","2023-04-04","10:08:22",""
"7247108","7.9101","0.0007","7.9101","0.0007","7.1057","0.0008","90","","90","","120","","385.04","0.06","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Al3 O19.5 P6 -","- Al3 O19.5 P6 -","- Al3 O19.5 P6 -","1","0.0833333","","Hao, Yucheng; Zhang, Yang; Zhang, Yuying; Fu, Zixiang; Heng, Chunyang; Li, Junjie; You, Jiatian; Hu, Kunhong; Lin, Yuan; Li, Haijian","A series of novel phosphites/phosphates with deep-ultraviolet cut-off edges from 0D polar to 3D non-polar architectures","CrystEngComm","2023","25","34","4864","4872","10.1039/D3CE00464C","","","0.71073","MoKα","","0.0668","0.0603","","","0.1706","0.1749","","","","","","1.149","","","","has coordinates","286125","2023-09-05","19:44:27",""
"7703314","9.3654","0.0002","9.3654","0.0002","6.8188","0.0001","90","","90","","120","","517.954","0.017","293","","293","","","","","","","","","4","P 63/m","-P 6c","176","","Dysprosium calcium silicate oxyapatite","","- Ca1.96 Dy8.04 O26 Si6 -","- Ca1.96 Dy8.04 O26 Si6 -","- Ca1.96 Dy8.04 O26 Si6 -","1","0.0833333","","Kazin, Pavel E.; Zykin, Mikhail A.; Trusov, Lev A.; Vasiliev, Alexander V.; Kremer, Reinhard K.; Dinnebier, Robert E.; Jansen, Martin","Multiple slow relaxation of magnetization in Dy<sup>3+</sup> confined in the crystal matrix of rare-earth-calcium silicates with the apatite structure.","Dalton transactions (Cambridge, England : 2003)","2020","49","6","2014","2023","10.1039/c9dt04248b","powder diffraction","x-ray","1.5406","CuKalpha1","","0.0198","0.0175","","0.0207","0.0205","","","","1.43","","","","","","","has coordinates","248951","2020-10-21","18:00:00",""
"7703427","5.0931","0.0002","5.0931","0.0002","22.1551","0.0013","90","","90","","120","","497.7","0.04","298","2","298","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C Co3 K2 O11 V2 -","- C Co3 K2 O11 V2 -","- C2 Co6 K4 O22 V4 -","2","0.166667","","Smith Pellizzeri, Tiffany M.; Sanjeewa, Liurukara D.; Pellizzeri, Steven; McMillen, Colin D.; Garlea, V. Ovidiu; Ye, Feng; Sefat, Athena S.; Kolis, Joseph W.","Single crystal neutron and magnetic measurements of Rb<sub>2</sub>Mn<sub>3</sub>(VO<sub>4</sub>)<sub>2</sub>CO<sub>3</sub> and K<sub>2</sub>Co<sub>3</sub>(VO<sub>4</sub>)<sub>2</sub>CO<sub>3</sub> with mixed honeycomb and triangular magnetic lattices.","Dalton transactions (Cambridge, England : 2003)","2020","49","14","4323","4335","10.1039/c9dt03389k","","","0.71073","MoKα","","0.0346","0.0327","","","0.0879","0.0895","","","","","","1.127","","","","has coordinates","251647","2020-10-21","18:00:00",""
"7704261","19.81","0.003","19.81","0.003","13.4702","0.0019","90","","90","","120","","4578","1.2","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C25.134 H27.716 B2 Cl0.268 N12 O2.224 Tb -","- C25.134 H27.716 B2 Cl0.268 N12 O2.224 Tb -","- C150.804 H166.296 B12 Cl1.608 N72 O13.344 Tb6 -","6","0.5","","Mikhalyova, Elena A.; Zeller, Matthias; Jasinski, Jerry P.; Butcher, Raymond J.; Carrella, Luca M.; Sedykh, Alexander E.; Gavrilenko, Konstantin S.; Smola, Sergey S.; Frasso, Michael; Cazorla, Sebastian Calderon; Perera, Kuluni; Shi, Anni; Ranjbar, Habib G.; Smith, Casey; Deac, Alexandru; Liu, Youlin; McGee, Sean M.; Dotsenko, Vladimir P.; Kumke, Michael U.; Müller-Buschbaum, Klaus; Rentschler, Eva; Addison, Anthony W.; Pavlishchuk, Vitaly V.","Combination of single-molecule magnet behaviour and luminescence properties in a new series of lanthanide complexes with tris(pyrazolyl)borate and oligo(β-diketonate) ligands.","Dalton transactions (Cambridge, England : 2003)","2020","49","23","7774","7789","10.1039/d0dt00600a","","","0.71073","MoKα","","0.0644","0.037","","","0.0708","0.0787","","","","","","1.071","","","","has coordinates,has disorder","253924","2020-10-21","18:00:00",""
"7704396","7.3908","0.0003","7.3908","0.0003","7.5568","0.0003","90","","90","","120","","357.48","0.02","296","","296","","","","","","","","","4","P 63/m","-P 6c","176","","","","- F16 Fe3.28 O2.6 V2.72 -","- F16 Fe3.276 O2.60004 V2.724 -","- F16 Fe3.276 O2.60004 V2.724 -","1","0.0833333","","Lemoine, Kévin; Moury, Romain; Lhoste, Jérôme; Hémon-Ribaud, Annie; Leblanc, Marc; Grenèche, Jean-Marc; Tarascon, Jean-Marie; Maisonneuve, Vincent","Stabilization of a mixed iron vanadium based hexagonal tungsten bronze hydroxyfluoride HTB-(Fe<sub>0.55</sub>V<sub>0.45</sub>)F<sub>2.67</sub>(OH)<sub>0.33</sub> as a positive electrode for lithium-ion batteries.","Dalton transactions (Cambridge, England : 2003)","2020","49","24","8186","8193","10.1039/d0dt01310b","powder diffraction","","1.78901","CoKα","","","","","","","","","8.6297","1.3557","","","","","","","has coordinates","253869","2020-10-21","18:00:00",""
"7706456","10.5738","0.0004","10.5738","0.0004","24.7974","0.001","90","","90","","120","","2401.04","0.16","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C38.96 H25 Eu3 O20.96 -","- C38.9598 H25.0006 Eu3 O20.96 -","- C77.9196 H50.0012 Eu6 O41.92 -","2","0.166667","","Xia, Tifeng; Wan, Yating; Yan, Xiayan; Hu, Li; Wu, Zhigang; Zhang, Jun","The ratiometric detection of the biomarker Ap5A for dry eye disease and physiological temperature using a rare trinuclear lanthanide metal-organic framework.","Dalton transactions (Cambridge, England : 2003)","2021","50","8","2792","2799","10.1039/d0dt03647a","","","0.71073","MoKα","","0.0428","0.0405","","","0.1031","0.1043","","","","","","1.175","","","","has coordinates,has disorder","262606","2021-03-05","01:55:43",""
"7707766","10.0564","0.0003","10.0564","0.0003","43.757","0.006","90","","90","","120","","3832.3","0.5","300","2","300","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C35 H64 B15 F60 K5 N10 -","- C35 H63.9988 B15 F60 K5 N10 -","- C70 H127.998 B30 F120 K10 N20 -","2","0.166667","","Zhang, Tie; Song, Shuang-Teng; Zhu, Hao-Nan; Chu, Lu-Lu; Fu, Da-Wei; Zhang, Yi","Unique cation-template three-dimensional hybrid material demonstrates dielectric switchable response.","Dalton transactions (Cambridge, England : 2003)","2021","50","29","10142","10146","10.1039/d1dt01812d","","","0.71073","MoKα","","0.0676","0.0641","","","0.1802","0.1833","","","","","","1.059","","","","has coordinates","268705","2021-09-06","10:52:59",""
"7708077","14.73","0.003","14.73","","17.616","0.005","90","","90","","120","","3310.1","1.2","100","2","100","2","","","","","","","","5","P 63/m","-P 6c","176","","Poly{[hexa(mu3-3-amino-4-hydroxybenzoate-k2O,O':kO'':k2N,O''')tri(mu3-hydroxide-kO:kO':kO'')tri(dimethylformamide-kO)pentayttrium(III)]pentahydrate}","","- C51 H56 N9 O25 Y5 -","- C51 H54 N9 O24 Y5 -","- C102 H108 N18 O48 Y10 -","2","0.166667","","Echenique-Errandonea, Estitxu; Pérez, Juana M.; Rojas, Sara; Cepeda, Javier; Seco, José M.; Fernández, Ignacio; Rodríguez-Diéguez, Antonio","A novel yttrium-based metal‒organic framework for the efficient solvent-free catalytic synthesis of cyanohydrin silyl ethers","Dalton Transactions","2021","50","34","11720","11724","10.1039/D1DT01953H","","","0.71073","MoKα","","0.0754","0.0399","","","0.1005","0.1151","","","","","","1.053","","","","has coordinates,has disorder","268805","2021-09-06","11:27:30",""
"7709690","14.9624","0.0005","14.9624","0.0005","7.3194","0.0002","90","","90","","120","","1419.09","0.08","296","2","296","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- H41 N52 O26.5 Pb6 -","- H40.9992 N52.001 O26.5 Pb6 -","- H40.9992 N52.001 O26.5 Pb6 -","1","0.0833333","","Yuan, Yuan; Xu, Yuangang; Xie, Qiang; Li, Dongxue; Lin, Qiuhan; Wang, Pengcheng; Lu, Ming","Pentazolate coordination polymers self-assembled by in situ generated [Pb4(OH)4]4+ cubic cations trapping cyclo-N5−","Dalton Transactions","2022","","","","","10.1039/D1DT04392G","","","0.71073","MoKα","","0.0271","0.0206","","","0.0392","0.0409","","","","","","1.046","","","","has coordinates,has disorder","273541","2022-03-08","23:51:32",""
"7710300","16.8223","0.0018","16.8223","0.0018","6.8892","0.0014","90","","90","","120","","1688.4","0.4","301.26","","301.26","","","","","","","","","5","P 63/m","-P 6c","176","","","","- C25.49 H26.51 N3.5 O15.52 Zn2 -","- C24 H14.007 N3 O11.0136 Zn2 -","- C48 H28.014 N6 O22.0272 Zn4 -","2","0.166667","","Xiao, Yao; You, Zi Xin; Xing, Yong Heng; Bai, Feng Ying; Shi, Zhan","Three-pole wheel paddle luminescent metal organic frameworks (LMOFs) based on the oxygen substituted triazine tricarboxylic acid ligand: recognition and detection of small drug molecules and aromatic amine molecules.","Dalton transactions (Cambridge, England : 2003)","2022","51","24","9336","9347","10.1039/d2dt01032a","","","0.71073","MoKα","","0.1275","0.074","","","0.1733","0.2067","","","","","","0.966","","","","has coordinates,has disorder","276613","2022-07-06","08:07:59",""
"7711200","17.185","0.002","17.185","0.002","18.443","0.002","90","","90","","120","","4716.9","0.9","296","2","296.15","","","","","","","","","6","P 63/m","-P 6c","176","(pipH)3[In6Cl6(Â?-4-Ph-pz)6(Â?-OH)6(Â?3-OH0.5)2]","(NC5H12)3[In6Cl6(N2C9H7)6(OH)7O]","","- C72 H91 Cl6 In6 N15 O9 -","- C69 H85 Cl6 In6 N15 O8 -","- C138 H170 Cl12 In12 N30 O16 -","2","0.166667","","Herrera, Susana; Rivero, Kennett I.; Guzmán, Alexis; Cedeño, Jonathan; Miksovska, Jaroslava; Raptis, Raphael G.","Mononuclear, hexanuclear and polymeric indium(iii) pyrazolido complexes; structural characterization, dynamic solution studies and luminescent properties","Dalton Transactions","2022","","","","","10.1039/D2DT01901A","","","0.71073","MoKα","","0.0418","0.0282","","","0.0631","0.0744","","","","","","1.143","","","","has coordinates","277723","2022-09-07","23:04:52",""
"7711446","11.9438","0.0019","11.9438","0.0019","26.82","0.004","90","","90","","120","","3313.4","0.9","291","2","291","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C30 H76 Cl La N12 Ni5 O44 -","- C30 H76 Cl La N12 Ni5 O44 -","- C60 H152 Cl2 La2 N24 Ni10 O88 -","2","0.166667","","Lan, Bi-Liu; Luo, Ai-Yi; Shao, Bing; Gao, Li-Na; Wei, Qin; Liang, Yu-Ning; Huang, Jin; Zhang, Zhong","Structural evolution from preorganized mononuclear triazamacrocyclic metalloligands to polynuclear metallocages and heterometallic 2D layers: modular architectures, assembly tracking and magnetic properties","Dalton Transactions","2022","","","","","10.1039/D2DT02186B","","","0.71073","MoKα","","0.0549","0.0489","","","0.1316","0.1327","","","","","","1.058","","","","has coordinates","278495","2022-10-07","22:56:05",""
"7711449","11.999","0.004","11.999","0.004","26.786","0.018","90","","90","","120","","3340","3","291","2","291","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C30 H76 Ce Cl N12 Ni5 O44 -","- C30 H76 Ce Cl N12 Ni5 O44 -","- C60 H152 Ce2 Cl2 N24 Ni10 O88 -","2","0.166667","","Lan, Bi-Liu; Luo, Ai-Yi; Shao, Bing; Gao, Li-Na; Wei, Qin; Liang, Yu-Ning; Huang, Jin; Zhang, Zhong","Structural evolution from preorganized mononuclear triazamacrocyclic metalloligands to polynuclear metallocages and heterometallic 2D layers: modular architectures, assembly tracking and magnetic properties","Dalton Transactions","2022","","","","","10.1039/D2DT02186B","","","0.71073","MoKα","","0.051","0.0444","","","0.1158","0.1169","","","","","","1.01","","","","has coordinates","278495","2022-10-07","22:56:05",""
"7712622","11.9427","0.0007","11.9427","0.0007","10.5184","0.0006","90","","90","","120","","1299.23","0.13","133","2","133","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C12 H30 Cl3 La N6 -","- C12 H30 Cl3 La N6 -","- C24 H60 Cl6 La2 N12 -","2","0.166667","","Wedal, Justin C.; Ziller, Joseph W.; Evans, William J.","Trimethyltriazacyclohexane Coordination Chemistry of Simple Rare-Earth Metal Salts","Dalton Transactions","2023","","","","","10.1039/D3DT00242J","","","0.71073","MoKα","","0.0124","0.0118","","","0.0315","0.0317","","","","","","1.111","","","","has coordinates","281880","2023-03-15","00:04:43",""
"7715450","13.4181","0.0004","13.4181","0.0004","34.9412","0.0012","90","","90","","120","","5448.2","0.3","293","2","293","2","","","","","","","","3","P 63/m","-P 6c","176","","","","- Bi3 Br16 K7 -","- Bi3 Br16 K7 -","- Bi18 Br96 K42 -","6","0.5","","Yang, Wenjian; Zhang, Jingshen; Xiong, Hui; Lan, Jing; Yuan, Songyang; Zhan, Mengdi; Tan, Ziyu; Li, Wenzhe; Fan, Jiandong","Emerging lead-free all inorganic perovskite single crystals K<sub>7</sub>Bi<sub>3</sub>X<sub>16</sub> (X = Cl, Br) toward photodetector application.","Dalton transactions (Cambridge, England : 2003)","2024","53","15","6609","6617","10.1039/d3dt03872f","","x-ray","0.71073","MoKα","","0.0956","0.0481","","","0.0862","0.1019","","","","","","0.976","","","","has coordinates","291652","2024-05-05","03:10:33",""
"7715950","18.4268","0.0006","18.4268","0.0006","22.5112","0.0011","90","","90","","120","","6619.6","0.4","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C72 H67 Cu12 N39 O61 -","- C72 H67.0002 Cu12 N39 O61 -","- C144 H134 Cu24 N78 O122 -","2","0.166667","","Pan, Ting; Wu, Yanxin; Duan, Yuefeng; Duan, Jingui","Solvents regulated packing porosity of a bilayer metal-organic cage","Dalton Transactions","2024","","","","","10.1039/D4DT01040J","","","0.71073","MoKα","","0.1077","0.0715","","","0.2015","0.2294","","","","","","1.026","","","","has coordinates","291743","2024-05-06","22:59:59",""
"7715951","19.3815","0.001","19.3815","0.001","22.13","0.002","90","","90","","120","","7199.2","0.8","296","2","296","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C48 H49.5 Cu6 N24 O17.5 -","- C48 H49.5 Cu6 N24 O17.5 -","- C192 H198 Cu24 N96 O70 -","4","0.333333","","Pan, Ting; Wu, Yanxin; Duan, Yuefeng; Duan, Jingui","Solvents regulated packing porosity of a bilayer metal-organic cage","Dalton Transactions","2024","","","","","10.1039/D4DT01040J","","","0.71073","MoKα","","0.0709","0.0535","","","0.1647","0.1782","","","","","","1.012","","","","has coordinates","291743","2024-05-06","23:00:00",""
"7715952","24.0593","0.0012","24.0593","0.0012","21.519","0.002","90","","90","","120","","10787.4","1.3","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C102 H120 Cu12 N45 O41 -","- C102 H120 Cu12 N45 O41 -","- C204 H240 Cu24 N90 O82 -","2","0.166667","","Pan, Ting; Wu, Yanxin; Duan, Yuefeng; Duan, Jingui","Solvents regulated packing porosity of a bilayer metal-organic cage","Dalton Transactions","2024","","","","","10.1039/D4DT01040J","","","0.71073","MoKα","","0.1027","0.0765","","","0.2319","0.2524","","","","","","1.028","","","","has coordinates,has disorder","291743","2024-05-06","23:00:00",""
"7715974","12.6858","0.0008","12.6858","0.0008","14.316","0.0019","90","","90","","120","","1995.2","0.3","173","2","173","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C48 H45 N3 Si3 -","- C48 H45 N3 Si3 -","- C96 H90 N6 Si6 -","2","0.166667","","Zender, Elena; Valverde, Danillo; Neubaur, Robert; Karger, Sebastian; Virovets, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Olivier, Yoann; Wagner, Matthias","Borylation and rearrangement reactions of azasilaanthracenes to afford B,N-doped nanographenes","Dalton Transactions","2024","","","","","10.1039/D4DT01166J","","","0.71073","MoKα","","0.0955","0.0633","","","0.1465","0.1657","","","","","","0.998","","","","has coordinates,has disorder","291778","2024-05-08","22:58:55",""
"8100495","8.3055","0.0007","8.3055","0.0007","7.6969","0.001","90","","90","","120","","459.81","0.08","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- H3 O9 P3 Sc2 -","- H3 O9 P3 Sc2 -","- H6 O18 P6 Sc4 -","2","0.166667","","Ewald, Bastian; Prots, Yurii; Kniep, Rüdiger","Crystal structure of discandium tris-monohydrogenphosphate(III), Sc~2~(HPO~3~)~3~","Zeitschrift für Kristallographie - New Crystal Structures","2003","218","4","377","378","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8100699","7.8983","0.0011","7.8983","0.0011","14.675","0.003","90","","90","","120","","792.8","0.2","173","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C10 H27 F2 N3 Si -","- C10 H27 F2 N3 Si -","- C20 H54 F4 N6 Si2 -","2","0.166667","","Gerd-Volker ,Röschenthaler; Enno, Lork; German, Bissky; Alexander, Kolomeitsev","Crystal structure of hexamethylguanidinium difluorotrimethylsilicate, C~10~H~27~F~2~N~3~Si","Zeitschrift für Kristallographie - New Crystal Structures","2002","217","3","419","420","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101314","9.972","0.001","9.972","","7.214","0.001","90","","90","","120","","621.4","","293","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Br O12 P3 Sr5 -","- Br O12 P3 Sr5 -","- Br2 O24 P6 Sr10 -","2","0.166667","","Alberius-Henning, Peter; Mattsson, Charlotte; Lidin,Sven","Crystal structure of pentastrontium tris(phosphate) bromide, Sr~5~ (PO~4~)~3~Br and of pentabarium tris(phosphate) bromide","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","345","346","","","","","","","","0.0424","","","0.0236","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101315","10.342","0.002","10.342","","7.673","0.002","90","","90","","120","","710.7","","293","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ba5 Br O12 P3 -","- Ba5 Br O12 P3 -","- Ba10 Br2 O24 P6 -","2","0.166667","","Alberius-Henning, Peter; Mattson, Charlotte; Lidin, Sven","Crystal structure of pentastrontium tris(phosphate) bromide, Sr~5~(PO~4~)~3~Br and of pentabarium tris(phosphate) bromide","Zeitschrift für Kristallographie - New Crystal Structures","2000","215","3","345","346","","","","","","","","0.0221","","","0.0154","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103008","8.7199","0.0012","8.7199","0.0012","5.3564","0.001","90","","90","","120","","352.72","0.1","295","2","295","2","","","","","","","","4","P 63/m","-P 6c","176","ytterbium lanthanum iron carbide","ytterbium lanthanum iron carbide","","- C6 Fe La3 Yb0.63 -","- C6 Fe La3 Yb0.63 -","- C12 Fe2 La6 Yb1.26 -","2","0.166667","","Bambar Davaasuren; Enkhtsetseg Dashjav; Guido Kreiner; Horst Borrmann; Rüdiger Kniep","Crystal structure of ytterbium lanthanum iron carbide, La3Yb0.63FeC6","Zeitschrift für Kristallographie - New Crystal Structures","2009","224","1","13","","","","","0.71073","MoKα","","0.03","0.0252","","","0.0452","0.0471","","","","","","1.192","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8103385","9.217","","9.217","","3.304","","90","","90","","120","","243.08","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Silver vanadium sulfide (.26/6/8)","","- Ag0.26 S8 V6 -","- Ag0.26 S8 V6 -","- Ag0.26 S8 V6 -","1","0.0833333","","Koy, J.; Bensch, W.","Crystal structure of silver hexavanadium octasulfide, Ag0.26 V6 S8","Zeitschrift fuer Kristallographie (149,1979-)","1995","210","","364","364","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8103418","12.4852","","12.4852","","14.4117","","90","","90","","120","","1945.53","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Ag9.01 Mg36.81 -","- Ag9.009 Mg36.81 -","- Ag18.018 Mg73.62 -","2","0.166667","","Kudla, C.; Prots', Yu.M.; Kreiner, G.; Leineweber, A.","On the crystal structure of gamma - Ag Mg4","Zeitschrift fuer Kristallographie (149,1979-)","2005","220","","102","114","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8103419","12.4037","","12.4037","","14.321","","90","","90","","120","","1908.12","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Ag9.05 Mg36.72 -","- Ag9.0452 Mg36.7224 -","- Ag18.0904 Mg73.4448 -","2","0.166667","","Prots', Yu.M.; Kudla, C.; Leineweber, A.; Kreiner, G.","On the crystal structure of gamma - Ag Mg4","Zeitschrift fuer Kristallographie (149,1979-)","2005","220","","102","114","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8103653","7.875","","7.875","","3.931","","90","","90","","120","","211.123","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- Er3 Ru2 -","- Er3 Ru2 -","- Er6 Ru4 -","2","0.166667","","Fornasini, M.L.; Palenzona, A.","The crystal structure of Er3 Ru2","Zeitschrift fuer Kristallographie (149,1979-)","1990","192","","249","254","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8103820","9.865","","9.865","","7.4306","","90","","90","","120","","626.251","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Pb10 (P O4)6 O","","- O25 P6 Pb10 -","- O25 P6 Pb10 -","- O25 P6 Pb10 -","1","0.0833333","","Krivovichev, S.V.; Burns, P.C.","Crystal chemistry of lead oxide phosphates: crystal structures of Pb4 O (P O4)2, Pb8 O5 (P O4)2 and Pb10 (P O4)6 O","Zeitschrift fuer Kristallographie (149,1979-)","2003","218","","357","365","","","","","","","","","","","","","","","","","","","","","","has coordinates","160349","2020-10-21","18:00:00",""
"8103910","9.5635","","9.5635","","7.0286","","90","","90","","120","","556.715","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Nd4.69 O (Si O4)3","","- Nd4.69 O13 Si3 -","- Nd4.694 O13 Si3 -","- Nd9.388 O26 Si6 -","2","0.166667","","Hartenbach, I.; Schleid, T.","M4.667Ch[Si O4]3 (M = Nd, Sm; Ch = O, S): structural comparison of two apatite-type lanthanoid chalcogenide ortho-oxosilicates","Zeitschrift fuer Kristallographie (149,1979-)","2005","220","","206","210","","","","","","","","","","","","","","","","","","","","","","has coordinates","162232","2020-10-21","18:00:00",""
"8103913","9.4923","","9.4923","","6.9394","","90","","90","","120","","541.496","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sm4.66 O (Si O4)3","","- O13 Si3 Sm4.66 -","- O13 Si3 Sm4.658 -","- O26 Si6 Sm9.316 -","2","0.166667","","Hartenbach, I.; Schleid, T.","M4.667Ch[Si O4]3 (M = Nd, Sm; Ch = O, S): structural comparison of two apatite-type lanthanoid chalcogenide ortho-oxosilicates","Zeitschrift fuer Kristallographie (149,1979-)","2005","220","","206","210","","","","","","","","","","","","","","","","","","","","","","has coordinates","162237","2020-10-21","18:00:00",""
"8103916","9.8337","","9.8337","","6.8404","","90","","90","","120","","572.857","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Nd4.65 S (Si O4)3","","- Nd4.65 O12 S Si3 -","- Nd4.654 O12 S Si3 -","- Nd9.308 O24 S2 Si6 -","2","0.166667","","Hartenbach, I.; Schleid, T.","M4.667Ch[Si O4]3 (M = Nd, Sm; Ch = O, S): structural comparison of two apatite-type lanthanoid chalcogenide ortho-oxosilicates","Zeitschrift fuer Kristallographie (149,1979-)","2005","220","","206","210","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103918","9.7502","","9.7502","","6.7613","","90","","90","","120","","556.657","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Sm4.60 S (Si O4)3","","- O12 S Si3 Sm4.6 -","- O12 S Si3 Sm4.596 -","- O24 S2 Si6 Sm9.192 -","2","0.166667","","Hartenbach, I.; Schleid, T.","M4.667Ch[Si O4]3 (M = Nd, Sm; Ch = O, S): structural comparison of two apatite-type lanthanoid chalcogenide ortho-oxosilicates","Zeitschrift fuer Kristallographie (149,1979-)","2005","220","","206","210","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104070","14.423","","14.423","","5.565","","90","","90","","120","","1002.55","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Na6 (Sb12 O18) (Sb Se3)2 (Na1.86 Sb0.14) ((O H)2.28 (H2 O)4.02)","","- H10.32 Na7.86 O24.3 Sb14.14 Se6 -","- Na7.86 O24.3 Sb14.14 Se6 -","- Na7.86 O24.3 Sb14.14 Se6 -","1","0.0833333","","Wang, X.","Crystal structures of oxoselenoantimonates(III) of sodium and rubidium Na6 (Sb12 O18) (Sb Se3)2 (Na1.86 Sb0.14) ((O H)2.28 (H2 O)4.02) and Rb6 (Sb12 O18) (Sb Se3)2 ((O H)0.66 (H2 O)3.48)","Zeitschrift fuer Kristallographie (149,1979-)","1995","210","","693","694","","","","","","","","","","","","","","","","","","","","","","has coordinates","163882","2020-10-21","18:00:00",""
"8104071","14.715","","14.715","","5.653","","90","","90","","120","","1060.06","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Rb6 (Sb12 O18) (Sb Se3)2 Sb0.22 ((O H)0.66 (H2 O)3.48)","","- H7.62 O22.14 Rb6 Sb14.22 Se6 -","- O22.14 Rb6 Sb14.22 Se6 -","- O22.14 Rb6 Sb14.22 Se6 -","1","0.0833333","","Wang, X.","Crystal structures of oxoselenoantimonates(III) of sodium and rubidium Na6 (Sb12 O18) (Sb Se3)2 (Na1.86 Sb0.14) ((O H)2.28 (H2 O)4.02) and Rb6 (Sb12 O18) (Sb Se3)2 ((O H)0.66 (H2 O)3.48)","Zeitschrift fuer Kristallographie (149,1979-)","1995","210","","693","694","","","","","","","","","","","","","","","","","","","","","","has coordinates","163886","2020-10-21","18:00:00",""
"8104235","10.007","","10.007","","8.385","","90","","90","","120","","727.179","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Na6 K1.2 (Al7.2 Si8.8 O32)","","- Al7.2 K1.2 Na6 O32 Si8.8 -","- Al7.2 K1.22 Na6 O31.9998 Si8.8 -","- Al7.2 K1.22 Na6 O31.9998 Si8.8 -","1","0.0833333","","Dollase, W.A.","Least-squares refinement of the structure of a plutonic nepheline","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1970","132","","27","44","","","","","","","","","","","","","","","","","","","","","","has coordinates","166146","2020-10-21","18:00:00",""
"8104443","15.921","","15.921","","3.957","","90","","90","","120","","868.635","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Sm Pt5 Si3","","- Pt5 Si3 Sm -","- Pt5 Si3 Sm -","- Pt30 Si18 Sm6 -","6","0.5","","Prots', Yu.M.; Bodak, O.I.; Pecharskii, V.K.; Salamakha, P.S.; Seropegin, Yu.D.","Crystal structure of samarium platinum silicide","Zeitschrift fuer Kristallographie (149,1979-)","1993","205","","329","330","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8107630","4.915","0.004","4.915","0.004","15.45","0.01","90","","90","","120","","323.2","0.4","","","293","","","","","","","","","6","P 63/m","-P 6c","176","","","","- C2 Cd F Li2 O6 Rb -","- C2 Cd F Li2 O6 Rb -","- C4 Cd2 F2 Li4 O12 Rb2 -","2","0.166667","","Chen, Jie; Luo, Min; Ye, Ning","Crystal structure of a new alkaline-cadmium carbonate Li2RbCd(CO3)2F, C2CdFLi2O6Rb","Zeitschrift für Kristallographie - New Crystal Structures","2015","230","1","1","2","10.1515/ncrs-2014-9048","","x-ray","0.71073","MoKα","","","0.0242","","","0.0571","","","","","","","","","","","has coordinates","286983","2023-10-16","08:13:59",""
"9000244","10.08","","10.08","","13.27","","90","","90","","120","","1167.68","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Nasonite","- Ca4 Cl2 O21 Pb6 Si6 -","- Ca4 Cl2 O21 Pb6 Si6 -","- Ca8 Cl4 O42 Pb12 Si12 -","2","0.166667","","Giuseppetti, G.; Rossi, G.; Tadini, C.","The crystal structure of nasonite","American Mineralogist","1971","56","","1174","1179","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000374","10.465","","10.465","","21.191","","90","","90","","120","","2009.84","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hanksite","- C2 Cl K Na22 O42 S9 -","- C2 Cl K Na22 O42 S9 -","- C4 Cl2 K2 Na44 O84 S18 -","2","0.166667","","Araki, T.; Zoltai, T.","The crystal structure of hanksite","American Mineralogist","1973","58","","799","801","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000877","6.612","","6.612","","9.51","","90","","90","","120","","360.062","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","Wadeite","- K2 O9 Si4 -","- K2 O9 Si4 -","- K4 O18 Si8 -","2","0.166667","","Swanson, D. K.; Prewitt, C. T.","The crystal structure of K2SiSi3O9 Note: B(1,2) for K and Si1 have been changed to match symmetry constraints","American Mineralogist","1983","68","","581","585","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:40",""
"9000938","10.14","","10.14","","7.185","","90","","90","","120","","639.784","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Hedyphane","- As3 Ca2 Cl O12 Pb3 -","- As3 Ca2 Cl O12 Pb3 -","- As6 Ca4 Cl2 O24 Pb6 -","2","0.166667","","Rouse, R. C.; Dunn, P. J.; Peacor, D. R.","Hedyphane from Franklin, New Jersey and Langban, Sweden: Cation ordering in an arsenate apatite sample H90417 from Langban, Sweden","American Mineralogist","1984","69","","920","927","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:40",""
"9001232","9.3973","","9.3973","","6.8782","","90","","90","","120","","526.031","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","","Hughes J M; Cameron M; Crowley K D","Structural variations in natural F, OH, and Cl apatites Locality: Durango Mexico","American Mineralogist","1989","74","","870","876","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001233","9.4166","","9.4166","","6.8745","","90","","90","","120","","527.91","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H O13 P3 -","- Ca5 H O13 P3 -","- Ca10 H2 O26 P6 -","2","0.166667","","Hughes J M; Cameron M; Crowley K D","Structural variations in natural F, OH, and Cl apatites Locality: Holly Springs, Georgia, USA","American Mineralogist","1989","74","","870","876","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001234","9.598","","9.598","","6.776","","90","","90","","120","","540.587","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Chlorapatite","- Ca5 Cl0.88 F0.12 O12 P3 -","- Ca5 Cl0.88 F0.12 O12 P3 -","- Ca10 Cl1.76 F0.24 O24 P6 -","2","0.166667","","Hughes J M; Cameron M; Crowley K D","Structural variations in natural F, OH, and Cl apatites Locality: Kragero, Norway","American Mineralogist","1989","74","","870","876","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001262","9.4615","","9.4615","","6.8491","","90","","90","","120","","530.987","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 Cl0.33 F0.39 H2 O12.28 P3 -","- Ca5 Cl0.33 F0.39 H0.28 O12.28 P3 -","- Ca10 Cl0.66 F0.78 H0.56 O24.56 P6 -","2","0.166667","","Hughes J M; Cameron M; Crowley K D","Crystal structures of natural ternary apatites: Solid solution in the Ca5(PO4)3X (X = F,OH,Cl) system","American Mineralogist","1990","75","","295","304","","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:51",""
"9001342","9.4052","","9.4052","","6.9125","","90","","90","","120","","529.544","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","","Fluorapatite","- Ca3.895 Ce0.631 F Na0.474 O12 P2.841 Si0.159 -","- Ca3.895 Ce0.631 F Na0.474 O12 P2.841 Si0.159 -","- Ca7.79 Ce1.262 F2 Na0.948 O24 P5.682 Si0.318 -","2","0.166667","","Hughes J M; Cameron M; Mariano A N","Rare-earth-element ordering and structural variations in natural rare-earth-bearing apatites sample from Pajarito, New Mexico","American Mineralogist","1991","76","","1165","1173","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001343","9.4202","","9.4202","","6.9157","","90","","90","","120","","531.48","","","","","","","","","","","","","8","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca4.557 Ce0.423 F0.335 H2 Na0.02 O12.664 P2.595 Si0.405 -","- Ca4.557 Ce0.423 F0.335 H0.664 Na0.02 O12.664 P2.595 Si0.405 -","- Ca9.114 Ce0.846 F0.67 H1.328 Na0.04 O25.328 P5.19 Si0.81 -","2","0.166667","","Hughes J M; Cameron M; Mariano A N","Rare-earth-element ordering and structural variations in natural rare-earth-bearing apatites sample B from the Oka carbonatite","American Mineralogist","1991","76","","1165","1173","","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:51",""
"9001344","9.3908","","9.3908","","6.8988","","90","","90","","120","","526.877","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.641 Ce0.309 F Na0.05 O12 P2.781 Si0.219 -","- Ca4.641 Ce0.309 F Na0.05 O12 P2.781 Si0.219 -","- Ca9.282 Ce0.618 F2 Na0.1 O24 P5.562 Si0.438 -","2","0.166667","","Hughes J M; Cameron M; Mariano A N","Rare-earth-element ordering and structural variations in natural rare-earth-bearing apatites sample from Kipawa, Quebec","American Mineralogist","1991","76","","1165","1173","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001345","9.3995","","9.3995","","6.8941","","90","","90","","120","","527.494","","","","","","","","","","","","","8","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.825 Ce0.165 F0.74 H2 Na0.01 O12.26 P2.841 Si0.159 -","- Ca4.825 Ce0.165 F0.74 H0.26 Na0.01 O12.26 P2.841 Si0.159 -","- Ca9.65 Ce0.33 F1.48 H0.52 Na0.02 O24.52 P5.682 Si0.318 -","2","0.166667","","Hughes J M; Cameron M; Mariano A N","Rare-earth-element ordering and structural variations in natural rare-earth-bearing apatites sample from the Oka carbonatite","American Mineralogist","1991","76","","1165","1173","","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:51",""
"9001387","9.3902","","9.3902","","6.9011","","90","","90","","120","","526.985","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.686 F O12 P3 Sr0.314 -","- Ca4.686 F O12 P3 Sr0.314 -","- Ca9.372 F2 O24 P6 Sr0.628 -","2","0.166667","","Hughes J M; Cameron M; Crowley K D","Ordering of divalent cations in the apatite structure: Crystal structure refinements of natural Mn- and Sr-bearing apatite sample Sr.63","American Mineralogist","1991","76","","1857","1862","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001388","9.3786","","9.3786","","6.8922","","90","","90","","120","","525.006","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.852 F0.89 O12 P3 Sr0.148 -","- Ca4.852 F0.89 O12 P3 Sr0.148 -","- Ca9.704 F1.78 O24 P6 Sr0.296 -","2","0.166667","","Hughes J M; Cameron M; Crowley K D","Ordering of divalent cations in the apatite structure: Crystal structure refinements of natural Mn- and Sr-bearing apatite sample Sr.29","American Mineralogist","1991","76","","1857","1862","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001389","9.343","","9.343","","6.8227","","90","","90","","120","","515.774","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.395 F0.74 Mn0.605 O12 P3 -","- Ca4.395 F0.74 Mn0.605 O12 P3 -","- Ca8.79 F1.48 Mn1.21 O24 P6 -","2","0.166667","","Hughes J M; Cameron M; Crowley K D","Ordering of divalent cations in the apatite structure: Crystal structure refinements of natural Mn- and Sr-bearing apatite sample Mn1.21","American Mineralogist","1991","76","","1857","1862","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001390","9.3596","","9.3596","","6.8603","","90","","90","","120","","520.461","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.791 F0.93 Mn0.211 O12 P3 -","- Ca4.791 F0.93 Mn0.211 O12 P3 -","- Ca9.582 F1.86 Mn0.422 O24 P6 -","2","0.166667","","Hughes J M; Cameron M; Crowley K D","Ordering of divalent cations in the apatite structure: Crystal structure refinements of natural Mn- and Sr-bearing apatite sample Mn.42","American Mineralogist","1991","76","","1857","1862","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001671","9.4123","","9.4123","","6.908","","90","","90","","120","","529.998","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.497 F La0.325 Na0.178 O12 P2.856 Si0.144 -","- Ca4.497 F La0.325 Na0.178 O12 P2.856 Si0.144 -","- Ca8.994 F2 La0.65 Na0.356 O24 P5.712 Si0.288 -","2","0.166667","","Fleet M E; Pan Y","Site preference of rare earth elements in fluorapatite Sample: La-FAp","American Mineralogist","1995","80","","329","335","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001672","9.3979","","9.3979","","6.8997","","90","","90","","120","","527.743","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.331 F Na0.257 Nd0.409 O12 P2.841 Si0.159 -","- Ca4.331 F Na0.257 Nd0.409 O12 P2.841 Si0.159 -","- Ca8.662 F2 Na0.514 Nd0.818 O24 P5.682 Si0.318 -","2","0.166667","","Fleet M E; Pan Y","Site preference of rare earth elements in fluorapatite Sample: Nd-FAp","American Mineralogist","1995","80","","329","335","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001673","9.3853","","9.3853","","6.8876","","90","","90","","120","","525.406","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.52 F Gd0.307 Na0.173 O12 P2.859 Si0.141 -","- Ca4.52 F Gd0.307 Na0.173 O12 P2.859 Si0.141 -","- Ca9.04 F2 Gd0.614 Na0.346 O24 P5.718 Si0.282 -","2","0.166667","","Fleet M E; Pan Y","Site preference of rare earth elements in fluorapatite Sample: Gd-FAp","American Mineralogist","1995","80","","329","335","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001674","9.3784","","9.3784","","6.8832","","90","","90","","120","","524.298","","","","","","","","","","","","","7","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.584 Dy0.258 F Na0.158 O12 P2.874 Si0.12 -","- Ca4.584 Dy0.258 F Na0.158 O12 P2.874 Si0.12 -","- Ca9.168 Dy0.516 F2 Na0.316 O24 P5.748 Si0.24 -","2","0.166667","","Fleet M E; Pan Y","Site preference of rare earth elements in fluorapatite Sample: Dy-FAp","American Mineralogist","1995","80","","329","335","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001878","9.394","","9.394","","6.8967","","90","","90","","120","","527.076","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","","Fleet M E; Pan Y","Site preference of rare earth elements in fluorapatite: Binary (LREE+HREE)- substituted crystals Sample: La,Gd-FAp","American Mineralogist","1997","82","","870","877","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001879","9.3874","","9.3874","","6.892","","90","","90","","120","","525.977","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","","Fleet M E; Pan Y","Site preference of rare earth elements in fluorapatite: Binary (LREE+HREE)- substituted crystals Sample: Ce,Dy-FAp","American Mineralogist","1997","82","","870","877","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001880","9.3845","","9.3845","","6.8901","","90","","90","","120","","525.507","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","","Fleet M E; Pan Y","Site preference of rare earth elements in fluorapatite: Binary (LREE+HREE)- substituted crystals Sample: Pr,Er-FAp","American Mineralogist","1997","82","","870","877","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001881","9.3812","","9.3812","","6.8867","","90","","90","","120","","524.878","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","","Fleet M E; Pan Y","Site preference of rare earth elements in fluorapatite: Binary (LREE+HREE)- substituted crystals Sample: Eu,Lu-FAp","American Mineralogist","1997","82","","870","877","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002213","9.4081","","9.4081","","6.8887","","90","","90","","120","","528.046","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H O13 P3 -","- Ca5 H O13 P3 -","- Ca10 H2 O26 P6 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: H6L, synthetic","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002214","9.4394","","9.4394","","6.8861","","90","","90","","120","","531.365","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H2 O13 P3 -","- Ca5 H2 O13 P3 -","- Ca10 H4 O26 P6 -","2","0.166667","","Wilson, R. M.; Elliot, J. C.; Dowker, S. E. P.","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: H6G, synthetic","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002215","9.4172","","9.4172","","6.8799","","90","","90","","120","","528.392","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H2 O13 P3 -","- Ca5 H2 O13 P3 -","- Ca10 H4 O26 P6 -","2","0.166667","","Wilson, R. M.; Elliot, J. C.; Dowker, S. E. P.","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: H6M, synthetic","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002216","9.4232","","9.4232","","6.8833","","90","","90","","120","","529.327","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H2 O13 P3 -","- Ca5 H2 O13 P3 -","- Ca10 H4 O26 P6 -","2","0.166667","","Wilson, R. M.; Elliot, J. C.; Dowker, S. E. P.","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: Prep.63b, synthetic","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002217","9.4623","","9.4623","","6.8863","","90","","90","","120","","533.962","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H1.16 Mg0.05 Na0.1 O11.88 P2.76 -","- Ca4.73 H1.16 Mg0.05 Na0.1 O11.88 P2.76 -","- Ca9.46 H2.32 Mg0.1 Na0.2 O23.76 P5.52 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RC1 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002218","9.4512","","9.4512","","6.8803","","90","","90","","120","","532.245","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H2 Mg0.05 Na0.1 O11.99 P2.79 -","- Ca4.73 H2 Mg0.05 Na0.1 O11.99 P2.79 -","- Ca9.46 H4 Mg0.1 Na0.2 O23.98 P5.58 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RC7 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002219","9.4343","","9.4343","","6.8681","","90","","90","","120","","529.403","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.7 H0.46 Mg0.05 Na0.1 O12.51 P2.61 -","- Ca4.7 H0.46 Mg0.05 Na0.1 O12.51 P2.61 -","- Ca9.4 H0.92 Mg0.1 Na0.2 O25.02 P5.22 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RC8 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002220","9.4564","","9.4564","","6.8821","","90","","90","","120","","532.971","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H1.76 Mg0.02 Na0.1 O11.81 P2.79 -","- Ca4.73 H1.76 Mg0.02 Na0.1 O11.81 P2.79 -","- Ca9.46 H3.52 Mg0.04 Na0.2 O23.62 P5.58 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RE1 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002221","9.4598","","9.4598","","6.8865","","90","","90","","120","","533.695","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H1.58 Mg0.02 Na0.1 O11.73 P2.79 -","- Ca4.73 H1.58 Mg0.02 Na0.1 O11.73 P2.79 -","- Ca9.46 H3.16 Mg0.04 Na0.2 O23.46 P5.58 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RE2 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002222","9.4592","","9.4592","","6.8816","","90","","90","","120","","533.248","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.7 H1.24 Mg0.02 Na0.1 O12.2 P2.73 -","- Ca4.7 H1.24 Mg0.02 Na0.1 O12.2 P2.73 -","- Ca9.4 H2.48 Mg0.04 Na0.2 O24.4 P5.46 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RFP - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002223","9.4586","","9.4586","","6.8811","","90","","90","","120","","533.141","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.76 H1.78 Mg0.02 Na0.1 O12.04 P2.85 -","- Ca4.76 H1.78 Mg0.02 Na0.1 O12.04 P2.85 -","- Ca9.52 H3.56 Mg0.04 Na0.2 O24.08 P5.7 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RFB - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002224","9.4554","","9.4554","","6.8835","","90","","90","","120","","532.966","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.76 H1.62 Mg0.02 Na0.1 O12.25 P2.82 -","- Ca4.76 H1.62 Mg0.02 Na0.1 O12.25 P2.82 -","- Ca9.52 H3.24 Mg0.04 Na0.2 O24.5 P5.64 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RGP - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002225","9.4506","","9.4506","","6.878","","90","","90","","120","","532","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.76 H2 Mg0.05 Na0.1 O12.27 P2.85 -","- Ca4.76 H2 Mg0.05 Na0.1 O12.27 P2.85 -","- Ca9.52 H4 Mg0.1 Na0.2 O24.54 P5.7 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RGB - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002226","9.4586","","9.4586","","6.8809","","90","","90","","120","","533.126","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H1.46 Mg0.02 Na0.1 O12.85 P2.76 -","- Ca4.73 H1.46 Mg0.02 Na0.1 O12.85 P2.76 -","- Ca9.46 H2.92 Mg0.04 Na0.2 O25.7 P5.52 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RHP - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002227","9.4616","","9.4616","","6.8819","","90","","90","","120","","533.541","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H1.1 Mg0.02 Na0.1 O12.36 P2.85 -","- Ca4.73 H1.1 Mg0.02 Na0.1 O12.36 P2.85 -","- Ca9.46 H2.2 Mg0.04 Na0.2 O24.72 P5.7 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RHB - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002228","9.4584","","9.4584","","6.8808","","90","","90","","120","","533.095","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.7 H2 Mg0.02 Na0.1 O12.09 P2.76 -","- Ca4.7 H2 Mg0.02 Na0.1 O12.09 P2.76 -","- Ca9.4 H4 Mg0.04 Na0.2 O24.18 P5.52 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RQ1 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002257","8.8612","","8.8612","","3.1021","","90","","90","","120","","210.946","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluoborite","- B F3 H3 Mg3 O3 -","- B F3 H3 Mg3 O3 -","- B2 F6 H6 Mg6 O6 -","2","0.166667","","Camara, F.; Ottolini, L.","New data on the crystal-chemistry of fluoborite by means of SREF, SIMS and EMP analysis Sample: Fbor 2V-43 n.2","American Mineralogist","2000","85","","103","107","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002258","8.8602","","8.8602","","3.1021","","90","","90","","120","","210.898","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluoborite","- B F3 H3 Mg3 O3 -","- B F3 H3 Mg3 O3 -","- B2 F6 H6 Mg6 O6 -","2","0.166667","","Camara, F.; Ottolini, L.","New data on the crystal-chemistry of fluoborite by means of SREF, SIMS and EMP analysis Sample: Fbor HV-43 n.3","American Mineralogist","2000","85","","103","107","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002345","8.83","","8.83","","2.779","","90","","90","","120","","187.647","","","","","","","","","","","synthesized at 24 GPa","","8","P 63/m","-P 6c","176","","","","- Al1.305 Ca0.02 Fe0.3 K0.28 Mg1.295 Na0.16 O6 Si1.05 -","- Al1.305 Ca0.02 Fe0.3 K0.28 Mg1.295 Na0.16 O6 Si1.05 -","- Al2.61 Ca0.04 Fe0.6 K0.56 Mg2.59 Na0.32 O12 Si2.1 -","2","0.166667","","Gasparik, T.; Tripathi, A.; Parise, J. B.","Structure of a new Al-rich phase, [K,Na].9[Mg,Fe]2[Mg,Fe,Al,Si]6O12, synthesized at 24 GPa","American Mineralogist","2000","85","","613","618","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002431","9.6499","","9.6499","","6.7725","","90","","90","","120","","546.167","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Chlorapatite","- Ca4.899 Cl2 La0.052 Na0.05 O12 P3 -","- Ca4.899 Cl2 La0.0519 Na0.05 O12 P3 -","- Ca9.798 Cl4 La0.1038 Na0.1 O24 P6 -","2","0.166667","","Fleet M E; Liu X; Pan Y","Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: La-ClAp","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002432","9.6474","","9.6474","","6.7747","","90","","90","","120","","546.061","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Chlorapatite","- Ca4.822 Cl2 Na0.087 Nd0.092 O12 P3 -","- Ca4.822 Cl2 Na0.087 Nd0.0917 O12 P3 -","- Ca9.644 Cl4 Na0.174 Nd0.1834 O24 P6 -","2","0.166667","","Fleet M E; Liu X; Pan Y","Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: Nd-ClAp","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002433","9.6487","","9.6487","","6.7652","","90","","90","","120","","545.442","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Chlorapatite","- Ca4.857 Cl2 Dy0.069 Na0.072 O12 P3 -","- Ca4.857 Cl2 Dy0.069 Na0.072 O12 P3 -","- Ca9.714 Cl4 Dy0.138 Na0.144 O24 P6 -","2","0.166667","","Fleet M E; Liu X; Pan Y","Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: Dy-ClAp","American Mineralogist","2000","85","","1437","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002506","8.7616","","8.7616","","2.785","","90","","90","","120","","185.15","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Al3 Ca0.5 Mg O6 -","- Al3 Ca0.5 Mg O6 -","- Al6 Ca Mg2 O12 -","2","0.166667","","Miura, H.; Hamada, Y.; Suzuki, T.; Akaogi, M.; Miyajima, N.; Fujino, K.","Crystal structure of MaMg2Al6O12, a new Al-rich high pressure form","American Mineralogist","2000","85","","1799","1803","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9002647","11.056","","11.056","","10.629","","90","","90","","120","","1125.17","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Carraraite","- C2 H30 Ca3 Ge O26 S2 -","- C2 H30 Ca3 Ge O26 S2 -","- C4 H60 Ca6 Ge2 O52 S4 -","2","0.166667","","Merlino, S.; Orlandi, P.","Carraraite and zaccagnaite, two new minerals from the Carrara marble quarries: their chemical compositions, physical properties and structural features","American Mineralogist","2001","86","","1293","1301","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:00",""
"9003381","8.724","","8.724","","8.464","","90","","90","","120","","557.876","","","","","","","","","","","","Mogok","10","P 63/m","-P 6c","176","","","Painite","- Al8.82 B Ca0.77 Cr0.03 Hf0.01 Na0.19 O18 Ti0.18 V0.01 Zr0.94 -","- Al8.82 B Ca0.77 Cr0.03 Hf0.01 Na0.19 O18 Ti0.18 V0.01 Zr0.94 -","- Al17.64 B2 Ca1.54 Cr0.06 Hf0.02 Na0.38 O36 Ti0.36 V0.02 Zr1.88 -","2","0.166667","","Armbruster, T.; Dobelin, N.; Peretti, A.; Gunther, D.; Reusser, E.; Grobety, B.","The crystal structure of painite CaZrB[Al9O18] revisited","American Mineralogist","2004","89","","610","613","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:31",""
"9003438","9.3429","","9.3429","","6.811","","90","","90","","120","","514.879","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.32 F Mn0.68 O12 P3 -","- Ca4.32 F Mn0.68 O12 P3 -","- Ca8.64 F2 Mn1.36 O24 P6 -","2","0.166667","","Hughes, John M.; Ertl, Andreas; Bernhardt, Heinz-Jürgen; Rossman, George R.; Rakovan, John F.","Mn-rich fluorapatite from Austria: Crystal structure, chemical analysis, and spectroscopic investigations","American Mineralogist","2004","89","","629","632","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:31",""
"9003548","9.4234","","9.4234","","6.8801","","90","","90","","120","","529.104","","","","","","","","","","","synthesized at 2-4 GPa","Synthetic; Sample: xt372","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H1.44 O13.012 P2.928 -","- Ca5 H1.44 O13.012 P2.928 -","- Ca10 H2.88 O26.024 P5.856 -","2","0.166667","","Fleet, M. E.; Liu, X.; King, P. L.","Accommodation of the carbonate ion in apatite: An FTIR and X-ray structure study of crystals synthesized at 2-4 GPa","American Mineralogist","2004","89","","1422","1432","","","","","","","","","","","","","","","","","","","","","","has coordinates","287648","2023-11-16","14:14:25",""
"9003549","9.4468","","9.4468","","6.8806","","90","","90","","120","","531.773","","","","","","","","","","","synthesized at 2-4 GPa","Synthetic; Sample: xt374","5","P 63/m","-P 6c","176","","","Hydroxylapatite","- C0.01 H1.3 Ca5 O13.072 P3 -","- C0.01 H1.3 Ca5 O13.072 P3 -","- C0.02 H2.6 Ca10 O26.144 P6 -","2","0.166667","","Fleet, M. E.; Liu, X.; King, P. L.","Accommodation of the carbonate ion in apatite: An FTIR and X-ray structure study of crystals synthesized at 2-4 GPa","American Mineralogist","2004","89","","1422","1432","","","","","","","","","","","","","","","","","","","","","","has coordinates","287649","2023-11-16","14:31:05",""
"9003550","9.4803","","9.4803","","6.8853","","90","","90","","120","","535.917","","","","","","","","","","","synthesized at 2-4 GPa","","4","P 63/m","-P 6c","176","","","Carbonate-hydroxylapatite","- C0.26 Ca5 O13.686 P2.829 -","- C0.26 Ca5 O13.686 P2.829 -","- C0.52 Ca10 O27.372 P5.658 -","2","0.166667","","Fleet M E; Liu X; King P L","Accommodation of the carbonate ion in apatite: An FTIR and X-ray structure study of crystals synthesized at 2-4 GPa Sample: xt371","American Mineralogist","2004","89","","1422","1432","","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9003551","9.4817","","9.4817","","6.8843","","90","","90","","120","","535.998","","","","","","","","","","","synthesized at 2-4 GPa","","4","P 63/m","-P 6c","176","","","Carbonate-hydroxylapatite","- C0.22 Ca5 O13.514 P2.823 -","- C0.22 Ca5 O13.514 P2.823 -","- C0.44 Ca10 O27.028 P5.646 -","2","0.166667","","Fleet M E; Liu X; King P L","Accommodation of the carbonate ion in apatite: An FTIR and X-ray structure study of crystals synthesized at 2-4 GPa Sample: xt373","American Mineralogist","2004","89","","1422","1432","","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9004057","10.331","","10.331","","7.343","","90","","90","","120","","678.717","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Vanadinite","- Cl O12 Pb5 V3 -","- Cl O12 Pb5 V3 -","- Cl2 O24 Pb10 V6 -","2","0.166667","","Trotter, J.; Barnes, W. H.","The structure of vanadinite","The Canadian Mineralogist","1958","6","","161","173","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:32",""
"9004200","10.3174","","10.3174","","7.3378","","90","","90","","120","","676.452","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Vanadinite","- Cl O12 Pb5 V3 -","- Cl O12 Pb5 V3 -","- Cl2 O24 Pb10 V6 -","2","0.166667","","Dai, Y. S.; Hughes, J. M.","Crystal-structure refinements of vanadinite and pyromorphite","The Canadian Mineralogist","1989","27","","189","192","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004201","9.9764","","9.9764","","7.3511","","90","","90","","120","","633.623","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Pyromorphite","- Cl O12 P3 Pb5 -","- Cl O12 P3 Pb5 -","- Cl2 O24 P6 Pb10 -","2","0.166667","","Dai, Y. S.; Hughes, J. M.","Crystal-structure refinements of vanadinite and pyromorphite","The Canadian Mineralogist","1989","27","","189","192","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004239","10.211","","10.211","","7.4185","","90","","90","","120","","669.859","","","","","","","","","","","","Durango, Mexico","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl O12 Pb5 -","- As3 Cl O12 Pb5 -","- As6 Cl2 O24 Pb10 -","2","0.166667","","Yongshan, D.; Hughes, J. M.; Moore, P. B.","The crystal structures of mimetite and clinomimetite, Pb5(AsO4)3Cl","The Canadian Mineralogist","1991","29","","369","376","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004334","5.987","","5.987","","3.5413","","90","","90","","120","","109.929","","","","","","","","","","","","","13","P 63/m","-P 6c","176","","","Gagarinite-(Y)","- Ca0.475 Ce0.005 Dy0.05 Er0.02 F2.7 Gd0.045 Ho0.015 Na0.3 Nd0.005 Sm0.015 Tb0.005 Y0.36 Yb0.005 -","- Ca0.475 Ce0.005 Dy0.05 Er0.02 F2.7 Gd0.045 Ho0.015 Na0.3 Nd0.005 Sm0.015 Tb0.005 Y0.36 Yb0.005 -","- Ca0.95 Ce0.01 Dy0.1 Er0.04 F5.4 Gd0.09 Ho0.03 Na0.6 Nd0.01 Sm0.03 Tb0.01 Y0.72 Yb0.01 -","2","0.166667","","Hughes, J. M.; Drexler, J. W.","Refinement of the structure of gagarinite-(Y), Nax(CaxREE2-x)F6","The Canadian Mineralogist","1994","32","","563","565","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004596","9.416","","9.416","","6.924","","90","","90","","120","","531.644","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.417 F O12 P3 Sr0.583 -","- Ca4.4169 F O12 P3 Sr0.5831 -","- Ca8.8338 F2 O24 P6 Sr1.1662 -","2","0.166667","","Rakovan J F; Hughes J M","Strontium in the apatite structure: Strontian fluorapatite and belovite-(Ce)","The Canadian Mineralogist","2000","38","","839","845","10.2113/gscanmin.38.4.839","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9005199","25.771","","25.771","","5.371","","90","","90","","120","","3089.22","","","","","","","","","","","","Vesuvius, Italy","7","P 63/m","-P 6c","176","","","Quadridavyne","- Al12 Ca4 Cl8 K3.84 Na8.16 O48 Si12 -","- Al12 Ca4 Cl8.00002 K3.84 Na8.16 O48 Si12 -","- Al24 Ca8 Cl16 K7.68 Na16.32 O96 Si24 -","2","0.166667","","Bonaccorsi, E.; Merlino, S.; Orlandi, P.; Pasero, M.; Vezzalini, G.","Quadridavyne, [(Na,K)6Cl2][Ca2Cl2][Si6Al6O24], a new feldspathoid mineral from Vesuvius area Note: Cl1 y-coordinate altered","European Journal of Mineralogy","1994","6","","481","487","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13",""
"9005245","9.404","","9.404","","7.636","","90","","90","","120","","584.819","","","","","","","","","","","","Moctezuma Mine, Moctezuma, Sonora, Mexico","7","P 63/m","-P 6c","176","","","Zemannite","- Fe1.1 H24 Mg0.45 Mn0.08 O13.08 Te3 Zn0.82 -","- Fe1.1 H8.16 Mg0.45 Mn0.08 O13.08 Te3 Zn0.82 -","- Fe2.2 H16.32 Mg0.9 Mn0.16 O26.16 Te6 Zn1.64 -","2","0.166667","","Miletich, F.","Crystal chemistry of the microporous tellurite minerals zemannite and kinichilite, Mg0.5[MeFe(TeO3)3].4.5H2O, (Me=Zn;Mn) Note: sample moc6","European Journal of Mineralogy","1995","7","","509","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9005246","9.42","","9.42","","7.657","","90","","90","","120","","588.425","","","","","","","","","","","","Bambolla Mine, Moctezuma, Sonora, Mexico","7","P 63/m","-P 6c","176","","","Zemannite","- Fe0.98 H24 Mg0.51 Mn0.18 O13.5 Te3 Zn0.84 -","- Fe0.98 H9 Mg0.51 Mn0.18 O13.5 Te3 Zn0.84 -","- Fe1.96 H18 Mg1.02 Mn0.36 O27 Te6 Zn1.68 -","2","0.166667","","Miletich, F.","Crystal chemistry of the microporous tellurite minerals zemannite and kinichilite, Mg0.5[MeFe(TeO3)3].4.5H2O, (Me=Zn;Mn) Note: sample bam6","European Journal of Mineralogy","1995","7","","509","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9005247","9.451","","9.451","","7.687","","90","","90","","120","","594.625","","","","","","","","","","","","Kawazu Mine, Rendaiji, Shimoda City, Shizuoka Prefecture, Japan","7","P 63/m","-P 6c","176","","","Kinichilite","- Fe0.98 H24 Mg0.51 Mn0.48 O13.5 Te3 Zn0.54 -","- Fe0.98 H9 Mg0.51 Mn0.48 O13.5 Te3 Zn0.54 -","- Fe1.96 H18 Mg1.02 Mn0.96 O27 Te6 Zn1.08 -","2","0.166667","","Miletich, F.","Crystal chemistry of the microporous tellurite minerals zemannite and kinichilite, Mg0.5[MeFe(TeO3)3].4.5H2O, (Me=Zn;Mn) Note: sample kaw4","European Journal of Mineralogy","1995","7","","509","523","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9005289","10.589","","10.589","","5.891","","90","","90","","120","","572.044","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Hoffmann, C.; Armbruster, T.; Kunz, M.","Structure refinement of (001) disordered gaudefroyite Ca4Mn3[(BO3)3(CO3)O3]: Jahn-Teller-distortion in edge-sharing chains of MnO6 octahedra","European Journal of Mineralogy","1997","9","","7","19","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9006344","12.871","","12.871","","5.371","","90","","90","","120","","770.567","","","","943","","","","","","","","","8","P 63/m","-P 6c","176","","","Microsommite","- Al3 Ca Cl1.12 K0.99 Na2.01 O13.5 S0.44 Si3 -","- Al3 Ca Cl1.11999 K0.99 Na2.01 O13.5 S0.44 Si3 -","- Al6 Ca2 Cl2.23998 K1.98 Na4.02 O27 S0.88 Si6 -","2","0.166667","","Bonaccorsi, E.; Comodi, P.; Merlino, S.","Thermal behaviour of davyne-group minerals Sample: T = 943 K","Physics and Chemistry of Minerals","1995","22","","367","374","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:14",""
"9006444","13.633","","13.633","","5.913","","90","","90","","120","","951.747","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Mixite","- As3 Bi Cu6 H60 O21 -","- As3 Bi Cu6 H11.9999 O21 -","- As6 Bi2 Cu12 H23.9999 O41.9999 -","2","0.166667","","Miletich, R.; Zemann, J.; Nowak, M.","Reversible hydration in synthetic mixite, BiCu6(OH)6(AsO4)3.nH2O(n<=3): hydration kinetics and crystal chemistry Sample: H20","Physics and Chemistry of Minerals","1997","24","","411","422","10.1007/s002690050055","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9006445","13.631","","13.631","","5.905","","90","","90","","120","","950.18","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Mixite","- As3 Bi Cu6 H36 O19 -","- As3 Bi Cu6 H7.99998 O19 -","- As6 Bi2 Cu12 H16 O38 -","2","0.166667","","Miletich, R.; Zemann, J.; Nowak, M.","Reversible hydration in synthetic mixite, BiCu6(OH)6(AsO4)3.nH2O(n<=3): hydration kinetics and crystal chemistry Sample: N2","Physics and Chemistry of Minerals","1997","24","","411","422","10.1007/s002690050055","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9006952","9.375","","9.375","","6.887","","90","","90","","120","","524.208","","","","","","","","100","","","","","4","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","","Comodi P; Liu Y; Zanazzi P F; Montagnoli M","Structural and vibrational behaviour of fluorapatite with pressure. Part 1: in situ single-crystal X-ray diffraction investigation Sample: P = .0001 GPa","Physics and Chemistry of Minerals","2001","28","","219","224","10.1007/s002690100154","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006953","9.268","","9.268","","6.834","","90","","90","","120","","508.367","","","","","","","","3040000","","","","","4","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","","Comodi P; Liu Y; Zanazzi P F; Montagnoli M","Structural and vibrational behaviour of fluorapatite with pressure. Part 1: in situ single-crystal X-ray diffraction investigation Sample: P = 3.04 GPa","Physics and Chemistry of Minerals","2001","28","","219","224","10.1007/s002690100154","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006954","9.224","","9.224","","6.805","","90","","90","","120","","501.415","","","","","","","","4720000","","","","","4","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 F O12 P3 -","- Ca5 F O12 P3 -","- Ca10 F2 O24 P6 -","2","0.166667","","Comodi P; Liu Y; Zanazzi P F; Montagnoli M","Structural and vibrational behaviour of fluorapatite with pressure. Part 1: in situ single-crystal X-ray diffraction investigation Sample: P = 4.72 GPa","Physics and Chemistry of Minerals","2001","28","","219","224","10.1007/s002690100154","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9007381","6.7766","","6.7766","","9.9275","","90","","90","","120","","394.816","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- K2 O9 Si3 Ti -","- K2 O9 Si3 Ti -","- K4 O18 Si6 Ti2 -","2","0.166667","","Xu, H.; Navrotsky, A.; Balmer, M. L.; Su, Y.","Crystal-chemical and energetic systematics of wadeite-type phases A2BSi3O9 (A = K, Cs; B = Si, Ti, Zr)","Physics and Chemistry of Minerals","2005","32","","426","435","10.1007/s00269-005-0017-2","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:08",""
"9007382","6.936","","6.936","","10.1822","","90","","90","","120","","424.219","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Wadeite","- K2 O9 Si3 Zr -","- K2 O9 Si3 Zr -","- K4 O18 Si6 Zr2 -","2","0.166667","","Xu, H.; Navrotsky, A.; Balmer, M. L.; Su, Y.","Crystal-chemical and energetic systematics of wadeite-type phases A2BSi3O9 (A = K, Cs; B = Si, Ti, Zr)","Physics and Chemistry of Minerals","2005","32","","426","435","10.1007/s00269-005-0017-2","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:08",""
"9007383","7.2319","","7.2319","","10.2688","","90","","90","","120","","465.109","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Cs2 O9 Si3 Zr -","- Cs2 O9 Si3 Zr -","- Cs4 O18 Si6 Zr2 -","2","0.166667","","Xu, H.; Navrotsky, A.; Balmer, M. L.; Su, Y.","Crystal-chemical and energetic systematics of wadeite-type phases A2BSi3O9 (A = K, Cs; B = Si, Ti, Zr)","Physics and Chemistry of Minerals","2005","32","","426","435","10.1007/s00269-005-0017-2","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007630","10.284","","10.284","","7.651","","90","","90","","120","","700.766","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Alforsite","- Ba5 Cl O12 P3 -","- Ba5 Cl O12 P3 -","- Ba10 Cl2 O24 P6 -","2","0.166667","","Hata, M.; Marumo, F.; Iwai, S.; Aoki, H.","Structure of barium chlorapatite","Acta Crystallographica, Section B","1979","35","","2382","2384","10.1107/S0567740879009377","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007649","9.334","","9.334","","6.759","","90","","90","","120","","509.975","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Na0.5 O13 Si3 Y4.5 -","- Na0.5 O13 Si3 Y4.5 -","- Na O26 Si6 Y9 -","2","0.166667","","Gunawardane, R. P.; Howie, R. A.; Glasser, F. P.","Structure of the oxyapatite NaY9(SiO4)6O2 Note: apatite structure","Acta Crystallographica, Section B","1982","38","","1564","1566","10.1107/S0567740882006396","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007709","13.583","","13.583","","5.895","","90","","90","","120","","941.902","","","","","","","","","","","","","10","P 63/m","-P 6c","176","","","Zalesiite","- As3 Ca0.4 Ce0.06 Cu6 Fe0.09 H18 La0.04 Nd0.01 O21 Y0.31 -","- As3 Ca0.4 Ce0.06 Cu6 Fe0.09 H12 La0.04 Nd0.01 O21 Y0.31 -","- As6 Ca0.8 Ce0.12 Cu12 Fe0.18 H24 La0.08 Nd0.02 O42 Y0.62 -","2","0.166667","","Aruga, A.; Nakai, I.","Structure of Ca-rich agardite, (Ca0.40Y0.31Fe0.09Ce0.06La0.04Nd0.01)Cu6.19[(AsO4)2.42(HAsO4)0.49](OH)6.38*3H2O Locality: Setoda, Hiroshima, Japan","Acta Crystallographica, Section C","1985","41","","161","163","10.1107/S0108270185003158","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9007828","7.7053","","7.7053","","14.8155","","90","","90","","120","","761.774","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","- C6 Cr La N6 O5 -","- C6 Cr La N6 O5 -","- C12 Cr2 La2 N12 O10 -","2","0.166667","","Dommann, A.; Vetsch, H.; Hulliger, F.","Structure of LaCr(CN)6.5H2O","Acta Crystallographica, Section C","1990","46","","1994","1996","10.1107/S0108270190002694","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007850","9.6513","","9.6513","","29.939","","90","","90","","120","","2415.12","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Cs5 Mo21 Se23 -","- Cs5 Mo21 Se23 -","- Cs10 Mo42 Se46 -","2","0.166667","","Gougeon, P.; Potel, M.; Sergent, M.","Structure of Cs5Mo21Se23 containing Mo21 clusters","Acta Crystallographica, Section C","1990","46","","2284","2287","10.1107/S0108270190005650","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007888","10.076","","10.076","","6.807","","90","","90","","120","","598.498","","","","","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Turneaureite","- As3 Ca5 Cl O12 -","- As3 Ca5 Cl O12 -","- As6 Ca10 Cl2 O24 -","2","0.166667","","Wardojo, T. A.; Hwu, S.-J.","Chlorapatite: Ca5(AsO4)3Cl Note: anisotropic temperature factors taken from ICSD","Acta Crystallographica, Section C","1996","52","","2959","2960","10.1107/S0108270196011006","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007924","9.4959","","9.4959","","7.0361","","90","","90","","120","","549.459","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- O13 Si3 Sm5 -","- O13 Si3 Sm5 -","- O26 Si6 Sm10 -","2","0.166667","","Morgan, M. G.; Wang, M.; Mar, A.","Samarium orthosilicate oxyapatite, Sm5(SiO4)3O","Acta Crystallographica, Section E","2002","58","","i70","i71","10.1107/S1600536802011868","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007994","10.5565","","10.5565","","7.7584","","90","","90","","120","","748.76","","","","","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","","- Ba5 Cl O12 V3 -","- Ba5 Cl O12 V3 -","- Ba10 Cl2 O24 V6 -","2","0.166667","","Roh, Y. H.; Hong, S. T.","Apatite-type Ba5(VO4)3Cl","Acta Crystallographica, Section E","2005","61","","i140","i142","10.1107/S1600536805018854","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008278","7.006","","7.006","","9.786","","90","","90","","120","","415.984","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Bi2 Ge3 O9 -","- Bi2 Ge3 O9 -","- Bi4 Ge6 O18 -","2","0.166667","","Grabmaier, B. C.; Haussuhl, S.; Klufers, P.","Crystal growth, structure, and physical properties of Bi2Ge3O9","Zeitschrift fur Kristallographie","1979","149","","261","267","10.1524/zkri.1979.149.3-4.261","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008311","8.556","","8.556","","8.175","","90","","90","","120","","518.275","","","","","","","","","","","","Cape Cross, Namibia","4","P 63/m","-P 6c","176","","","Jeremejevite","- Al6 B5 F3 O15 -","- Al6 B5 F3 O15 -","- Al12 B10 F6 O30 -","2","0.166667","","Rodellas, C.; Garcia-Blanco S; Vegas, A.","Crystal structure refinement of jeremejevite (Al6B5F3O15)","Zeitschrift fur Kristallographie","1983","165","","255","260","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:55:58",""
"9009221","27.559","","27.559","","10.55","","90","","90","","120","","6939.21","","","","","","","","","","","","Avant's Claim, near Shady, Polk County, Arkansas, USA","5","P 63/m","-P 6c","176","","","Cacoxenite","- Al4 Fe21 H60 O110 P17 -","- Al4 Fe21 H54 O110 P17 -","- Al8 Fe42 H108 O220 P34 -","2","0.166667","","Moore P B; Shen J","An X-ray structural study of cacoxenite, a mineral phosphate","Nature","1983","306","","356","358","10.1038/306356a0","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9009300","13.605","","13.605","","5.917","","90","","90","","120","","948.482","","","","","","","","","","","","Clara mine, Black Forest, Baden-Wurttemberg, Germany","5","P 63/m","-P 6c","176","","","Agardite-(Ce)","- As3 Ce0.707 Cu6 H18 O21 -","- As3 Ce0.707 Cu6 H12 O21 -","- As6 Ce1.414 Cu12 H24 O42 -","2","0.166667","","Hess, H.","Die kristallstruktur des chlorotils, SECu6(AsO4)3(OH)6*3H2O (SE = seltene erdmetalle)","Neues Jahrbuch fur Mineralogie, Monatshefte","1983","1983","","385","392","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9009462","9.446","","9.446","","6.895","","90","","90","","120","","532.796","","","","","","","","","","","","core samples of the Cesano I geothermal well, Cesano area, Latium, Italy","5","P 63/m","-P 6c","176","","","Cesanite","- Ca1.49 H2.47 Na3.51 O12.94 S3 -","- Ca1.49 H1.41 Na3.51 O12.94 S3 -","- Ca2.98 H2.82 Na7.02 O25.88 S6 -","2","0.166667","","Tazzoli, V.","The crystal structure of cesanite, Ca1+xNa4-x(SO4)3(OH)x*(1-x)H2O, a sulphate isotypic of apatite Locality: core samples of the Cesano I geothermal well, Cesano area, Latium, Italy","Mineralogical Magazine","1983","47","","59","63","10.1180/minmag.1983.047.342.10","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9009572","8.827","","8.827","","3.085","","90","","90","","120","","208.167","","","","","","","","","","","","Nocera, Italy","4","P 63/m","-P 6c","176","","","Fluoborite","- B F3 Mg3 O3 -","- B F3 Mg3 O3 -","- B2 F6 Mg6 O6 -","2","0.166667","","Dal Negro, A.; Tadini, C.","Refinement of the crystal structure of fluoborite, Mg3(F,OH)3(BO3)","Tschermaks Mineralogische und Petrographische Mitteilungen","1974","21","","94","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009594","5.755","","5.755","","25.12","","90","","90","","120","","720.512","","","","","","","","","","","","Campomorto, Montalto di Castro","5","P 63/m","-P 6c","176","","","Vertumnite","- Al2.126 Ca2 H22 O15.72 Si1.434 -","- Al2.126 Ca2 H13.42 O15.72 Si1.434 -","- Al4.252 Ca4 H26.84 O31.44 Si2.868 -","2","0.166667","","Galli, E.; Passaglia, E.","Vertumnite: its crystal structure and relationship with natural and synthetic phases Locality: Campomorto, Montalto di Castro","Tschermaks Mineralogische und Petrographische Mitteilungen","1978","25","","33","46","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9009599","10.322","","10.322","","7.054","","90","","90","","120","","650.869","","","","","","","","","","","","Langban, Varmland, Sweden","4","P 63/m","-P 6c","176","","","Finnemanite","- As3 Cl O9 Pb5 -","- As3 Cl O9 Pb5 -","- As6 Cl2 O18 Pb10 -","2","0.166667","","Effenberger, H.; Pertlik, F.","Die kristallstruktur des finnemanits, Pb5Cl(AsO3)3, mit einem vergleich zum strukturtyp des chlorapatits, Ca5Cl(PO4)3","Tschermaks Mineralogische und Petrographische Mitteilungen","1979","26","","95","107","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009867","10.322","","10.322","","7.054","","90","","90","","120","","650.869","","","","","","","","","","","","Langban, Varmland, Sweden","4","P 63/m","-P 6c","176","","","Finnemanite","- As3 Cl O9 Pb5 -","- As3 Cl O9 Pb5 -","- As6 Cl2 O18 Pb10 -","2","0.166667","","Effenberger, H.; Pertlik, F.","Der strukturtyp von finnemanit, Pb5Cl(AsO3)3","Anzeiger der Osterreichische Akademie der Wissenschaften","1977","114","","209","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009869","13.646","","13.646","","5.92","","90","","90","","120","","954.692","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Mixite","- As3 Bi0.66 Ca0.34 Cu6 H7.8 O21 -","- As3 Bi0.66 Ca0.34 Cu6 H12 O21 -","- As6 Bi1.32 Ca0.68 Cu12 H24 O42 -","2","0.166667","","Mereiter K; Preisinger A","Kristallstrukturdaten der wismutminerale atelestit, mixit und pucherit Locality: Tintic, Utah, USA","Anzeiger der Osterreichische Akademie der Wissenschaften","1986","123","","79","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009978","9.3207","","9.3207","","6.8947","","90","","90","","120","","518.732","","","","299.15","","","","","","","","Epirus, Greece","4","P 63/m","-P 6c","176","","","Carbonate-fluorapatite","- Ca2.019 F0.165 O8.832 P1.182 -","- Ca2.019 F0.165 O8.832 P1.182 -","- Ca4.038 F0.33 O17.664 P2.364 -","2","0.166667","","Perdikatsis, B.","X-ray powder diffraction study of francolite by the Rietveld method Sample: T = 26 C Note: Reported structure does not reproduce reported formula or bondlengths","Materials Science Forum","1991","","","809","814","10.4028/www.scientific.net/MSF.79-82.809","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:33",""
"9009979","9.323","","9.323","","6.8987","","90","","90","","120","","519.289","","","","803.15","","","","","","","","Epirus, Greece","4","P 63/m","-P 6c","176","","","Carbonate-fluorapatite","- Ca2.07 F0.163 O8.922 P1.239 -","- Ca2.07 F0.163 O8.922 P1.239 -","- Ca4.14 F0.326 O17.844 P2.478 -","2","0.166667","","Perdikatsis, B.","X-ray powder diffraction study of francolite by the Rietveld method Sample: T = 530 C Note: Reported structure does not reproduce reported formula or bondlengths","Materials Science Forum","1991","","","809","814","10.4028/www.scientific.net/MSF.79-82.809","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:33",""
"9009980","9.3593","","9.3593","","6.8919","","90","","90","","120","","522.825","","","","1023.15","","","","","","","","Epirus, Greece","4","P 63/m","-P 6c","176","","","Carbonate-fluorapatite","- Ca2.108 F0.171 O8.817 P1.362 -","- Ca2.108 F0.171 O8.817 P1.362 -","- Ca4.216 F0.342 O17.634 P2.724 -","2","0.166667","","Perdikatsis, B.","X-ray powder diffraction study of francolite by the Rietveld method Sample: T = 750 C Note: Reported structure does not reproduce reported formula or bondlengths","Materials Science Forum","1991","","","809","814","10.4028/www.scientific.net/MSF.79-82.809","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:33",""
"9009981","9.3708","","9.3708","","6.888","","90","","90","","120","","523.814","","","","1473.15","","","","","","","","Epirus, Greece","4","P 63/m","-P 6c","176","","","Carbonate-fluorapatite","- Ca2.176 F0.169 O8.973 P1.488 -","- Ca2.176 F0.169 O8.973 P1.488 -","- Ca4.352 F0.338 O17.946 P2.976 -","2","0.166667","","Perdikatsis, B.","X-ray powder diffraction study of francolite by the Rietveld method Sample: T = 1200 C Note: Reported structure does not reproduce reported formula or bondlengths","Materials Science Forum","1991","","","809","814","10.4028/www.scientific.net/MSF.79-82.809","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:33",""
"9010134","9.857","","9.857","","7.13","","90","","90","","120","","599.943","","","","","","","","","","","","Capitana mine, Copiapo, Atacama Province, Chile","6","P 63/m","-P 6c","176","","","Phosphohedyphane","- As0.279 Ca1.838 Cl O12 P2.721 Pb3.162 -","- As0.279 Ca1.838 Cl O12 P2.721 Pb3.162 -","- As0.558 Ca3.676 Cl2 O24 P5.442 Pb6.324 -","2","0.166667","","Kampf, A. R.; Steele, I. M.; Jenkins, R. A.","Phosphohedyphane, Ca2Pb3(PO4)3Cl, the phosphate analogue of hedyphane: Description and crystal structure","American Mineralogist","2006","91","","1909","1917","10.2138/am.2006.2268","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9010136","9.496","","9.496","","6.92","","90","","90","","120","","540.403","","","","","","","","","","","","","8","P 63/m","-P 6c","176","","","Hydroxylellestadite","- Ca5 Cl0.07 F0.09 H0.82 O12.82 P0.66 S1.08 Si1.26 -","- Ca5 Cl0.07 F0.09 O12.82 P0.66 S1.08 Si1.26 -","- Ca10 Cl0.14 F0.18 O25.64 P1.32 S2.16 Si2.52 -","2","0.166667","","Onac, B. P.; Effenberger, H.; Ettinger, K.; Panzaru, S. P.","Hydroxylellestadite from Cioclovina Cave (Romania): Microanalytical, structural, and vibrational spectroscopy data Locality: Cioclovina Cave, Sureanu Mountains, Romania","American Mineralogist","2006","91","","1927","1931","10.2138/am.2006.2143","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010382","9.441","","9.441","","6.835","","90","","90","","120","","527.6","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 Cl0.4 F0.5 H0.1 O12.1 P3 -","- Ca5 Cl0.4 F0.5 H0.1 O12.1 P3 -","- Ca10 Cl0.8 F H0.2 O24.2 P6 -","2","0.166667","","McCubbin, F. M.; Mason, H. E.; Park, H.; Phillips, B. L.; Parise, J. B.; Nekvasil, H.; Lindsley, D. H.","Synthesis and characterization of low-OH- fluor-chlorapatite: a single-crystal XRD and NMR spectroscopic study Locality: synthetic","American Mineralogist","2008","93","","210","216","10.2138/am.2008.2557","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9010504","9.3648","","9.3648","","6.8879","","90","","90","","120","","523.136","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Fluorapatite","- C0.042 Ca5 F0.921 O12.321 P2.883 -","- C0.042 Ca5 F0.921 O12.321 P2.883 -","- C0.084 Ca10 F1.842 O24.642 P5.766 -","2","0.166667","","Fleet, M. E.; Liu, X.","Accommodation of the carbonate ion in fluorapatite synthesized at high pressure Locality: synthetic Note: LM130 sample","American Mineralogist","2008","93","","1460","1469","10.2138/am.2008.2786","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9010505","9.3679","","9.3679","","6.8885","","90","","90","","120","","523.528","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Fluorapatite","- C0.078 Ca5 F0.842 O12.402 P2.895 -","- C0.078 Ca5 F0.842 O12.402 P2.895 -","- C0.156 Ca10 F1.684 O24.804 P5.79 -","2","0.166667","","Fleet, M. E.; Liu, X.","Accommodation of the carbonate ion in fluorapatite synthesized at high pressure Locality: synthetic Note: LM136 sample","American Mineralogist","2008","93","","1460","1469","10.2138/am.2008.2786","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9010506","9.3659","","9.3659","","6.8901","","90","","90","","120","","523.426","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Fluorapatite","- C0.066 Ca5 F0.864 O12.381 P2.883 -","- C0.066 Ca5 F0.864 O12.381 P2.883 -","- C0.132 Ca10 F1.728 O24.762 P5.766 -","2","0.166667","","Fleet, M. E.; Liu, X.","Accommodation of the carbonate ion in fluorapatite synthesized at high pressure Locality: synthetic Note: LM142 sample","American Mineralogist","2008","93","","1460","1469","10.2138/am.2008.2786","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9010646","10.60791","","10.60791","","5.88603","","90","","90","","120","","573.605","","","","298.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: HRPXRD, T = 25 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010647","10.60074","","10.60074","","5.88402","","90","","90","","120","","572.634","","","","298.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 25 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010648","10.60643","","10.60643","","5.88761","","90","","90","","120","","573.599","","","","332.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 59 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010649","10.61129","","10.61129","","5.89062","","90","","90","","120","","574.418","","","","366.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 93 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010650","10.61864","","10.61864","","5.89528","","90","","90","","120","","575.669","","","","418.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 145 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010651","10.62601","","10.62601","","5.90008","","90","","90","","120","","576.938","","","","469.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 196 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010652","10.63402","","10.63402","","5.9052","","90","","90","","120","","578.309","","","","520.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 247 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010653","10.64342","","10.64342","","5.91056","","90","","90","","120","","579.858","","","","571.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 298 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010654","10.65448","","10.65448","","5.91703","","90","","90","","120","","581.7","","","","623.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 350 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010655","10.65998","","10.65998","","5.92041","","90","","90","","120","","582.633","","","","657.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 384 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010656","10.66317","","10.66317","","5.92221","","90","","90","","120","","583.159","","","","674.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 401 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010657","10.67026","","10.67026","","5.92616","","90","","90","","120","","584.324","","","","725.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 452 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010658","10.67467","","10.67467","","5.92984","","90","","90","","120","","585.171","","","","759.15","","","","","","","","Wessels mine, Kalahari manganese field, South Africa","5","P 63/m","-P 6c","176","","","Gaudefroyite","- C B3 Ca4 Mn3 O15 -","- C B3 Ca4 Mn3 O15 -","- C2 B6 Ca8 Mn6 O30 -","2","0.166667","","Antao, S. M.; Hassan, I.","Gaudefroyite, Ca8Mn3+6[(BO3)6(CO3)2O6]: high-temperature crystal structure Sample: T = 486 C","The Canadian Mineralogist","2008","46","","183","193","10.3749/canmin.46.1.183","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010733","12.8784","","12.8784","","37.0078","","90","","90","","120","","5315.54","","","","","","","","","","","","Latera Caldera, Farnese, Viterbo Province, Italy","10","P 63/m","-P 6c","176","","","Farneseite","- Al21 Ca4.26 Cl0.24 F0.078 H10 K4.59 Na17.826 O111.512 S5.366 Si21 -","- Al21 Ca4.26 Cl0.24 F0.078 H3.024 K4.59 Na17.826 O111.512 S5.366 Si21 -","- Al42 Ca8.52 Cl0.48 F0.156 H6.048 K9.18 Na35.652 O223.024 S10.732 Si42 -","2","0.166667","","Camara, F.; Bellatreccia, F.; Della Ventura, G.; Mottana, A.","Farneseite, a new mineral of the cancrinite - sodalite group with a 14-layer stacking sequence: occurence and crystal structure","European Journal of Mineralogy","2005","17","","839","846","10.1127/0935-1221/2005/0017-0839","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010784","9.58","","9.58","","6.985","","90","","90","","120","","555.173","","","","","","","","","","","","Mount Kukisvumchorr, Khibiny alkaline complex, Kola Peninsula, Russia","10","P 63/m","-P 6c","176","","","Fluorcalciobritholite","- Ca3.006 Ce0.931 F La0.542 Nd0.261 O12 P1.05 Pr0.079 Si1.95 Y0.179 -","- Ca3.006 Ce0.931 F La0.542 Nd0.261 O12 P1.05 Pr0.079 Si1.95 Y0.179 -","- Ca6.012 Ce1.862 F2 La1.084 Nd0.522 O24 P2.1 Pr0.158 Si3.9 Y0.358 -","2","0.166667","","Pekov, I. V.; Pasero, M.; Yaskovskaya, A. N.; Chukanov, N. V.; Pushcharovsky, D. Y.; Merlino, S.; Zubkova, N. V.; Kononkova, N. N.; Men'shikov, Y. P.; Zadov, A. E.","Fluorcalciobritholite, (Ca,REE)5[(Si,P)O4]3F, a new mineral: description and crystal chemistry Locality: Mount Kukisvumchorr, Khibiny alkaline complex, Kola Peninsula, Russia","European Journal of Mineralogy","2007","19","","95","103","10.1127/0935-1221/2007/0019-0095","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9011091","9.424","","9.424","","6.879","","90","","90","","120","","529.086","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H O13 P3 -","- Ca5 H O13 P3 -","- Ca10 H2 O26 P6 -","2","0.166667","","Sudarsanan, K.; Young, R. A.","Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-4","Acta Crystallographica, Section B","1969","25","","1534","1543","10.1107/S0567740869004298","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9011092","9.424","","9.424","","6.879","","90","","90","","120","","529.086","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H O13 P3 -","- Ca5 H O13 P3 -","- Ca10 H2 O26 P6 -","2","0.166667","","Sudarsanan, K.; Young, R. A.","Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-6","Acta Crystallographica, Section B","1969","25","","1534","1543","10.1107/S0567740869004298","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9011093","9.424","","9.424","","6.879","","90","","90","","120","","529.086","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H O13 P3 -","- Ca5 H O13 P3 -","- Ca10 H2 O26 P6 -","2","0.166667","","Sudarsanan, K.; Young, R. A.","Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-10","Acta Crystallographica, Section B","1969","25","","1534","1543","10.1107/S0567740869004298","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9011094","9.424","","9.424","","6.879","","90","","90","","120","","529.086","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H O13 P3 -","- Ca5 H O13 P3 -","- Ca10 H2 O26 P6 -","2","0.166667","","Sudarsanan, K.; Young, R. A.","Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: Neutron","Acta Crystallographica, Section B","1969","25","","1534","1543","10.1107/S0567740869004298","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9011131","9.745","","9.745","","7.265","","90","","90","","120","","597.489","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Strontium-apatite","- H0.886 O12.886 P3 Sr4.894 -","- H0.886 O12.886 P3 Sr4.8944 -","- H1.772 O25.772 P6 Sr9.7888 -","2","0.166667","","Sudarsanan, K.; Young, R. A.","Structure of strontium hydroxide phosphate, Sr5(PO4)3OH Locality: synthetic","Acta Crystallographica, Section B","1972","28","","3668","3670","10.1107/S0567740872008544","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9011219","9.761","","9.761","","6.739","","90","","90","","120","","556.051","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Br1.012 Ca4.922 O11.965 P2.896 -","- Br1.0122 Ca4.9224 O11.9646 P2.8962 -","- Br2.0244 Ca9.8448 O23.9292 P5.7924 -","2","0.166667","","Elliott, J. C.; Dykes, E.; Mackie, P. E.","Structure of bromapatite and the radius of the bromide ion","Acta Crystallographica, Section B","1981","37","","435","438","10.1107/S0567740881003208","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9011386","9.3938","","9.3938","","6.9013","","90","","90","","120","","527.405","","","","","","","","","","","","Synthetic","6","P 63/m","-P 6c","176","","","","- Ca4.5 F0.77 Nd0.5 O12.14 P2.55 Si0.45 -","- Ca4.5 F0.77 Nd0.5 O12.14 P2.55 Si0.45 -","- Ca9 F1.54 Nd O24.28 P5.1 Si0.9 -","2","0.166667","","Boyer, L.; Savariault, J. M.; Carpena, J.; Lacout, J. L.","A neodymium-substituted britholite compound","Acta Crystallographica, Section C","1998","54","","1057","1059","10.1107/S0108270197019306","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9011401","10.557","","10.557","","7.73912","","90","","90","","120","","746.97","","","","","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Morelandite","- As3 Ba5 Cl O12 -","- As3 Ba5 Cl O12 -","- As6 Ba10 Cl2 O24 -","2","0.166667","","Bell, A. M. T.; Henderson, C. M. B.; Wendlandt, R. F.; Harrison, W. J.","Rietveld refinement of Ba5(AsO4)3Cl from high-resolution synchrotron data","Acta Crystallographica, Section E","2008","64","","i63","i64","10.1107/S1600536808026901","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9011736","9.81","","9.81","","7.14","","90","","90","","120","","595.068","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Caracolite","- Cl Na3 O12 Pb2 S3 -","- Cl2 Na5.99998 O24 Pb4.00002 S6 -","- Cl2 Na5.99998 O24 Pb4.00002 S6 -","","","","Schneider, W.","Caracolit, das Na3Pb2(SO4)3Cl mit apatitstruktur","Neues Jahrbuch fur Mineralogie, Monatshefte","1967","1967","","284","289","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:57",""
"9011748","12.705","","12.705","","5.368","","90","","90","","120","","750.399","","","","","","","","","","","","Monte Somma, Vesuvius, Italy","8","P 63/m","-P 6c","176","","","Davyne","- Al3 Ca Cl1.333 K0.87 Na2.13 O13.333 S0.333 Si3 -","- Al3 Ca Cl1.33335 K0.87 Na2.13 O13.3334 S0.33333 Si3 -","- Al6 Ca2 Cl2.6667 K1.74 Na4.26 O26.6668 S0.66666 Si6 -","2","0.166667","","Bonaccorsi, E.; Merlino, S.; Pasero, M.","Davyne: its structural relationships with cancrinite and vishnevite","Neues Jahrbuch fur Mineralogie, Monatshefte","1990","1990","","97","112","","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9011807","10.0056","","10.0056","","7.496","","90","","90","","120","","649.9","","","","","","","","","","","","Leadhills, Scotland","6","P 63/m","-P 6c","176","","","Mattheddleite","- Cl0.57 H0.43 O12.43 Pb5 S1.5 Si1.5 -","- Cl0.57 H0.43 O12.43 Pb5 S1.5 Si1.5 -","- Cl1.14 H0.86 O24.86 Pb10 S3 Si3 -","2","0.166667","","Steele, I. M.; Pluth, J. J.; Livingstone, A.","Crystal structure of mattheddleite: a Pb, S, Si phase with the apatite structure Locality: Leadhills, Scotland","Mineralogical Magazine","2000","64","","915","921","10.1180/002646100549742","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9011886","8.811","","8.811","","37.03","","90","","90","","120","","2489.63","","","","","","","","","","","","Lovozero pegmatites, Kola peninsula, Russia","11","P 63/m","-P 6c","176","","","Mineevite-(Y)","- C15 H4 Ba Cl Dy0.4 F2 Gd0.5 Na25 O53 S2 Y1.1 -","- C15 H3.99999 Ba Cl Dy0.4 F2 Gd0.5 Na25 O53 S2 Y1.1 -","- C30 H7.99998 Ba2 Cl2 Dy0.8 F4 Gd Na50 O106 S4 Y2.2 -","2","0.166667","","Yamonva, N. A.; Pushcharovskii, D. Y.; Vyatkin, S. V.; Khomyakov, A. P.","Crystal structure of the new native sulfate-carbonate Na25BaTR2(CO3)11(HCO3)4(SO4)2F2Cl Note: OH occupancies chosen to reproduce chemical formula","Soviet Physics Crystallography","1992","37","","753","756","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:11",""
"9012391","9.297","","9.297","","3.657","","90","","90","","120","","273.742","","","","","","","","","","","","Synthetic","2","P 63/m","-P 6c","176","","","Polkanovite","- As3.5 Rh6 -","- As7 Rh12 -","- As7 Rh12 -","","","","Pivan, J. Y.; Guerin, R.; Sergent, M.","Rh12As7, a host structure for rare earth elements: Crystal structures of Rh12As7 and Ho2Rh12As7 Locality: synthetic Note: x(RhII) corrected","Journal of the Less-Common Metals","1985","107","","249","258","10.1016/0022-5088(85)90084-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:29:59",""
"9012393","9.892","","9.892","","3.859","","90","","90","","120","","327.019","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- As3.5 Ho Rh6 -","- As7 Ho2 Rh12 -","- As7 Ho2 Rh12 -","","","","Pivan, J. Y.; Guerin, R.; Sergent, M.","Rh12As7, a host structure for rare earth elements: Crystal structures of Rh12As7 and Ho2Rh12As7","Journal of the Less-Common Metals","1985","107","","249","258","10.1016/0022-5088(85)90084-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:29:59",""
"9012394","9.315","","9.315","","3.659","","90","","90","","120","","274.953","","","","","","","","","","","","Synthetic","2","P 63/m","-P 6c","176","","","Polkanovite","- As3.5 Rh6 -","- As7 Rh12 -","- As7 Rh12 -","","","","Lambert-Andron B; Dhahri, E.; Chaudouet, P.; Madar, R.","Crystal structure of Rh12As7","Journal of the Less-Common Metals","1985","108","","353","358","10.1016/0022-5088(85)90230-9","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:29:59",""
"9012498","9.4343","","9.4343","","6.8885","","90","","90","","120","","530.976","","","","","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","","- Ca1.011 Ce3.989 O13 Si3 -","- Ca2.022 Ce7.978 O26 Si6 -","- Ca2.022 Ce7.978 O26 Si6 -","","","","Skakle, J. M. S.; Dickson, C. L.; Glasser, F. P.","The crystal structures of CeSiO4 and Ca2Ce8(SiO4)6O2","Powder Diffraction","2000","15","","234","238","10.1017/S0885715600011143","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:30:05",""
"9012631","9.774","","9.774","","7.291","","90","","90","","120","","603.201","","","","","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Pyromorphite","- H O13 P3 Pb5 -","- H O13 P3 Pb5 -","- H2 O26 P6 Pb10 -","2","0.166667","","Barinova, A. V.; Bonin, M.; Pushcharovsky, D. Y.; Rastsvetaeva, R. K.; Schenk, K.; Dimitrova, O. V.","Crystal structure of synthetic hydroxylpyromorphite Pb5(PO4)3(OH) Note: y(O3) corrected","Crystallography Reports","1998","43","","189","192","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9012719","9.44174","","9.44174","","6.93964","","90","","90","","120","","535.762","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluorellestadite","- Ca5 F O12 S1.5 Si1.5 -","- Ca10 F2 O24 S3 Si3 -","- Ca10 F2 O24 S3 Si3 -","","","","Pajares, I.; De la Torre, A. G.; Martinez-Ramirez S; Puertas, F.; Blanco-Varela M T; Aranda, M. A. G.","Quantitative analysis of mineralized white Portland clinkers: The structure of fluorellestadite Locality: synthetic","Powder Diffraction","2002","17","","281","286","10.1154/1.1505045","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9012807","9.6773","","9.6773","","6.8585","","90","","90","","120","","556.248","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Chlorellestadite","- Ca5 Cl O12 S1.5 Si1.5 -","- Ca10 Cl2 O24 S3 Si3 -","- Ca10 Cl2 O24 S3 Si3 -","","","","Saint-Jean S J; Hansen, S.","Nonstoichiometry in chlorellestadite Locality: synthetic Sample: Stoichiometric","Solid State Sciences","2005","7","","97","102","10.1016/j.solidstatesciences.2004.10.014","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9012808","9.5608","","9.5608","","6.8949","","90","","90","","120","","545.817","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Chlorellestadite","- Ca4.7 Cl0.4 O12 S1.5 Si1.5 -","- Ca9.4 Cl0.8 O24 S3 Si3 -","- Ca9.4 Cl0.8 O24 S3 Si3 -","","","","Saint-Jean S J; Hansen, S.","Nonstoichiometry in chlorellestadite Locality: synthetic Sample: Nonstoichiometric","Solid State Sciences","2005","7","","97","102","10.1016/j.solidstatesciences.2004.10.014","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9013140","7.6093","","7.6093","","2.9079","","90","","90","","120","","145.814","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","","","- N4 Si3 -","- N8 Si6 -","- N8 Si6 -","","","","Yang, P.; Fun, H.-K.; Rahman, I. A.; Saleh, M. I.","Two phase refinements of the structures of a-Si3N4 and B-Si3N4 made from rice husk by Rietveld analysis Sample: Beta phase","Ceramics International","1995","21","","137","142","10.1016/0272-8842(95)95885-L","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:29",""
"9013447","9.759","","9.759","","7.291","","90","","90","","120","","601.351","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Fluorphosphohedyphane","- Ca2.24 F O12 P3 Pb2.76 -","- Ca4.48 F2 O24 P6 Pb5.52 -","- Ca4.48 F2 O24 P6 Pb5.52 -","","","","Miyake, M.; Ishigaki, K.; Suzuki, T.","Structure refinements of Pb2+ ion-exchanged apatites by X-ray powder pattern-fitting Note: Sample FAp Locality: synthetic Note: apatite group","Journal of Solid State Chemistry","1986","61","","230","235","10.1016/0022-4596(86)90026-5","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:36",""
"9013448","9.99","","9.99","","7.276","","90","","90","","120","","628.86","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Pyromorphite","- Ca1.04 Cl O12 P3 Pb3.96 -","- Ca2.08 Cl2 O24 P6 Pb7.92 -","- Ca2.08 Cl2 O24 P6 Pb7.92 -","","","","Miyake, M.; Ishigaki, K.; Suzuki, T.","Structure refinements of Pb2+ ion-exchanged apatites by X-ray powder pattern-fitting Note: Sample ClAp Locality: synthetic Note: apatite group","Journal of Solid State Chemistry","1986","61","","230","235","10.1016/0022-4596(86)90026-5","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:36",""
"9013449","9.88","","9.88","","7.417","","90","","90","","120","","627.008","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Pyromorphite","- Ca1.31 H O13 P3 Pb3.69 -","- Ca1.31 H O13 P3 Pb3.69 -","- Ca2.62 H2 O26 P6 Pb7.38 -","2","0.166667","","Miyake, M.; Ishigaki, K.; Suzuki, T.","Structure refinements of Pb2+ ion-exchanged apatites by X-ray powder pattern-fitting Note: Sample OHAp Locality: synthetic Note: apatite group","Journal of Solid State Chemistry","1986","61","","230","235","10.1016/0022-4596(86)90026-5","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:50",""
"9013548","9.3709","","9.3709","","6.8849","","90","","90","","120","","523.589","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.958 F O12 P3 U0.042 -","- Ca9.912 F2 O24 P6 U0.084 -","- Ca9.912 F2 O24 P6 U0.084 -","","","","Luo, Y.; Hughes, J. M.; Rakovan, J.; Pan, Y.","Site preference of U and Th in Cl, F, and Sr apatites Locality: synthetic Note: UFAP","American Mineralogist","2009","94","","345","351","10.2138/am.2009.3026","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9013549","9.6233","","9.6233","","6.7784","","90","","90","","120","","543.633","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Chlorapatite","- Ca4.967 Cl2 O12 P3 U0.033 -","- Ca9.934 Cl4 O24 P6 U0.066 -","- Ca9.934 Cl4 O24 P6 U0.066 -","","","","Luo, Y.; Hughes, J. M.; Rakovan, J.; Pan, Y.","Site preference of U and Th in Cl, F, and Sr apatites Locality: synthetic Note: UClAP","American Mineralogist","2009","94","","345","351","10.2138/am.2009.3026","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9013550","9.375","","9.375","","6.883","","90","","90","","120","","523.903","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.961 F O12 P3 Th0.039 -","- Ca9.918 F2 O24 P6 Th0.078 -","- Ca9.918 F2 O24 P6 Th0.078 -","","","","Luo, Y.; Hughes, J. M.; Rakovan, J.; Pan, Y.","Site preference of U and Th in Cl, F, and Sr apatites Locality: synthetic Note: ThFAP","American Mineralogist","2009","94","","345","351","10.2138/am.2009.3026","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9013551","9.633","","9.633","","6.7834","","90","","90","","120","","545.131","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Chlorapatite","- Ca4.891 Cl2 O12 P3 Th0.109 -","- Ca9.782 Cl4 O24 P6 Th0.218 -","- Ca9.782 Cl4 O24 P6 Th0.218 -","","","","Luo, Y.; Hughes, J. M.; Rakovan, J.; Pan, Y.","Site preference of U and Th in Cl, F, and Sr apatites Locality: synthetic Note: ThClAP","American Mineralogist","2009","94","","345","351","10.2138/am.2009.3026","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9013552","9.7038","","9.7038","","7.2723","","90","","90","","120","","593.043","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","Stronadelphite","- F O12 P3 Sr4.965 Th0.035 -","- F2 O24 P6 Sr9.93 Th0.07 -","- F2 O24 P6 Sr9.93 Th0.07 -","","","","Luo, Y.; Hughes, J. M.; Rakovan, J.; Pan, Y.","Site preference of U and Th in Cl, F, and Sr apatites Locality: synthetic Note: ThSrFAP","American Mineralogist","2009","94","","345","351","10.2138/am.2009.3026","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9013558","9.8562","","9.8562","","7.2095","","90","","90","","120","","606.534","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Apatite-(SrCl)","- Cl O12 P3 Sr4.94 Th0.06 -","- Cl2 O24 P6 Sr9.88 Th0.12 -","- Cl2 O24 P6 Sr9.88 Th0.12 -","","","","Luo, Y.; Hughes, J. M.; Rakovan, J.; Pan, Y.","Site preference of U and Th in Cl, F, and Sr apatites Note: ThSrClAP","American Mineralogist","2009","94","","345","351","10.2138/am.2009.3026","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:36",""
"9013627","9.4212","","9.4212","","6.8927","","90","","90","","120","","529.825","","","","","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H O13 P3 -","- Ca5 H O13 P3 -","- Ca10 H2 O26 P6 -","2","0.166667","","Lee, Y. J.; Stephens, P. W.; Tang, Y.; Li, W.; Phillips, B. L.; Parise, J. B.; Reeder, R. J.","Arsenate substitution in hydroxylapatite: Structural characterization of the Ca5(PxAs1-xO4)3OH solid solution Sample: As0","American Mineralogist","2009","94","","666","675","10.2138/am.2009.3120","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:50",""
"9013628","9.4655","","9.4655","","6.9068","","90","","90","","120","","535.913","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Hydroxylapatite","- As0.33 Ca5 H O13 P2.67 -","- As0.6606 Ca10 O26 P5.3394 -","- As0.6606 Ca10 O26 P5.3394 -","","","","Lee, Y. J.; Stephens, P. W.; Tang, Y.; Li, W.; Phillips, B. L.; Parise, J. B.; Reeder, R. J.","Arsenate substitution in hydroxylapatite: Structural characterization of the Ca5(PxAs1-xO4)3OH solid solution Sample: As11","American Mineralogist","2009","94","","666","675","10.2138/am.2009.3120","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:36",""
"9013629","9.5075","","9.5075","","6.9187","","90","","90","","120","","541.611","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Hydroxylapatite","- As0.727 Ca5 H O13 P2.273 -","- As1.4538 Ca10 O26 P4.5462 -","- As1.4538 Ca10 O26 P4.5462 -","","","","Lee, Y. J.; Stephens, P. W.; Tang, Y.; Li, W.; Phillips, B. L.; Parise, J. B.; Reeder, R. J.","Arsenate substitution in hydroxylapatite: Structural characterization of the Ca5(PxAs1-xO4)3OH solid solution Sample: As24","American Mineralogist","2009","94","","666","675","10.2138/am.2009.3120","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:36",""
"9013630","9.564","","9.564","","6.936","","90","","90","","120","","549.438","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Hydroxylapatite","- As1.298 Ca5 H O13 P1.702 -","- As2.595 Ca10 O26 P3.405 -","- As2.595 Ca10 O26 P3.405 -","","","","Lee, Y. J.; Stephens, P. W.; Tang, Y.; Li, W.; Phillips, B. L.; Parise, J. B.; Reeder, R. J.","Arsenate substitution in hydroxylapatite: Structural characterization of the Ca5(PxAs1-xO4)3OH solid solution Sample: As43","American Mineralogist","2009","94","","666","675","10.2138/am.2009.3120","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:36",""
"9013631","9.6311","","9.6311","","6.9556","","90","","90","","120","","558.749","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Johnbaumite","- As1.972 Ca5 H O13 P1.028 -","- As3.9438 Ca10 O26 P2.0562 -","- As3.9438 Ca10 O26 P2.0562 -","","","","Lee, Y. J.; Stephens, P. W.; Tang, Y.; Li, W.; Phillips, B. L.; Parise, J. B.; Reeder, R. J.","Arsenate substitution in hydroxylapatite: Structural characterization of the Ca5(PxAs1-xO4)3OH solid solution Sample: As66","American Mineralogist","2009","94","","666","675","10.2138/am.2009.3120","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:36",""
"9013632","9.6758","","9.6758","","6.9732","","90","","90","","120","","565.375","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Johnbaumite","- As2.405 Ca5 H O13 P0.595 -","- As4.809 Ca10 O26 P1.191 -","- As4.809 Ca10 O26 P1.191 -","","","","Lee, Y. J.; Stephens, P. W.; Tang, Y.; Li, W.; Phillips, B. L.; Parise, J. B.; Reeder, R. J.","Arsenate substitution in hydroxylapatite: Structural characterization of the Ca5(PxAs1-xO4)3OH solid solution Sample: As80","American Mineralogist","2009","94","","666","675","10.2138/am.2009.3120","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:36",""
"9013633","9.7156","","9.7156","","6.9857","","90","","90","","120","","571.057","","","","","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Johnbaumite","- As3 Ca5 H O13 -","- As3 Ca5 H O13 -","- As6 Ca10 H2 O26 -","2","0.166667","","Lee, Y. J.; Stephens, P. W.; Tang, Y.; Li, W.; Phillips, B. L.; Parise, J. B.; Reeder, R. J.","Arsenate substitution in hydroxylapatite: Structural characterization of the Ca5(PxAs1-xO4)3OH solid solution Sample: As100","American Mineralogist","2009","94","","666","675","10.2138/am.2009.3120","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:50",""
"9013733","9.626","","9.626","","6.88","","90","","90","","120","","552.091","","","","","","","","","","","","La Fossa Crater, Vulcano Island, Aeolian Archipelago, Sicily Italy","7","P 63/m","-P 6c","176","","","Aiolosite","- Bi0.864 Br0.07 Cl0.74 H2 Na4.136 O12.19 S3 -","- Bi0.864 Br0.07 Cl0.74 H0.38 Na4.136 O12.19 S3 -","- Bi1.728 Br0.14 Cl1.48 H0.76 Na8.272 O24.38 S6 -","2","0.166667","","Demartin, F.; Gramaccioli, C. M.; Campostrini, I.; Pilati, T.","Aiolosite, Na2(Na2Bi)(SO4)3Cl, a new sulfate isotypic to apatite from La Fossa Crater, Vulcano, Aeolian Islands, Italy","American Mineralogist","2010","95","","382","385","10.2138/am.2010.3337","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07",""
"9013896","10.39","","10.39","","7.575","","90","","90","","120","","708.181","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","Sr-Morelandite","","Morelandite","- As3 Ba2.951 Cl O12 Sr2.047 -","- As6 Ba5.902 Cl2 O24 Sr4.094 -","- As6 Ba5.902 Cl2 O24 Sr4.094 -","","","","Dordevic, T.; Sutovic, S.; Stojanovic, J.; Karanovic, L.","Sr, Ba and Cd arsenates with the apatite-type structure","Acta Crystallographica, Section C","2008","64","","i82","i86","10.1107/S0108270108023457","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9014002","10.299","","10.299","","7.308","","90","","90","","120","","671.304","","","","","","","","","","","","Mibladen, Morocco","4","P 63/m","-P 6c","176","","","Vanadinite","- Cl O12 Pb5 V3 -","- Cl2 O24 Pb10 V6 -","- Cl2 O24 Pb10 V6 -","","","","Laufek, F.; Skala, R.; Haloda, J.; Cisarova, I.","Crystal structure of vanadinite: refinement of anisotropic displacement parameters Locality: Mibladen, Morocco","Journal of the Czech Geological Society","2006","51","","271","275","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:33:15",""
"9014298","6.0403","","6.0403","","3.5899","","90","","90","","120","","113.431","","","","","","","","","","","","ultra-alkaline rare-metal feldspar pegmatites from eastern Siberia","5","P 63/m","-P 6c","176","","","Gagarinite-(Eu)","- Ca0.498 Eu0.299 F3 Na0.558 Y0.198 -","- Ca0.996 Eu0.598 F6 Na1.116 Y0.396 -","- Ca0.996 Eu0.598 F6 Na1.116 Y0.396 -","","","","Frank-Kamenetskaya, O. V.; Fundamenskii, V. S.; Tsytsenko, A. K.; Frank-Kamenetskii, V. A.","Crystal structure of gagarinite from precision X-ray data: Structural changes in the NaCaTRF6-Na1.5TR1.5F6 series","Crystallography Reports","1994","39","","923","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014438","8.924","","8.924","","3.116","","90","","90","","120","","214.905","","","","","","","","","","","","the Titovsky deposit, Sakha-Yakutia Republic, Russia","4","P 63/m","-P 6c","176","","","Hydroxylborite","- B H3 Mg3 O6 -","- B2 H6 Mg6 O12 -","- B2 H6 Mg6 O12 -","","","","Rudnev, V. V.; Chukanov, N. V.; Nechelyustov, G. N.; Yamnova, N. A.","Hydroxylborite, Mg3(BO3)(OH)3, a new mineral species and isomorphous series fluoborite-hydroxylborite series","Geology of Ore Deposits","2007","49","","710","719","10.1134/S1075701507080053","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014460","9.6402","","9.6402","","7.0121","","90","","90","","120","","564.353","","","","","","","","","","","","Blue Bell claims, near Baker, San Bernardino County, California, USA","5","P 63/m","-P 6c","176","","","Fluorphosphohedyphane","- Ca2.354 F O12 P3 Pb2.646 -","- Ca4.708 F2 O24 P6 Pb5.292 -","- Ca4.708 F2 O24 P6 Pb5.292 -","","","","Kampf, A. R.; Housley, R. M.","Fluorphosphohedyphane, Ca2Pb3(PO4)3F, the first apatite supergroup mineral with essential Pb and F","American Mineralogist","2011","96","","423","429","10.2138/am.2011.3586","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014777","9.845","","9.845","","7.383","","90","","90","","120","","619.719","","","","","","","","","","","","Belovitovoye pegmatite, Kirovskii apatite mine at Mt. Kukisvumchorr,","5","P 63/m","-P 6c","176","","","Stronadelphite","- Ca0.2 F O12 P3 Sr4.8 -","- Ca0.4 F2 O24 P6 Sr9.6 -","- Ca0.4 F2 O24 P6 Sr9.6 -","","","","Pekov, I. V.; Britvin, S. N.; Zubkova, N. V.; Pushcharovsky, D. Y.; Pasero, M.; Merlino, S.","Stronadelphite, Sr5(PO4)3F, a new apatite-group mineral in the southern part of the Khibiny alkaline complex, Kola peninsula, Russia","European Journal of Mineralogy","2010","22","","869","874","10.1127/0935-1221/2010/0022-2063","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015242","11.1548","","11.1548","","10.5702","","90","","90","","120","","1139.04","","","","","","","","","","","","Bellerberg, near Kottenheim, Eastern Eifel area,","5","P 63/m","-P 6c","176","","","Kottenheimite","- Ca3 H30 O25.66 S1.82 Si -","- Ca3 H30 O25.66 S1.82 Si -","- Ca6 H60 O51.32 S3.64 Si2 -","2","0.166667","","Chukanov, N. V.; Britvin, S. N.; Van, K. V.; Mockel, S.; Zadov, A. E.","Kottenheimite, Ca3Si(OH)6(SO4)2*12H2O, a new member of the ettringite group from the Eifel area, Germany Rhineland-Palatinate, Germany","The Canadian Mineralogist","2012","50","","55","63","10.3749/canmin.50.1.55","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9015419","6.0861","","6.0861","","3.681","","90","","90","","120","","118.08","","","","","","","","","","","","Strange Lake deposit, Quebec-Labrador, Canada","10","P 63/m","-P 6c","176","","","Gagarinite-(Ce)","- Ca0.45 Ce0.275 Dy0.006 F3 Gd0.033 La0.143 Na0.45 Nd0.099 Sm0.011 Y0.044 -","- Ca0.9 Ce0.55 Dy0.012 F6 Gd0.066 La0.286 Na0.9 Nd0.198 Sm0.022 Y0.088 -","- Ca0.9 Ce0.55 Dy0.012 F6 Gd0.066 La0.286 Na0.9 Nd0.198 Sm0.022 Y0.088 -","","","","Sciberras, M. J.; Leverett, P.; Williams, P. A.; Hibbs, D. E.; Roberts, A. C.; Grice, J. D.","The single-crystal X-ray structure of gagarinite-(Ce)","The Canadian Mineralogist","2011","49","","1111","1114","10.3749/canmin.49.4.1111","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015431","9.06","","9.06","","3.06","","90","","90","","120","","217.525","","","","","","","","","","","","Tallgruvan, Sweden","5","P 63/m","-P 6c","176","","","Hydroxylborite","- B F0.87 H2.13 Mg3 O5.13 -","- B F0.87 H2.13 Mg3 O5.13 -","- B2 F1.74 H4.26 Mg6 O10.26 -","2","0.166667","","Takeuchi, Y.","The structure of fluoborite","Acta Crystallographica","1950","3","","208","210","10.1107/S0365110X50000501","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9015520","13.226","","13.226","","32.37","","90","","90","","120","","4903.77","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- Ca17 N34 O122.96 -","- Ca34 N68 O245.92 -","- Ca34 N68 O245.92 -","","","","Leclaire, A.","Structure cristalline d'un nouvel hydrate du nitrate de calcium Ca(NO3)2(H2O)1.235","Acta Crystallographica, Section B","1976","32","7","1950","1953","10.1107/S0567740876006845","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015690","9.3687","","9.3687","","6.8739","","90","","90","","120","","522.507","","","","","","","","","","","","Ipira, Bahia Province, Brazil","9","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.974 Cl0.06 F0.76 H0.18 Na0.026 O12.18 P2.844 S0.066 Si0.09 -","- Ca4.974 Cl0.06 F0.76 H0.18 Na0.026 O12.18 P2.844 S0.066 Si0.09 -","- Ca9.948 Cl0.12 F1.52 H0.36 Na0.052 O24.36 P5.688 S0.132 Si0.18 -","2","0.166667","","Baikie, T.; Schreyer, M. K.; Wong, C. L.; Pramana, S. S.; Klooster, W. T.; Ferraris, C.; McIntyre, G. J.; White, T. J.","A multi-domain gem-grade Brazilian apatite Note: single-crystal X-ray at T = 100 K","American Mineralogist","2012","97","","1574","1581","10.2138/am.2012.4069","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9016027","15.583","","15.583","","5.895","","90","","90","","120","","1239.7","","","","","","","","","","","","Setoda, Hiroshima, Japan","10","P 63/m","-P 6c","176","","","Zalesiite","- As3 Ca0.4 Ce0.06 Cu6 Fe0.09 H12.96 La0.04 Nd0.01 O21 Y0.31 -","- As3 Ca0.4 Ce0.06 Cu6 Fe0.09 H12.96 La0.04 Nd0.01 O21 Y0.31 -","- As6 Ca0.8 Ce0.12 Cu12 Fe0.18 H25.92 La0.08 Nd0.02 O42 Y0.62 -","2","0.166667","","Aruga, A.; Nakai, I.","Structure of Ca-rich agardite, (Ca0.40Y0.31Fe0.09Ce0.06La0.04Nd0.01)Cu6.19[(AsO4)2.42(HAsO4)0.49](OH)6.38*3H2O","Acta Crystallographica, Section C","1985","41","","161","163","10.1107/S0108270185003158","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9016317","9.3687","","9.3687","","6.8739","","90","","90","","120","","522.507","","","","","","","","","","","","Ipira, Bahia Province, Brazil","9","P 63/m","-P 6c","176","","","Fluorapatite","- Ca4.974 Cl0.06 F0.76 H0.18 Na0.026 O12.18 P2.844 S0.066 Si0.09 -","- Ca9.948 Cl0.12 F1.52 H0.36 Na0.052 O24.36 Pb5.688 Sb0.132 Si0.18 -","- Ca9.948 Cl0.12 F1.52 H0.36 Na0.052 O24.36 Pb5.688 Sb0.132 Si0.18 -","","","","Baikie, T.; Schreyer, M. K.; Wong, C. L.; Pramana, S. S.; Klooster, W. T.; Ferraris, C.; McIntyre, G. J.; White, T. J.","A multi-domain gem-grade Brazilian apatite Note: single-crystal neutron at T = 130 K","American Mineralogist","2012","97","","1574","1581","10.2138/am.2012.4069","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016543","9.4437","","9.4437","","6.8169","","90","","90","","120","","526.504","","","","","","","","","","","","Lagmannsvik, Hamaroy, Nordland, Norway","15","P 63/m","-P 6c","176","","","Fluorbritholite-(Y)","- Ca1.52 Ce0.35 Dy0.15 Er0.15 F Gd0.12 La0.06 Mn0.03 Nd0.33 O12 Pr0.06 Si3 Sm0.12 Y1.96 Yb0.18 -","- Ca1.52 Ce0.35 Dy0.15 Er0.15 F Gd0.12 La0.06 Mn0.03 Nd0.33 O12 Pr0.06 Si3 Sm0.12 Y1.96 Yb0.18 -","- Ca3.04 Ce0.7 Dy0.3 Er0.3 F2 Gd0.24 La0.12 Mn0.06 Nd0.66 O24 Pr0.12 Si6 Sm0.24 Y3.92 Yb0.36 -","2","0.166667","","Pekov, I. V.; Zubkova, N. V.; Chukanov, N. V.; Husdal, T. A.; Zadov, A. E.; Pushcharovsky, D. Y.","Fluorbritholite-(Y), (Y,Ca,Ln)5[(Si,P)O4]3F, a new mineral of the britholite group","Neues Jahrbuch fur Mineralogie, Abhandlungen","2011","188","","191","197","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9016559","16.387","","16.387","","8.279","","90","","90","","120","","1925.34","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Al2 Ca H15.68 O11.84 -","- Al2 Ca H15.68 O11.84 -","- Al12 Ca6 H94.08 O71.04 -","6","0.5","","Guirado, F.; Gali, S.; Chinchon, S.; Rius, J.","Crystal structure solution of hydrated high-alumina cement from X-ray powder diffraction data","Angewandte Chemie","1998","37","","72","75","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9016900","10.0017","","10.0017","","7.3413","","90","","90","","120","","635.991","","","","","","","","","","","","Puech de Compolibat, Combret, Aveyron","4","P 63/m","-P 6c","176","","","Pyromorphite","- Cl O12 P3 Pb5 -","- Cl2 O24 P6 Pb10 -","- Cl2 O24 P6 Pb10 -","","","","Mills, S. J.; Ferraris, G.; Kampf, A. R.; Favreau, G.","Twinning in pyromorphite: The first documented occurrence of twinning by merohedry in the apatite supergroup","American Mineralogist","2012","97","","415","418","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:45:19",""
"9016947","9.986","","9.986","","7.3378","","90","","90","","120","","633.694","","","","","","","","","","","","Daoping mine, Guangxi, China","5","P 63/m","-P 6c","176","","","Pyromorphite","- Ca0.01 Cl0.956 O12 P2.913 Pb4.695 -","- Ca0.02 Cl1.912 O24 P5.826 Pb9.39 -","- Ca0.02 Cl1.912 O24 P5.826 Pb9.39 -","","","","Okudera, H.","Relationships among channel typology and atomic displacements in the structures of Pb5(BO4)3Cl with B = P (pyromorphite), V (vanadinite), and As (mimetite)","American Mineralogist","2013","98","","1573","1579","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:52:49",""
"9016948","9.9791","","9.9791","","7.3439","","90","","90","","120","","633.345","","","","","","","","","","","","Daoping mine, Guangxi, China","5","P 63/m","-P 6c","176","","","Pyromorphite","- Ca0.01 Cl0.956 O12 P2.913 Pb4.695 -","- Ca0.02 Cl1.912 O24 P5.826 Pb9.39 -","- Ca0.02 Cl1.912 O24 P5.826 Pb9.39 -","","","","Okudera, H.","Relationships among channel typology and atomic displacements in the structures of Pb5(BO4)3Cl with B = P (pyromorphite), V (vanadinite), and As (mimetite)","American Mineralogist","2013","98","","1573","1579","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:52:49",""
"9016949","10.3231","","10.3231","","7.3399","","90","","90","","120","","677.394","","","","","","","","","","","","Mibladen, Morocco","5","P 63/m","-P 6c","176","","","Vanadinite","- Cl0.915 O12 P0.012 Pb4.51 V2.976 -","- Cl1.83 O24 P0.024 Pb9.02 V5.952 -","- Cl1.83 O24 P0.024 Pb9.02 V5.952 -","","","","Okudera, H.","Relationships among channel typology and atomic displacements in the structures of Pb5(BO4)3Cl with B = P (pyromorphite), V (vanadinite), and As (mimetite)","American Mineralogist","2013","98","","1573","1579","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:52:49",""
"9016950","10.3217","","10.3217","","7.3407","","90","","90","","120","","677.284","","","","","","","","","","","","Mibladen, Morocco","5","P 63/m","-P 6c","176","","","Vanadinite","- Cl0.915 O12 P0.012 Pb4.51 V2.976 -","- Cl1.83 O24 P0.024 Pb9.02 V5.952 -","- Cl1.83 O24 P0.024 Pb9.02 V5.952 -","","","","Okudera, H.","Relationships among channel typology and atomic displacements in the structures of Pb5(BO4)3Cl with B = P (pyromorphite), V (vanadinite), and As (mimetite)","American Mineralogist","2013","98","","1573","1579","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:52:49",""
"9016951","10.2382","","10.2382","","7.4502","","90","","90","","120","","676.31","","","","","","","","","","","","Pingtouling mine, Guangdong, China","5","P 63/m","-P 6c","176","","","Mimetite","- As2.775 Cl O12 P0.036 Pb5 -","- As5.55 Cl2 O24 P0.072 Pb9.99 -","- As5.55 Cl2 O24 P0.072 Pb9.99 -","","","","Okudera, H.","Relationships among channel typology and atomic displacements in the structures of Pb5(BO4)3Cl with B = P (pyromorphite), V (vanadinite), and As (mimetite)","American Mineralogist","2013","98","","1573","1579","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:52:49",""
"9016952","10.2396","","10.2396","","7.4405","","90","","90","","120","","675.614","","","","","","","","","","","","Pingtouling mine, Guangdong, China","5","P 63/m","-P 6c","176","","","Mimetite","- As2.775 Cl O12 P0.036 Pb5 -","- As5.55 Cl2 O24 P0.072 Pb9.99 -","- As5.55 Cl2 O24 P0.072 Pb9.99 -","","","","Okudera, H.","Relationships among channel typology and atomic displacements in the structures of Pb5(BO4)3Cl with B = P (pyromorphite), V (vanadinite), and As (mimetite)","American Mineralogist","2013","98","","1573","1579","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:52:49",""
"9016953","9.7199","","9.7221","","6.9651","","90.077","","90.051","","119.944","","570.327","","","","","","","","","","","","Harstigen mine, Varmland, Sweden","5","P 63/m","-P 6c","176","","","Johnbaumite","- As2.79 Ca5 H O13 P0.21 -","- As2.79 Ca5 H O13 P0.21 -","- As5.58 Ca10 H2 O26 P0.42 -","2","0.166667","","Biagioni, C.; Pasero, M.","The crystal structure of johnbaumite, Ca5(AsO4)3OH, the arsenate analogue of hydroxylapatite","American Mineralogist","2013","98","","1580","1584","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9017040","9.5104","","9.5104","","6.8311","","90","","90","","120","","535.08","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 Cl0.332 F0.773 O12 P3 -","- Ca5 Cl0.332 F0.773 O12 P3 -","- Ca10 Cl0.664 F1.546 O24 P6 -","2","0.166667","","Hughes, J. M.; Nekvasil, H.; Ustunisik, G.; Lindsley, D. H.; Coraor, A. E.; Vaughn, J.; Phillips, B. L.; McCubbin, F. M.; Woerner, W. R.","Solid solution in the fluorapatite-chlorapatite binary system: High-precision crystal structure refinements of synthetic F-Cl apatite. Note: Sample HNF5CL5","American Mineralogist","2014","99","","369","376","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9017041","9.5101","","9.5101","","6.83","","90","","90","","120","","534.96","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 Cl0.343 F0.766 O12 P3 -","- Ca5 Cl0.343 F0.766 O12 P3 -","- Ca10 Cl0.686 F1.532 O24 P6 -","2","0.166667","","Hughes, J. M.; Nekvasil, H.; Ustunisik, G.; Lindsley, D. H.; Coraor, A. E.; Vaughn, J.; Phillips, B. L.; McCubbin, F. M.; Woerner, W. R.","Solid solution in the fluorapatite-chlorapatite binary system: High-precision crystal structure refinements of synthetic F-Cl apatite. Note: Sample HNF5CL5-8","American Mineralogist","2014","99","","369","376","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9017042","9.51","","9.51","","6.8289","","90","","90","","120","","534.863","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 Cl0.336 F0.764 O12 P3 -","- Ca5 Cl0.336 F0.764 O12 P3 -","- Ca10 Cl0.672 F1.528 O24 P6 -","2","0.166667","","Hughes, J. M.; Nekvasil, H.; Ustunisik, G.; Lindsley, D. H.; Coraor, A. E.; Vaughn, J.; Phillips, B. L.; McCubbin, F. M.; Woerner, W. R.","Solid solution in the fluorapatite-chlorapatite binary system: High-precision crystal structure refinements of synthetic F-Cl apatite. Note: Sample HNF5CL5-9","American Mineralogist","2014","99","","369","376","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9017043","9.5084","","9.5084","","6.8293","","90","","90","","120","","534.714","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","Fluorapatite","- Ca5 Cl0.332 F0.763 O12 P3 -","- Ca5 Cl0.332 F0.763 O12 P3 -","- Ca10 Cl0.664 F1.526 O24 P6 -","2","0.166667","","Hughes, J. M.; Nekvasil, H.; Ustunisik, G.; Lindsley, D. H.; Coraor, A. E.; Vaughn, J.; Phillips, B. L.; McCubbin, F. M.; Woerner, W. R.","Solid solution in the fluorapatite-chlorapatite binary system: High-precision crystal structure refinements of synthetic F-Cl apatite. Note: HNF5CL5-10","American Mineralogist","2014","99","","369","376","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9017050","9.9244","","9.9244","","34.2357","","90","","90","","120","","2920.24","","","","","","","","","","","","Synthetic","3","P 63/m","-P 6c","176","","","","- O57 Pb21 Si18 -","- O114 Pb41.9999 Si36 -","- O114 Pb41.9999 Si36 -","","","","Siidra, O. I.; Zenko, D. S.; Krivovichev, S. V.","Structural complexity of lead silicates: Crystal structure of Pb21[Si7O22]2[Si4O13] and its comparison to hyttsjoite","American Mineralogist","2014","99","","817","823","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:17",""
"9017067","8.7225","","8.7225","","2.7664","","90","","90","","120","","182.275","","","","","","","","","","","","Synthetic","5","P 63/m","-P 6c","176","","","","- Al2.455 Mg0.79 Na0.33 O6 Si0.63 -","- Al4.91 Mg1.58 Na0.66 O12 Si1.26 -","- Al4.91 Mg1.58 Na0.66 O12 Si1.26 -","","","","Pamato, M. G.; Kurnosov, A.; Ballaran, T. B.; Trots, D. M.; Caracas, R.; Frost, D. J.","Hexagonal Na0.41[Na0.125Mg0.79Al0.085]2[Al0.79Si0.21]6O12 (NAL phase): Crystal structure refinement and elasticity","American Mineralogist","2014","99","","1562","1569","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:18",""
"9017100","9.504","","9.504","","6.347","","90","","90","","120","","496.492","","","","","","","","","","","","Cross Lake, Manitoba, Canada","7","P 63/m","-P 6c","176","","","Pieczkaite","- Ca1.39 Cl0.72 Fe0.26 H0.28 Mn3.41 O12.28 P3 -","- Ca1.39 Cl0.72 Fe0.26001 H0.28 Mn3.40999 O12.28 P3 -","- Ca2.78 Cl1.44 Fe0.52002 H0.56 Mn6.81998 O24.56 P6 -","2","0.166667","","Tait, K.; Ball, N. A.; Hawthorne, F. C.","Pieczkaite, ideally Mn5(PO4)3Cl, a new apatite-supergroup mineral from Cross Lake, Manitoba, Canada: Description and crystal structure","American Mineralogist","2015","100","","1047","1052","","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:46",""
"9017242","16.0916","","16.0916","","21.7127","","90","","90","","120","","4869.04","","","","","","","","","","","","White Caps gold deposit, Manhattan district, Nye County, Nevada, USA","5","P 63/m","-P 6c","176","","","Whitecapsite","- As9 Fe9.508 H120 O104 Sb3 -","- As9 Fe9.508 H120 O104 Sb3 -","- As18 Fe19.016 H240 O208 Sb6 -","2","0.166667","","Pekov, I. V.; Zubkova, N. V.; Gottlicher, J.; Yapaskurt, V. O.; Chukanov, N. V.; Lykova, I. S.; Belakovskiy, D. I.; Jensen, M. C.; Leising, J. F.; Nikischer, A. J.; Pushcharovsky, D. Y.","Whitecapsite, a new hydrous iron and trivalent antimony arsenate mineral from the White Caps mine, Nevada, USA Note: Not all H atoms could be located","European Journal of Mineralogy","2014","26","","577","587","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:53",""
"9017322","10.2055","","10.2055","","7.4483","","90","","90","","120","","671.825","","","","298","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 298 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017323","10.2224","","10.2224","","7.4494","","90","","90","","120","","674.152","","","","373","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 373 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017324","10.2323","","10.2323","","7.4533","","90","","90","","120","","675.812","","","","423","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 423 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017325","10.2415","","10.2415","","7.4594","","90","","90","","120","","677.582","","","","473","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 473 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017326","10.2055","","10.2055","","7.4483","","90","","90","","120","","671.825","","","","298","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 298 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017327","10.2055","","10.2055","","7.4483","","90","","90","","120","","671.825","","","","298","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 298 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017328","10.2224","","10.2224","","7.4494","","90","","90","","120","","674.152","","","","373","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 373 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017329","10.2224","","10.2224","","7.4494","","90","","90","","120","","674.152","","","","373","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 373 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017330","10.2323","","10.2323","","7.4533","","90","","90","","120","","675.812","","","","423","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 423 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017331","10.2323","","10.2323","","7.4533","","90","","90","","120","","675.812","","","","423","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 423 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017332","10.2415","","10.2415","","7.4594","","90","","90","","120","","677.582","","","","473","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 473 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017333","10.2415","","10.2415","","7.4594","","90","","90","","120","","677.582","","","","473","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl0.74 O12.13 Pb5 -","- As6 Cl1.48 O24.26 Pb10 -","- As6 Cl1.48 O24.26 Pb10 -","","","","Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.","Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 473 K","Acta Crystallographica, Section B","2008","64","","34","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:54",""
"9017350","13.5059","","13.5059","","5.8903","","90","","90","","120","","930.497","","","","","","","","","","","","Jote West mine, Pampa Larga Mining District, Copiapo, Chile","11","P 63/m","-P 6c","176","","","Agardite-(Y)","- As2.484 Ca0.43 Cu6 Dy0.01 Er0.02 H12.002 Ho0.01 O21.001 P0.516 Y0.52 Yb0.01 -","- As2.484 Ca0.43 Cu6 Dy0.01 Er0.02 H12.002 Ho0.01 O21.001 P0.516 Y0.52 Yb0.01 -","- As4.968 Ca0.86 Cu12 Dy0.02 Er0.04 H24.004 Ho0.02 O42.002 P1.032 Y1.04 Yb0.02 -","2","0.166667","","Morrison, S. M.; Domanik, K. J.; Origlieri, M. J.; Downs, R. T.","Agardite-(Y), Cu2+6Y(AsO4)3(OH)6*3H2O","Acta Crystallographica, Section E","2013","69","","i61","i62","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:53",""
"9017762","9.49","","9.49","","6.4777","","90","","90","","120","","505.224","","","","","","","","","","","","Szklary pegmatite, Lower Silesia, Poland","9","P 63/m","-P 6c","176","","","Parafiniukite","- Ca2.33 Cl0.48 F0.11 H0.41 Mg0.03 Mn2.63 Na0.01 O12.41 P3 -","- Ca2.33 Cl0.48 F0.11 H0.41 Mg0.03 Mn2.63 Na0.01 O12.41 P3 -","- Ca4.66 Cl0.96 F0.22 H0.82 Mg0.06 Mn5.26 Na0.02 O24.82 P6 -","2","0.166667","","Pieczka, A.; Biagioni, C.; Golebiowska, B.; Jelen, P.; Pasero, M.; Sitarz, M.","Parafiniukite, Ca2Mn3(PO4)3Cl, a new member of the apatite supergroup from the Szklary pegmatite, Lower Silesia, Poland: description and crystal structure","Minerals","2018","8","","","485","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:53",""
"9017820","10.4589","","10.4589","","7.8476","","90","","90","","120","","743.429","","","","","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","","- Ba5 H O13 V3 -","- Ba10 H2 O26 V6 -","- Ba10 H2 O26 V6 -","","","","Mugavero, S. J.; Bharathy, M.; McAlum, J.; Loye, H. C.","Crystal growth of alkaline earth vanadates from hydroxide fluxes","Solid State Sciences","2008","10","","370","376","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","08:29:25",""
"9017821","10.057","","10.057","","7.4349","","90","","90","","120","","651.242","","","","","","","","","","","","Synthetic","4","P 63/m","-P 6c","176","","","","- H O13 Sr5 V3 -","- H2 O26 Sr10 V6 -","- H2 O26 Sr10 V6 -","","","","Mugavero, S. J.; Bharathy, M.; McAlum, J.; Loye, H. C.","Crystal growth of alkaline earth vanadates from hydroxide fluxes","Solid State Sciences","2008","10","","370","376","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","08:29:25",""
"9017835","10.248","","10.248","","7.441","","90","","90","","120","","676.769","","","","","","","","","","","","Cassiterite-sulfide field, Festivalnyi, East Siberia, Russia","4","P 63/m","-P 6c","176","","","Mimetite","- As3 Cl O12 Pb5 -","- As6 Cl2 O24 Pb10 -","- As6 Cl2 O24 Pb10 -","","","","Sokolova, E. V.; Egorov-Tismenko Y K","Study of crystalline structures of rare arsentates: duftite and mimetite","Vestnik Moskovskogo Universiteta Geologiya","1982","37","","50","56","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","08:29:25",""
"9017873","13.2197","","13.2197","","5.8591","","90","","90","","120","","886.757","","","","","","","","","","","","Yavapai County, Arizona, USA","14","P 63/m","-P 6c","176","","","Petersite-(Ce)","- Ca0.42 Ce0.18 Cu6 Dy0.01 Gd0.03 H12 La0.12 Nd0.09 O21 P2.85 Pr0.02 Si0.15 Sm0.01 Y0.16 -","- Ca0.42 Ce0.18 Cu6 Dy0.01 Gd0.03 H12 La0.12 Nd0.09 O21 P2.85 Pr0.02 Si0.15 Sm0.01 Y0.16 -","- Ca0.84 Ce0.36 Cu12 Dy0.02 Gd0.06 H24 La0.24 Nd0.18 O42 P5.7 Pr0.04 Si0.3 Sm0.02 Y0.32 -","2","0.166667","","Morrison, S. M.; Domanik, K. J.; Yang, H.; Downs, R. T.","Petersite-(Ce), Cu2+6Ce(PO4)3(OH)6*3H2O, a new mixite group mineral from Yavapai County, Arizona, USA","The Canadian Mineralogist","2016","54","","1505","1511","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:53",""