# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-13T12:00:46+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'P b a 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
"1000109","11.5418","0.0007","11.3437","0.0007","3.6733","0.0002","90","","90","","90","","480.9","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Dipotassium aquaoxonium nonafluorodialuminate","","- Al2 F9 H5 K2 O2 -","- Al2 F9 H1.25 K2 O2 -","- Al4 F18 H2.5 K4 O4 -","2","0.25","","Le Bail, A; Duroy, H; Fourquet, J L","Crystal structure and thermolysis of K~2~(H~5~O~2~)Al~2~F~9~","Journal of Solid State Chemistry","1992","98","","151","158","10.1016/0022-4596(92)90081-6","","","","","","0.035","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000202","10.711","0.002","6.638","0.001","4.008","0.001","90","","90","","90","","285","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Mercury iron(III) fluoride dihydrate","","- F5 Fe H4 Hg O2 -","- F5 Fe H4 Hg O2 -","- F10 Fe2 H8 Hg2 O4 -","2","0.25","","Fourquet, J L; Courant, E; Chevalier, P; de Pape, R","Structure of Mercury(II) Iron(III) Fluoride Dihydrate, Hg Fe F~5~ (H~2~ O)~2~","Acta Crystallographica C (39,1983-)","1985","41","","165","167","","","","","","","0.0291","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000325","7.3591","0.0004","23.0897","0.001","5.7054","0.0002","90","","90","","90","","969.5","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Dipotassium catena-fluoroferrate(III)","","- F5 Fe K2 -","- F5 Fe K2 -","- F40 Fe8 K16 -","8","1","","Fourquet, J L; Duroy, H","K~2~FeF~5~: synthesis and crystal structure of a new form","Journal of Solid State Chemistry","1993","103","","353","358","10.1006/jssc.1993.1110","","","","","","0.026","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000388","11.248","0.002","16.51299","0.002","3.3329","0.0003","90","","90","","90","","619","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Tricalcium dithallate","","- Ca2.8 O6 Tl2.2 -","- Ca2.8 O6 Tl2.2 -","- Ca11.2 O24 Tl8.8 -","4","0.5","","Goutenoire, F; Caignaert, V; Hervieu, M; Michel, C; Raveau, B","The calcium thallate Ca3 Tl2 O6, third member of the series Can Tl2 On+3","Journal of Solid State Chemistry","1995","115","","508","513","10.1006/jssc.1995.1166","","","","","","0.048","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001109","6.9444","0.0009","12.7561","0.0019","4.2526","0.0005","90","","90","","90","","376.7","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Copper(I) Mercury Chloride selenide","","- Cl Cu Hg Se -","- Cl Cu Hg Se -","- Cl4 Cu4 Hg4 Se4 -","4","0.5","","Guillo, M; Mercey, B; Labbe, P H; Deschanvres, A","The Structure of Copper(I) Mercury(II) Chloride Selenide","Acta Crystallographica B (24,1968-38,1982)","1980","36","","2520","2523","10.1107/S056774088000934X","","","","","","0.071","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001286","9.844","0.005","17.752","0.007","4.095","0.002","90","","90","","90","","715.6","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","COPPER(I) MERCURY SULFIDE CHLORIDE","","- Cl Cu Hg S -","- Cl Cu Hg S -","- Cl8 Cu8 Hg8 S8 -","8","1","","Guillo, M; Mercey, B; Deschanvres, G","Systemes Cu X (X = Cl, Br) - Hg S. Etude des composes Cu Hg S X (X = Cl, Br)","Materials Research Bulletin","1979","14","","947","954","10.1016/0025-5408(79)90162-4","","","","","","0.09","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001287","10.045","0.006","18.32","0.001","4.128","0.002","90","","90","","90","","759.7","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","COPPER(I) MERCURY SULFIDE BROMIDE","","- Br Cu Hg S -","- Br Cu Hg S -","- Br8 Cu8 Hg8 S8 -","8","1","","Guillo, M; Mercey, B; Deschanvres, G","Systemes Cu X (X = Cl, Br) - Hg S. Etude des composes Cu Hg S X (X = Cl, Br)","Materials Research Bulletin","1979","14","","947","954","10.1016/0025-5408(79)90162-4","","","","","","0.08","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001352","5.523","0.001","10.761","0.005","3.811","0.001","90","","90","","90","","226.5","","","","","","","","","","SrCO3 and Mn3O4 were first mixed and heated at 1100\%C in air, and then heated at 1450\%C in air. The resulting product was heated in an evacuated silica ampoule at 500\%C in the presence of zirconium.","","","3","P b a m","-P 2 2ab","55","","Distrontium dimanganese pentaoxide","","- Mn2 O5 Sr2 -","- Mn2 O5 Sr2 -","- Mn4 O10 Sr4 -","2","0.25","","Caignaert, V.; Nguyen, N.; Hervieu, M.; Raveau, B.","Sr~2~Mn~2~O~5~, an oxygen-defect perovskite with Mn(III) in square pyramidal coordination","Materials Research Bulletin","1985","20","","479","484","10.1016/0025-5408(85)90101-1","","","","","","0.031","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001447","8.4992","0.0007","15.339","0.0008","10.5913","0.0009","90","","90","","90","","1380.8","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Tetrasodium niobium phosphate (4/8/6)","","- Na4 Nb8 O35 P6 -","- Na4 Nb8 O35 P6 -","- Na8 Nb16 O70 P12 -","2","0.25","","Benabbas, A; Borel, M M; Grandin, A; Leclaire, A; Raveau, B","A niobium phosphate bronze closely related to the tungsten phosphate bronzes family: Na~4~Nb~8~P~6~O~35~","Journal of Solid State Chemistry","1990","89","","75","82","10.1016/0022-4596(90)90295-9","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001663","5.596","0.001","10.29","0.02","3.806","0.001","90","","90","","90","","219.2","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Neodymium copper oxide (1/1/2.5)","","- Cu Nd O2.5 -","- Cu Nd O2.5 -","- Cu4 Nd4 O10 -","4","0.5","","Chen, B - H; Walker, D; Suard, E; Scott, B A; Mercey, B; Hervieu, M; Raveau, B","High pressure synthesis of Nd Cu O3-d perovskites (0<d<0.5)","Inorganic Chemistry","1995","34","","2077","2083","10.1021/ic00112a020","","","","","","0.093","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004084","9.115","0.004","7.941","0.004","6.306","0.004","90","","90","","90","","456.4","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Dilead platinum oxide","","- O4 Pb2 Pt -","- O4 Pb2 Pt -","- O16 Pb8 Pt4 -","4","0.5","","Bettahar, N; Conflant, P; Abraham, F; Thomas, D","Pb~2~ Pt O~4~. A new platinum-lead oxide with edge-shared Pt O~6~ octahedral chains","Journal of Solid State Chemistry","1987","67","","85","90","10.1016/0022-4596(87)90342-2","","","","","","0.049","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1005046","10.536","0.003","18.27499","0.005","4.799","0.001","90","","90","","90","","924","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Tetratantalum silicon tetratelluride","","- Si Ta4 Te4 -","- Si Ta4 Te4 -","- Si4 Ta16 Te16 -","4","0.5","","Badding, M E; Disalvo, F J","Synthesis and structure of Ta4 Si Te4, a new low-dimensional material","Inorganic Chemistry","1990","29","","3952","3954","10.1021/ic00345a009","","","","","","0.061","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007029","9.256","0.002","8.614","0.002","6.152","0.002","90","","90","","90","","490.5","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Silver dimercury(I) phosphate","","- Ag Hg2 O4 P -","- Ag Hg2 O4 P -","- Ag4 Hg8 O16 P4 -","4","0.5","","Masse, R; Guitel, J C; Durif, A","Structure cristalline du monophosphate Ag Hg~2~ P O~4~. Donnees cristallographiques sur Ag Hg~2~ As O~4~","Journal of Solid State Chemistry","1978","23","","369","373","10.1016/0022-4596(78)90086-5","","","","","","0.046","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008810","14.537","0.002","10.219","0.002","5.95","0.001","90","","90","","90","","883.9","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Cobalt magnesium germanium oxide (7.25/6.75/5/24)","","- Co7.25 Ge5 Mg6.75 O24 -","- Co7.254 Ge5 Mg6.746 O24 -","- Co14.508 Ge10 Mg13.492 O48 -","2","0.25","","Levy, D; Barbier, J","A new structural family: M10n-2 Ge3n+1 O16n with M = (Co, Mg) and (Ni, Mg)","Journal of Solid State Chemistry","1997","130","","9","19","10.1006/jssc.1997.7252","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008811","14.446","0.003","10.174","0.002","5.917","0.001","90","","90","","90","","869.6","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Trinickel undecamagnesium pentagermanium oxide","","- Ge5 Mg11 Ni3 O24 -","- Ge5 Mg10.996 Ni3.004 O24 -","- Ge10 Mg21.992 Ni6.008 O48 -","2","0.25","","Levy, D; Barbier, J","A new structural family: M10n-2 Ge3n+1 O16n with M = (Co, Mg) and (Ni, Mg)","Journal of Solid State Chemistry","1997","130","","9","19","10.1006/jssc.1997.7252","","","","","","0.103","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008835","9.2","","12.2","","2.99","","90","","90","","90","","335.6","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Dinickel diboron aluminium oxide","","- Al2 B2 Ni4 O10 -","- Al1.9998 B2 Ni4.0002 O10 -","- Al3.9996 B4 Ni8.0004 O20 -","2","0.25","","Schwab, A M; Bertaut, E F","Structure du boroaluminate B2 O3 Al2 O3 (Ni O)4","Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)","1970","93","","255","257","","","","","","","0.17","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011331","8.27","","11.63","","8.89","","90","","90","","90","","855","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Dipotassium tetrachloromercurate hydrate","","- Cl4 H2 Hg K2 O -","- Cl4 H2 Hg K2 O -","- Cl16 H8 Hg4 K8 O4 -","4","0.5","","MacGillavry, C H; de Wilde, J H; Bijvoet, J M","The crystal structure of K2 Hg Cl4 * H2 O","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1938","100","","212","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","186542","2020-10-21","18:00:00",""
"1101101","17.397","0.0005","8.81986","0.00023","4.90794","0.00012","90","","90","","90","","753.07","0.05","","","","","","","","","","","","3","P b a m","","","","","","- O5 P V -","- O10 P2 V2 -","- O40 P8 V8 -","4","0.5","","Richard Harlow; Zhigang Li; Normal Herron; Harold Horowitz; Eugene McCarron; James Richardson; Brian Toby","The Crystal Structure of the Gamma Phase of Vanadyl Phosphate, gamma-VOPO4, Solved and Refined Using Both Synchrotron and Neutron Powder Diffraction Data","unpublished","","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1507652","14.1588","0.0004","7.1036","0.0002","13.577","0.0004","90","","90","","90","","1365.55","0.07","100","2","100","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- C5 H9 N3 O2 -","- C5 H9 N3 O2 -","- C40 H72 N24 O16 -","8","1","","Kang, Sung Ok; Vukovic, Sinisa; Custelcean, Radu; Hay, Benjamin P.","Cyclic Imide Dioximes: Formation and Hydrolytic Stability","Industrial & Engineering Chemistry Research","2012","51","19","6619","","10.1021/ie300492z","","","1.54178","CuKα","","0.0426","0.0402","","","0.1122","0.1135","","","","","","1.163","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509656","20.523","","25.118","","4.0241","","90","","90","","90","","2074.41","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","La4 Ag2 In4 S13","","- Ag2 In4 La4 S13 -","- Ag2 In4 La4 S13 -","- Ag8 In16 La16 S52 -","4","0.5","","Gulay, L.D.; Huch, M.R.; Daszkiewicz, M.","Crystal structures of the Ln(4-x) In(5-y) S13 (Ln = La, Ce, Pr and Nd; x = 0.08-0.12, y = 0.21-0.24), La3 In1.67 S7, Gd3 In S6 and La4 Ag2 In4 S13 compounds","Journal of Solid State Chemistry","2008","181","","2626","2632","10.1016/j.jssc.2008.06.037","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510111","4.56","","8.92","","2.83","","90","","90","","90","","115.111","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Au (Cu0.9 Ga0.1)","","- Au Cu0.9 Ga0.1 -","- Au Cu0.9 Ga0.1 -","- Au4 Cu3.6 Ga0.4 -","4","0.5","","Courtois, A.; Hertz, J.; Protas, J.; Dirand, M.","Structure cristalline de la phase Au Cu III in copper-gold alloys","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-)","1975","280","","559","561","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510185","14.027","","7.204","","5.511","","90","","90","","90","","556.889","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","K5 I2 (Au O2)","","- Au I2 K5 O2 -","- Au I2 K5 O2 -","- Au2 I4 K10 O4 -","2","0.25","","Schneider, J.; Hoppe, R.","Eine ""misslungene"" Synthese: ueber K2 Li (I O6) und K5 I2 (Au O2)","Journal of the Less-Common Metals","1988","137","","85","103","10.1016/0022-5088(88)90078-1","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510385","4.648","","8.998","","2.892","","90","","90","","90","","120.951","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Au2 Cu Zn -","- Au2 Cu Zn -","- Au4 Cu2 Zn2 -","2","0.25","","Wilkens, M.; Wegst, J.; Gunzel, E.; Burkhardt, W.; Meissner, H.G.; Schutt, W.; Schubert, K.; Esslinger, P.","Einige strukturelle Ergebnisse an metallischen Phasen","Naturwissenschaften","1956","43","","248","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510508","7.364","","14.308","","5.679","","90","","90","","90","","598.363","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Rb5 Au3 O2","","- Au3 O2 Rb5 -","- Au3 O2 Rb5 -","- Au6 O4 Rb10 -","2","0.25","","Jansen, M.; Wedig, U.; Nuss, J.; Mudring, A.V.","Mixed valent gold oxides: syntheses, structures, and properties of Rb5 Au3 O2, Rb7 Au5 O2, and Cs7 Au5 O2","Journal of Solid State Chemistry","2000","155","","29","36","10.1006/jssc.2000.8881","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510985","14.8965","","10.048","","5.2486","","90","","90","","90","","785.611","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Er2 Cl2 (B2 O5)","","- B2 Cl2 Er2 O5 -","- B2 Cl2 Er2 O5 -","- B8 Cl8 Er8 O20 -","4","0.5","","Nikelski, T.; Schleid, T.","La Cl (B O2)2 und Er2 Cl2 (B2 O5): zwei Chlorid-Oxoborate dreiwertiger Lanthanide","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","2028","2033","10.1002/zaac.200300184","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511052","11.741","","12.187","","3.5988","","90","","90","","90","","514.944","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sc4 Cl6 B","","- B Cl6 Sc4 -","- B Cl6 Sc4 -","- B2 Cl12 Sc8 -","2","0.25","","Corbett, J.D.; Hwu, S.-J.","Metal-metal bonded scandium cluster (Sc7 Cl12 Z) and infinite chain (Sc4 Cl6 Z) phases stabilized by interstitial boron or nitrogen (Z)","Journal of Solid State Chemistry","1986","64","","331","346","10.1016/0022-4596(86)90077-0","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511068","9.2963","","11.948","","2.9737","","90","","90","","90","","330.295","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Co3 (B O3) O2","","- B Co3 O5 -","- B Co3 O5 -","- B4 Co12 O20 -","4","0.5","","Huang, Z.-X.; Zhang, H.; Cheng, W.-D.","Synthesis and crystal structure of borate oxide Co3 B O5","Jiegon Huaxue","2001","20","","97","99","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511076","9.209","","12.121","","2.9877","","90","","90","","90","","333.494","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Ni2 Cr O2 (B O3)","","- B Cr Ni2 O5 -","- B Cr0.995 Ni2.005 O5 -","- B4 Cr3.98 Ni8.02 O20 -","4","0.5","","Nielsen, K.; Norrestam, R.; Kritikos, M.; Sotofte, I.; Thorup, N.","Structural characterization of two synthetic Ni-ludwigites, and some semiempirical EHTB calculations on the ludwigite structure type","Journal of Solid State Chemistry","1994","111","","217","223","10.1006/jssc.1994.1220","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511155","9.37","","12.357","","3.055","","90","","90","","90","","353.723","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","(Fe0.625 Mg0.375)2 Fe (B O3) O2","","- B Fe2.25 Mg0.75 O5 -","- B Fe2.25 Mg0.75 O5 -","- B4 Fe9 Mg3 O20 -","4","0.5","","Takeuchi, Y.","The crystal structure of vonsenite","Mineralogical Journal (Japan)","1956","2","","19","26","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511158","9.5","","12.4","","3.1","","90","","90","","90","","365.18","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Fe3 (B O3) O2","","- B Fe3 O5 -","- B Fe3 O5 -","- B4 Fe12 O20 -","4","0.5","","Federico, M.","Sulla Breislakite","Periodico di Mineralogia","1957","26","","191","214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511215","9.195","","12.209","","2.9922","","90","","90","","90","","335.91","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","(Li0.31 V0.69)3 B O5","","- B Li0.93 O5 V2.07 -","- B Li0.93 O5 V2.07 -","- B4 Li3.72 O20 V8.28 -","4","0.5","","Onoda, M.","Crystal structure and electronic state of the disordered S=1 system (Li(x) V(1-x)3) B O5 with x = 0.3","Journal of Solid State Chemistry","1998","141","","418","423","10.1006/jssc.1998.7965","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511331","11.016","","16.75499","","3.564","","90","","90","","90","","657.818","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Ta4 B Te4 (Te2)2","","- B Ta4 Te8 -","- B Ta4 Te8 -","- B2 Ta8 Te16 -","2","0.25","","Kleinke, H.; Finckh, E.W.; Tremel, W.","Ta4 B Te8: Tantalum telluride cluster chains with encapsulated boron atoms","Angew. Chem. Int. ed.","1999","38","","2054","2057","10.1002/(SICI)1521-3773(19990712)38:13/14<2054::AID-ANIE2054>3.0.CO;2-Y","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511352","5.6539","","11.2569","","4.2013","","90","","90","","90","","267.393","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Ce2 Ni B10","","- B10 Ce2 Ni -","- B10 Ce2 Ni -","- B20 Ce4 Ni2 -","2","0.25","","Jeitschko, W.; Konrad, T.; Hartjes, K.; Lang, A.; Hoffmann, R.D.","Polyborides with Th2 Ni B10 - type structure: synthesis, crystal structure, and magnetic and electrical properties","Journal of Solid State Chemistry","2000","154","","246","253","10.1006/jssc.2000.8844","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511376","5.6251","","11.207","","4.182","","90","","90","","90","","263.635","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Nd2 Ni B10","","- B10 Nd2 Ni -","- B10 Nd2 Ni -","- B20 Nd4 Ni2 -","2","0.25","","Hoffmann, R.D.; Hartjes, K.; Konrad, T.; Lang, A.; Jeitschko, W.","Polyborides with Th2 Ni B10 - type structure: synthesis, crystal structure, and magnetic and electrical properties","Journal of Solid State Chemistry","2000","154","","246","253","10.1006/jssc.2000.8844","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511381","21.901","","9.967","","2.9465","","90","","90","","90","","643.183","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Mg5 Ru13 B11","","- B11 Mg5 Ru13 -","- B11 Mg5 Ru13 -","- B22 Mg10 Ru26 -","2","0.25","","Jung, W.; Schweitzer, K.","Mg2 Ru5 B4 und Mg5 Ru13 B11, zwei ternaere Magnesium-Ruthenium-boride mit Kanalstrukturen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1985","530","","127","134","10.1002/zaac.19855301115","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511480","10","","8.376","","2.9542","","90","","90","","90","","247.444","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Mg2 Ru5 B4","","- B4 Mg2 Ru5 -","- B4 Mg2 Ru5 -","- B8 Mg4 Ru10 -","2","0.25","","Schweitzer, K.; Jung, W.","Mg2 Ru5 B4 und Mg5 Ru13 B11, zwei ternaere Magnesium-Ruthenium-boride mit Kanalstrukturen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1985","530","","127","134","10.1002/zaac.19855301115","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511483","5.981","","11.569","","3.474","","90","","90","","90","","240.381","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sm Mn B4","","- B4 Mn Sm -","- B4 Mn Sm -","- B16 Mn4 Sm4 -","4","0.5","","Mikhalenko, S.I.; Kuz'ma, Yu.B.","Sm-Mn-B system","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1991","27","","2109","2112","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511488","6.016","","11.65","","3.598","","90","","90","","90","","252.171","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Y Mo B4","","- B4 Mo Y -","- B4 Mo Y -","- B16 Mo4 Y4 -","4","0.5","","Kuz'ma, Yu.B.; Sobolev, A.S.; Svarichevskaya, S.I.","The system yttrium - molybdenum - boron and yttrium tungsten - boron","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1973","9","","1697","1702","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511495","5.7853","","11.208","","3.2737","","90","","90","","90","","212.272","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sc Ni B4","","- B4 Ni Sc -","- B4 Ni Sc -","- B16 Ni4 Sc4 -","4","0.5","","Mikhalenko, S.I.; Zavalii, L.V.; Kuz'ma, Yu.B.","New scandium borides with the yttrium chromium boride (Y Cr B4) type structure","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1988","24","","1814","1816","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511524","16.674","","17.667","","9.511","","90","","90","","90","","2801.75","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Y B41.818 Si1.145","","- B41.818 Si1.145 Y -","- B41.8185 Si1.1455 Y -","- B334.548 Si9.164 Y8 -","8","1","","Takami, M.; Ishizawa, Y.; Kobayashi, K.; Tanaka, T.; Higashi, I.","Crystal structure of Y B41 Si1.2","Journal of Solid State Chemistry","1997","133","","11","15","10.1006/jssc.1997.7307","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511577","8.99","","11.312","","3.494","","90","","90","","90","","355.322","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Co Lu2 B6","","- B6 Co Lu2 -","- B6 Co Lu2 -","- B24 Co4 Lu8 -","4","0.5","","Kuz'ma, Yu.B.; Shostak, Y.M.; Dub, O.M.","The ternary Lu-Co-B system","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1988","24","","1270","1274","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511593","8.7909","","11.0541","","3.2996","","90","","90","","90","","320.64","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sc2 Cr B6","","- B6 Cr Sc2 -","- B6 Cr Sc2 -","- B24 Cr4 Sc8 -","4","0.5","","Mykhalenko, S.; Kuz'ma, Yu.B.; Babizhet'sky, V.S.","New compound in the system Sc - Cr - B","Journal of Solid State Chemistry","2004","177","","439","443","10.1016/j.jssc.2003.02.004","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511604","8.969","","11.34","","3.49","","90","","90","","90","","354.963","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Lu2 Fe B6","","- B6 Fe Lu2 -","- B6 Fe Lu2 -","- B24 Fe4 Lu8 -","4","0.5","","David, M.I.; Dub, O.M.; Kuz'ma, Yu.B.","Tb-Fe-B and Lu-Fe-B ternary systems","Poroshkovaya Metallurgiya","1987","26","","563","566","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511619","8.947","","11.273","","3.381","","90","","90","","90","","341.006","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","(Lu1.34 V1.66) B6","","- B6 Lu1.34 V1.66 -","- B6 Lu1.34 V1.66 -","- B24 Lu5.36 V6.64 -","4","0.5","","Chaban, N.F.; Davidov, V.M.; Kuz'ma, Yu.B.; Mikhalenko, S.I.","Phase equilibria in the Lu - V - B system and the structure of the new boride Lu1.34 V1.66 B6","Powder Metallurgy and Metal Ceramics","2002","41","","162","168","10.1023/A:1019887027364","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511626","6.013","","11.619","","3.626","","90","","90","","90","","253.331","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Ce Re B4","","- B4 Ce Re -","- B4 Ce Re -","- B16 Ce4 Re4 -","4","0.5","","Mikhalenko, S.I.; Chaban, N.F.; Kuz'ma, Yu.B.","New compounds with the Y Cr B4 structure","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1996","32","","44","48","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511641","9.175","","11.55","","3.673","","90","","90","","90","","389.232","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Y2 Re B6","","- B6 Re Y2 -","- B6 Re Y2 -","- B24 Re4 Y8 -","4","0.5","","Kuz'ma, Yu.B.; Svarichevskaya, S.I.","Crystal structure of Y2 Re B6 and its analogs","Kristallografiya","1972","17","","658","661","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511661","4.842","","11.3","","3.361","","90","","90","","90","","183.896","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Co Yb B4","","- B4 Co Yb -","- B4 Co Yb -","- B16 Co4 Yb4 -","4","0.5","","Kuz'ma, Yu.B.; Dub, O.M.; Chaban, N.F.","New compounds with Y Cr B4-type structure","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1985","21","","1718","1720","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511699","11.609","","11.342","","2.836","","90","","90","","90","","373.414","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","Ru11 B8","","- B8 Ru11 -","- B8 Ru11 -","- B16 Ru22 -","2","0.25","","Aselius, J.","The crystal structure of Ru11 B8","Acta Chemica Scandinavica (1-27,1973-42,1988)","1960","14","","2169","2176","10.3891/acta.chem.scand.14-2169","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511722","6.057","","11.712","","3.64","","90","","90","","90","","258.22","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Th Cr B4","","- B4 Cr Th -","- B4 Cr Th -","- B16 Cr4 Th4 -","4","0.5","","Evers, C.B.H.; Konrad, T.; Jeitschko, W.; Danebrock, M.E.","Preparation, properties and crystal structures of the thorium chromium borides Th Cr B4 and Th Cr2 B6; structure refinements of Ce Cr2 B6, Th B4 and Th B6","Journal of Alloys Compd.","1996","234","","56","61","10.1016/0925-8388(95)01993-6","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511723","5.972","","11.46","","3.461","","90","","90","","90","","236.868","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Y Cr B4","","- B4 Cr Y -","- B4 Cr Y -","- B16 Cr4 Y4 -","4","0.5","","Kuz'ma, Yu.B.","Crystal structure of the compound Y Cr B4 and its anlalogs","Kristallografiya","1970","15","","372","374","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511743","5.944","","11.51","","3.464","","90","","90","","90","","236.991","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Gd Mn B4","","- B4 Gd Mn -","- B4 Gd Mn -","- B16 Gd4 Mn4 -","4","0.5","","Kuz'ma, Yu.B.","New ternary compounds with the structure of Y Cr B4 type","Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Tekhnichni ta Matematichni Nauki","1970","1970","","756","758","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1512485","5.5307","0.0004","10.7829","0.0008","3.8145","0.0003","90","","90","","90","","227.49","","","","425","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Mn2 O5 Sr2 -","- Mn2 O5 Sr2 -","- Mn4 O10 Sr4 -","2","0.25","","Takanori Mori; Kazuko Inoue; Naoki Kamegashira; Yasuo Yamaguchi; Kenji Ohoyama","Neutron diffraction study of Sr2Mn2O5","Journal of Alloys and Compounds","2000","296","1--2","92","97","10.1016/S0925-8388(99)00521-6","powder diffraction","neutron","1.8196","","","","","","","","","","","","","","","","","","has coordinates","203889","2020-10-21","18:00:00",""
"1520771","7.7134","","8.1139","","5.6914","","90","","90","","90","","356.201","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Bi2 Al4 O9","","- Al4 Bi2 O9 -","- Al4 Bi2 O9 -","- Al8 Bi4 O18 -","2","0.25","","Abrahams, I.; Hawkes, G. E.; Bush, A. J.; Nunes, T.","Structure and Oxide Ion Conductivity Mechanism in Bi~2~Al~4~O~9~ by Combined X-Ray and High-Resolution Neutron pPwder Diffraction and ^27^Al Solid State NMR","Journal of Solid State Chemistry","1999","147","2","631","636","10.1006/jssc.1999.8427","","","","","","","","","","","","","","","","","","","","","has coordinates","171593","2020-10-21","18:00:00",""
"1520786","9.254","","12.287","","3.004","","90","","90","","90","","341.567","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","(Mg1.93 Fe0.967 Al0.093) O2 (B O3)","","- Al0.093 B Fe0.967 Mg1.93 O5 -","- Al0.093 B Fe0.967 Mg1.93 O5 -","- Al0.372 B4 Fe3.868 Mg7.72 O20 -","4","0.5","","Appel, P.W.U.; Brigatti, M.F.","Ludwigite from central Sweden: new data and crystal structure refinement","Mineralogical Magazine (1969-)","1999","63","","511","518","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520942","12.4007","","12.4007","","3.903","","90","","90","","90","","600.193","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Ba4 Nd2 Ti4 Ta6 O30","","- Ba4 Nd2 O30 Ta6 Ti4 -","- Ba4.002 Nd1.998 O30 Ta6 Ti4 -","- Ba4.002 Nd1.998 O30 Ta6 Ti4 -","1","0.125","","Chen, X.M.; Lu, G.L.; Yang, J.S.; Wu, Y.J.","Some tungsten-bronze compounds in the Ba O - Nd2 O3 - Ti O2 Ta2 O5 system","Journal of Solid State Chemistry","1999","148","","438","441","","","","","","","","","","","","","","","","","","","","","","has coordinates","140527","2020-10-21","18:00:00",""
"1520943","12.4826","","12.4826","","3.9295","","90","","90","","90","","612.276","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Ba5 Nd Ti3 Ta7 O30","","- Ba5 Nd O30 Ta7 Ti3 -","- Ba4.998 Nd1.002 O30 Ta7 Ti3 -","- Ba4.998 Nd1.002 O30 Ta7 Ti3 -","1","0.125","","Chen, X.M.; Wu, Y.J.; Lu, G.L.; Yang, J.S.","Some tungsten-bronze compounds in the Ba O - Nd2 O3 - Ti O2 Ta2 O5 system","Journal of Solid State Chemistry","1999","148","","438","441","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520971","11.488","","17.66119","","4.2201","","90","","90","","90","","856.223","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","K2 (Gd2 Sb2 Se9)","","- Gd2 K2 Sb2 Se9 -","- Gd2 K2 Sb2 Se9 -","- Gd4 K4 Sb4 Se18 -","2","0.25","","Choi, K.-S.; Hanko, J.A.; Kanatzidis, M.G.","Eightfold superstructure in K2 Gd2 Sb2 Se9 and K2 La2 Sb2 S9 caused by three-dimensional ordering of the 5s2 lone pair of Sb(3+) ions","Journal of Solid State Chemistry","1999","147","","309","319","","","","","","","","","","","","","","","","","","","","","","has coordinates","140581","2020-10-21","18:00:00",""
"1520972","11.208","","16.8781","","4.2419","","90","","90","","90","","802.439","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","K2 (La2 Sb2 S9)","","- K2 La2 S9 Sb2 -","- K2 La2 S9 Sb2 -","- K4 La4 S18 Sb4 -","2","0.25","","Choi, K.-S.; Hanko, J.A.; Kanatzidis, M.G.","Eightfold superstructure in K2 Gd2 Sb2 Se9 and K2 La2 Sb2 S9 caused by three-dimensional ordering of the 5s2 lone pair of Sb(3+) ions","Journal of Solid State Chemistry","1999","147","","309","319","","","","","","","","","","","","","","","","","","","","","","has coordinates","140582","2020-10-21","18:00:00",""
"1521025","6.12382","","10.28083","","3.58963","","90","","90","","90","","225.996","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sr2 Pr O4","","- O4 Pr Sr2 -","- O4 Pr Sr2 -","- O8 Pr2 Sr4 -","2","0.25","","Fiscus, J.E.; zur Loye, H.C.","Synthesis of Sr2 Pr O4: a Pr(4+)-containing oxide in the Sr2 Pb O4 structure type","Journal of Alloys Compd.","2000","306","","141","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521291","5.8404","","11.7057","","8.1751","","90","","90","","90","","558.899","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Pb (Hf O3)","","- Hf O3 Pb -","- Hf O3 Pb -","- Hf8 O24 Pb8 -","8","1","","Madigou, V.; Nihoul, G.; Bouree, F.; Baudour, J.L.; Favotto, C.; Roubin, M.","Crystallographic structure of lead hafnate (Pb Hf O3) from neutron powder diffraction and electron microscopy","Philosophical Magazine, Part A","1999","79","","847","858","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521498","5.865","","11.723","","3.856","","90","","90","","90","","265.121","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","(Ni (N H3)2) Br2","","- Br2 H6 N2 Ni -","- Br2 H6 N2 Ni -","- Br4 H12 N4 Ni2 -","2","0.25","","Leineweber, A.; Jacobs, H.","Preparation and crystal structures of Ni (N H3)2 Cl2 and of two modifications of Ni (N H3)2 Br2 and Ni (N H3)2 I2","Journal of Solid State Chemistry","2000","152","","381","387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521544","12.756","","12.803","","10.602","","90","","90","","90","","1731.47","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Na3 Fe2 (P O4)2 F3","","- F3 Fe2 Na3 O8 P2 -","- F3 Fe2 Na3 O8 P2 -","- F24 Fe16 Na24 O64 P16 -","8","1","","le Meins, J.M.; Crosnier-Lopez, M.P.; Hemon-Ribaud, A.; Courbion, G.","Phase transitions in the Na3 M2 (P O4)2 F3 family (M = Al(3+), V(3+), Cr(3+), Fe(3+), Ga(3+)) : synthesis, thermal, structural and magnetic studies","Journal of Solid State Chemistry","1999","148","","260","277","","","","","","","","","","","","","","","","","","","","","","has coordinates","141756","2020-10-21","18:00:00",""
"1522049","5.546","","9.888","","3.193","","90","","90","","90","","175.1","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Cd2 Sn O4","","- Cd2 O4 Sn -","- Cd2 O4 Sn -","- Cd4 O8 Sn2 -","2","0.25","","Troemel, M.","Die Kristallstruktur der Verbindungen vom Sr2 Pb O4-Typ","Zeitschrift fuer Anorganische und Allgemeine Chemie","1969","371","","237","247","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522866","5.42","","10.51","","4.03","","90","","90","","90","","229.566","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- Ga3 Pd5 -","- Ga3 Pd5 -","- Ga6 Pd10 -","2","0.25","","Schubert, K.; Lukas, H.L.; Bhan, S.; Meissner, H.G.","Zum Aufbau der Systeme Co-Ga, Pd-Ga, Pd-Sn und verwandter Legierungen","Zeitschrift fuer Metallkunde","1959","50","","534","540","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523255","24.452","","5.2","","4.091","","90","","90","","90","","520.172","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- Ni Sn -","- Ni Sn -","- Ni16 Sn16 -","16","2","","Bhargava, M.K.; Schubert, K.","Kristallstruktur von Ni Sn","Journal of the Less-Common Metals","1973","33","","181","189","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523368","28.79","","6.94","","2.76","","90","","90","","90","","551.455","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- Pt7 Zn12 -","- Pt7 Zn12 -","- Pt14 Zn24 -","2","0.25","","Carl, W.; Schubert, K.","Die Struktur von Pt7 Zn12","Journal of the Less-Common Metals","1969","19","","279","283","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523392","5.484","","10.86","","3.95","","90","","90","","90","","235.247","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- Ga2.7 Pt5.3 -","- Ga2.7 Pt5.3 -","- Ga5.4 Pt10.6 -","2","0.25","","Chattopadhyay, T.K.; Khalaff, K.; Schubert, K.","Zur Konstitution der Mischungen Platin-Gallium und Platin-Gallium-Germanium","Metall (Berlin)","1974","28","","1160","1168","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523696","5.36","","10.42","","4.08","","90","","90","","90","","227.873","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- Rh5 Ti3 -","- Rh5 Ti3 -","- Rh10 Ti6 -","2","0.25","","Giessen, B.C.; Wang, R.; Grant, N.J.","New A3 B5 phases of the titanium group metals with rhodium","Transactions of the Metallurgical Society of Aime","1969","245","","1207","1210","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523697","5.58","","10.73","","4.25","","90","","90","","90","","254.462","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- Hf3 Rh5 -","- Hf3 Rh5 -","- Hf6 Rh10 -","2","0.25","","Giessen, G.C.; Wang, R.; Grant, N.J.","New A3 B5 phases of the titanium group metals with rhodium","Transactions of the Metallurgical Society of Aime","1969","245","","1207","1210","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523998","8.258","","11.662","","8.925","","90","","90","","90","","859.52","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","K2 (Hg Cl4) (H2 O)","","- Cl4 H2 Hg K2 O -","- Cl4 Hg K2 O -","- Cl16 Hg4 K8 O4 -","4","0.5","","Aurivillius, K.; Stalhandske, C.","An X-ray single crystal study of K2 Hg Cl4 H2 O","Acta Chemica Scandinavica (1-27,1973-42,1988)","1973","27","","1086","1088","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1524376","11.703","","9.929","","6.041","","90","","90","","90","","701.959","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- Cd7 Th6 -","- Cd7 Th6 -","- Cd14 Th12 -","2","0.25","","Fornasini, M.L.; Palenzona, A.; Manfrinetti, P.","Crystal structure of the new thorium intermetallics Th In and Th6 Cd7","Journal of Solid State Chemistry","1984","51","","135","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525246","6.734","","23.24","","4.115","","90","","90","","90","","643.99","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","U2 Mo O8","","- Mo O8 U2 -","- Mo O8 U2 -","- Mo4 O32 U8 -","4","0.5","","Serezhkin, V.N.; Kovba, L.M.; Trunov, V.K.","Crystal structure of U2 Mo O8","Kristallografiya","1973","18","","514","517","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526174","12.131","","22.271","","3.819","","90","","90","","90","","1031.78","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Ba3.87 Sm9.4 Ti18 O54","","- Ba3.87 O54 Sm9.4 Ti18 -","- Ba3.872 O54 Sm9.4 Ti18 -","- Ba3.872 O54 Sm9.4 Ti18 -","1","0.125","","Ohsato, H.","Science of tungstenbronze-type like Ba6-3x R8+2x Ti18 O54 (R = rare earth) microwave dielectric solid solutions","Journal of the European Ceramic Society","2001","21","","2703","2711","","","","","","","","","","","","","","","","","","","","","","has coordinates","147304","2020-10-21","18:00:00",""
"1526184","8.937","","11.226","","3.433","","90","","90","","90","","344.422","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sc2 Al0.9 B6","","- Al0.9 B6 Sc2 -","- Al0.9 B6 Sc2 -","- Al3.6 B24 Sc8 -","4","0.5","","Okada, S.; Leithe-Jasper, A.; Tanaka, T.; Michiue, Y.; Gurin, V.N.","Crystal growth and structure analysis of a new scandium aluminum boride Sc2 Al B6","Journal of Solid State Chemistry","2000","154","","49","53","","","","","","","","","","","","","","","","","","","","","","has coordinates","147314","2020-10-21","18:00:00",""
"1526275","7.497","","8.6086","","5.6963","","90","","90","","90","","367.632","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Nd (Mn2 O5)","","- Mn2 Nd O5 -","- Mn2 Nd O5 -","- Mn8 Nd4 O20 -","4","0.5","","Popov, G.; Greenblatt, M.; McCarroll, W.H.","Synthesis of Ln Mn2 O5 (Ln = Nd, Pr) crystals using fused salt electrolysis","Materials Research Bulletin","2000","35","","1661","1667","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526276","7.5384","","8.6319","","5.7022","","90","","90","","90","","371.046","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Pr (Mn2 O5)","","- Mn2 O5 Pr -","- Mn2 O5 Pr -","- Mn8 O20 Pr4 -","4","0.5","","Popov, G.; McCarroll, W.H.; Greenblatt, M.","Synthesis of Ln Mn2 O5 (Ln = Nd, Pr) crystals using fused salt electrolysis","Materials Research Bulletin","2000","35","","1661","1667","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526631","7.3992","","23.001","","4.5139","","90","","90","","90","","768.216","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Yb5 In2 Sb6","","- In2 Sb6 Yb5 -","- In2 Sb6 Yb5 -","- In4 Sb12 Yb10 -","2","0.25","","Kim, S.-J.; Ireland, J.R.; Kanatzidis, M.G.; Kannewurf, C.R.","Yb5 In2 Sb6: a new rare earth Zintl phase with a narrow band gap","Journal of Solid State Chemistry","2000","155","","55","61","","","","","","","","","","","","","","","","","","","","","","has coordinates","147863","2020-10-21","18:00:00",""
"1526840","14.3419","","15.5528","","3.9948","","90","","90","","90","","891.067","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Nd7 V O4 Se8","","- Nd7 O4 Se8 V -","- Nd7 O4 Se8 V -","- Nd14 O8 Se16 V2 -","2","0.25","","Tougait, O.; Ibers, J.A.","Synthesis and characterization of the rare-earth vanadium oxyselenides Ln7 V O4 Se8 (Ln = Nd, Sm, Gd)","Journal of Solid State Chemistry","2000","154","","564","568","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526842","14.2","","15.451","","3.9511","","90","","90","","90","","866.888","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Sm7 V O4 Se8","","- O4 Se8 Sm7 V -","- O4 Se8 Sm7 V -","- O8 Se16 Sm14 V2 -","2","0.25","","Tougait, O.; Ibers, J.A.","Synthesis and characterization of the rare-earth vanadium oxyselenides Ln7 V O4 Se8 (Ln = Nd, Sm, Gd)","Journal of Solid State Chemistry","2000","154","","564","568","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527089","26.1998","","9.4652","","3.4641","","90","","90","","90","","859.05","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- Nb8 P5 -","- Nb8 P5 -","- Nb32 P20 -","4","0.5","","Anugul, S.; Pontchour, C.-O.; Rundqvist, S.","The crystal structure of Nb8 P5","Acta Chemica Scandinavica (1-27,1973-42,1988)","1973","27","","26","34","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528281","7.294","","8.5551","","5.6875","","90","","90","","90","","354.905","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Dy Mn2 O5 -","- Dy Mn2 O5 -","- Dy4 Mn8 O20 -","4","0.5","","Abrahams, S.C.; Bernstein, J.L.","Crystal structure of paramagnetic Dy Mn2 O5","Journal of Chemical Physics","1967","46","","3776","3782","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528452","10.046","","25.994","","3.9689","","90","","90","","90","","1036.42","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Mn2 Sb2 Se4 Br2","","- Br2 Mn2 Sb2 Se4 -","- Br2 Mn2 Sb2 Se4 -","- Br8 Mn8 Sb8 Se16 -","4","0.5","","Doussier, C.; Leone, P.; Moelo, Y.","Synthesis and crystal structures of four new bromo-chalcogenides: Mn Sb S2 Br, Mn Bi Se2 Br and two allotropic forms of Mn Sb Se2 Br. Crystal chemistry of the Mn Pn Q2 X family (Pn: Sb, Bi; Q: S, Se; X: Cl, Br, I)","Solid State Sciences","2006","8","","652","659","","","","","","","","","","","","","","","","","","","","","","has coordinates","150691","2020-10-21","18:00:00",""
"1528469","8.079","","14.337","","8.681","","90","","90","","90","","1005.51","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","(N H4)4 (P4 S8) (H2 O)2","","- H20 N4 O2 P4 S8 -","- H20 N4 O2 P4 S8 -","- H40 N8 O4 P8 S16 -","2","0.25","","Falius, H.; Krause, W.; Sheldrick, W.S.","(N H4)4 (P4 S8) (H2 O)2, das Salz einer 'quadratischen' Thiophosphorsaeure","Angewandte Chemie (German Edition)","1981","93","","121","122","","","","","","","","","","","","","","","","","","","","","","has coordinates","150745","2020-10-21","18:00:00",""
"1528724","7.2617","","8.5161","","5.7126","","90","","90","","90","","353.275","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Dy (Cr0.94 Mn1.06) O5","","- Cr0.94 Dy Mn1.06 O5 -","- Cr0.94 Dy Mn1.06 O5 -","- Cr3.76 Dy4 Mn4.24 O20 -","4","0.5","","Martinez-Lope, M.J.; Alonso, J.A.; Retuerto, M.; Garcia-Hernandez, M.","Preparation, structural and magnetic characterization of Dy Cr Mn O3","Journal of Solid State Chemistry","2009","182","","532","537","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528937","6.155","","10.06","","3.498","","90","","90","","90","","216.594","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sr2 (Pb O4)","","- O4 Pb Sr2 -","- O4 Pb Sr2 -","- O8 Pb2 Sr4 -","2","0.25","","Troemel, M.","Zur Struktur der Verbindungen vom Sr2 Pb O4-Typ","Naturwissenschaften","1965","52","","492","493","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529022","5.75379","","9.7016","","3.26641","","90","","90","","90","","182.334","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Ca2 (Sn O4)","","- Ca2 O4 Sn -","- Ca2 O4 Sn -","- Ca4 O8 Sn2 -","2","0.25","","Yamane, H.; Kaminaga, Y.; Abe, S.; Yamada, T.","Preparation, crystal structure, and photoluminescence of Ca2 Sn O4:Eu(3+), Y(3+)","Journal of Solid State Chemistry","2008","181","","2559","2564","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529023","5.76322","","9.7997","","3.28937","","90","","90","","90","","185.776","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Ca1.9 Eu0.2 Sn0.9 O4","","- Ca1.9 Eu0.2 O4 Sn0.9 -","- Ca1.9 Eu0.2 O4 Sn0.9 -","- Ca3.8 Eu0.4 O8 Sn1.8 -","2","0.25","","Yamane, H.; Kaminaga, Y.; Abe, S.; Yamada, T.","Preparation, crystal structure, and photoluminescence of Ca2 Sn O4:Eu(3+), Y(3+)","Journal of Solid State Chemistry","2008","181","","2559","2564","","","","","","","","","","","","","","","","","","","","","","has coordinates","151942","2020-10-21","18:00:00",""
"1529024","5.78238","","9.7868","","3.33566","","90","","90","","90","","188.768","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Ca1.7 Eu0.6 Sn0.7 O4","","- Ca1.7 Eu0.6 O4 Sn0.7 -","- Ca1.7 Eu0.6 O4 Sn0.7 -","- Ca3.4 Eu1.2 O8 Sn1.4 -","2","0.25","","Yamane, H.; Kaminaga, Y.; Abe, S.; Yamada, T.","Preparation, crystal structure, and photoluminescence of Ca2 Sn O4:Eu(3+), Y(3+)","Journal of Solid State Chemistry","2008","181","","2559","2564","","","","","","","","","","","","","","","","","","","","","","has coordinates","151943","2020-10-21","18:00:00",""
"1529025","5.76582","","9.76949","","3.30489","","90","","90","","90","","186.162","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Ca1.8 Y0.2 Eu0.2 Sn0.8 O4","","- Ca1.8 Eu0.2 O4 Sn0.8 Y0.2 -","- Ca1.8 Eu0.2 O4 Sn0.8 Y0.2 -","- Ca3.6 Eu0.4 O8 Sn1.6 Y0.4 -","2","0.25","","Yamane, H.; Kaminaga, Y.; Yamada, T.; Abe, S.","Preparation, crystal structure, and photoluminescence of Ca2 Sn O4:Eu(3+), Y(3+)","Journal of Solid State Chemistry","2008","181","","2559","2564","","","","","","","","","","","","","","","","","","","","","","has coordinates","151944","2020-10-21","18:00:00",""
"1529145","6.945","","19.533","","7.215","","90","","90","","90","","978.763","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","K2 U7 O22","","- K2 O22 U7 -","- K2 O22 U7 -","- K4 O44 U14 -","2","0.25","","Kovba, L.M.","Crystal Structure of K2 U7 O22","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1972","13","","256","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","152208","2020-10-21","18:00:00",""
"1529271","9.1757","0.0012","12.3163","0.0016","2.9978","0.0004","90","","90","","90","","338.78","0.08","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- B4 Mn5.64 Ni6.36 O20 -","- B4 Mn5.64 Ni6.36 O20 -","- B4 Mn5.64 Ni6.36 O20 -","1","0.125","","Bezmaternykh, Leonard; Kolesnikova, Evgeniya; Eremin, Evgeniy; Seryotkin, Yuriy; Molokeev, Maxim; Volkov, Nikita","Spin-lattice coupling and peculiarities of magnetic behavior of ferrimagnetic ludwigites Mn0.5(2+)M1.5(2+)Mn(3+)BO5 (M=Cu, Ni)","Solid State Phenomena","2015","233","0","133","","10.4028/www.scientific.net/SSP.233-234.133","","","0.71073","MoKα","","0.0312","0.0286","","","0.0668","0.0691","","","","","","1.171","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"1529379","9.1868","0.001","12.3218","0.0013","3.001","0.0003","90","","90","","90","","339.71","0.06","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- B4 Mn5.12 Ni6.84 O20 -","- B4 Mn5.12 Ni6.84 O20 -","- B4 Mn5.12 Ni6.84 O20 -","1","0.125","","L.N. Bezmaternykh; E.M. Kolesnikova; E.V. Eremin; S.N. Sofronova; N.V. Volkov; M.S. Molokeev","Magnetization pole reversal of ferrimagnetic ludwigites Mn3-xNixBO5","Journal of Magnetism and Magnetic Materials","2014","364","0","55","59","10.1016/j.jmmm.2014.04.031","","","0.71073","MoKα","","0.0306","0.027","","","0.0677","0.0711","","","","","","1.039","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"1529380","9.179","0.0017","12.344","0.002","3.001","0.0006","90","","90","","90","","340.03","0.11","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- B2 Mn5 Ni O10 -","- B4 Mn10 Ni2 O20 -","- B4 Mn10 Ni2 O20 -","1","0.125","","L.N. Bezmaternykh; E.M. Kolesnikova; E.V. Eremin; S.N. Sofronova; N.V. Volkov; M.S. Molokeev","Magnetization pole reversal of ferrimagnetic ludwigites Mn3-xNixBO5","Journal of Magnetism and Magnetic Materials","2014","364","0","55","59","10.1016/j.jmmm.2014.04.031","","","0.71073","MoKα","","0.04","0.0381","","","0.109","0.1112","","","","","","1.007","","","","has coordinates,has Fobs","176428","2020-10-21","18:00:00",""
"1530036","21.254","","11.774","","3.968","","90","","90","","90","","992.971","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Nd4 In5 S13","","- In5 Nd4 S13 -","- In5 Nd4 S13 -","- In10 Nd8 S26 -","2","0.25","","Guseinov, G.G.; Shnulin, A.N.; Mamedov, F.Kh.; Mamedov, H.S.","The crystal structure of Nd4 In5 S13","Doklady Akademii Nauk SSSR","1979","246","","1360","1362","","","","","","","","","","","","","","","","","","","","","","has coordinates","154998","2020-10-21","18:00:00",""
"1530037","21.393","","11.843","","4.061","","90","","90","","90","","1028.88","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","La4 In5 S13","","- In5 La4 S13 -","- In5 La4 S13 -","- In10 La8 S26 -","2","0.25","","Guseinov, G.G.; Mamedov, F.H.; Mamedov, H.S.","The crystal structure of La4 In5 S13","Doklady Akademii Nauk Azerbaidzhanskoi SSR","1979","35","","50","53","","","","","","","","","","","","","","","","","","","","","","has coordinates","154999","2020-10-21","18:00:00",""
"1530189","9.257","","10.301","","5.954","","90","","90","","90","","567.752","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sr Nb8 O14","","- Nb8 O14 Sr -","- Nb8 O14 Sr -","- Nb16 O28 Sr2 -","2","0.25","","Koehler, J.; Simon, A.; Hibble, S.J.; Cheetham, A.K.","A Single-Crystal and Synchrotron Powder X-Ray Refinement of the Structure of Sr Nb8 O14, a New Oxoniobate containing Nb6 Octahedra","Journal of the Less-Common Metals","1988","142","","123","133","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530430","9.23","","12.23","","2.995","","90","","90","","90","","338.084","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","(Mg1.85 Fe.15) (Fe.60 Al.40) B O3 O2","","- Al0.4 B Fe0.75 Mg1.85 O5 -","- Al0.4 B Fe0.75 Mg1.85 O5 -","- Al1.6 B4 Fe3 Mg7.4 O20 -","4","0.5","","Mokeeva, V.I.","The refinement of the structure of Ludwigite, (Mg1.85 Fe.15) (Fe.60 Al.40) B O3 O2 and distribution of mg, Fe2+ in its cation position","Geokhimiya","1968","1968","","975","979","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530524","9.566","","15.804","","6.36","","90","","90","","90","","961.512","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Cs Sb F4","","- Cs F4 Sb -","- Cs F4 Sb -","- Cs8 F32 Sb8 -","8","1","","Ovchinnikov, V.E.; Udovenko, A.A.; Solov'eva, L.P.; Davidovich, R.L.; Volkova, L.M.","Structure cristalline du tetrafluoroantimoniate(III) de caesium Cs Sb F4","Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))","1982","8","","1539","1541","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530577","15.01","","15.56","","4.068","","90","","90","","90","","950.104","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Pb4 Sb4 S11","","- Pb4 S11 Sb4 -","- Pb4 S11 Sb4 -","- Pb8 S22 Sb8 -","2","0.25","","Petrova, I.V.; Bortnikov, N.S.; Pobedimskaya, E.A.; Belov, N.V.","Crystal structure of new synthetic lead-antimony sulfo salt","Doklady Akademii Nauk SSSR","1979","244","","607","609","","","","","","","","","","","","","","","","","","","","","","has coordinates","155708","2020-10-21","18:00:00",""
"1530621","16.011","","14.984","","7.276","","90","","90","","90","","1745.58","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","K3 Nd Si6 O15","","- K3 Nd O15 Si6 -","- K3 Nd O15 Si6 -","- K12 Nd4 O60 Si24 -","4","0.5","","Pushcharovskii, D.Yu.; Karpov, O.G.; Pobedimskaya, E.A.; Belov, N.V.","The crystal structure of K3 Nd Si6 O15","Doklady Akademii Nauk SSSR","1977","234","","1323","1325","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530626","12.725","","12.741","","8.441","","90","","90","","90","","1368.53","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","K2 Sc (Si2 O6) (O H)","","- H K2 O7 Sc Si2 -","- K2 O7 Sc Si2 -","- K16 O56 Sc8 Si16 -","8","1","","Pyatenko, Yu.A.; Voronkov, A.A.; Zhdanova, T.A.","About the crystal structure of K4 Sc2 (O H)2 (Si4 O12)","Doklady Akademii Nauk SSSR","1979","248","","868","871","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530816","14.092","","10.078","","3.314","","90","","90","","90","","470.652","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Ta2 Ni3 S8","","- Ni3 S8 Ta2 -","- Ni3 S8 Ta2 -","- Ni6 S16 Ta4 -","2","0.25","","Squattrito, P.J.; Sunshine, S.A.; Ibers, J.A.","Some substitutional chemistry in known ternary and quaternary chalcogenides","Journal of Solid State Chemistry","1986","64","","261","269","","","","","","","","","","","","","","","","","","","","","","has coordinates","156030","2020-10-21","18:00:00",""
"1530886","9.517","","9.822","","22.813","","90","","90","","90","","2132.47","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Ba5 (Mo4 O6)8","","- Ba5 Mo32 O48 -","- Ba4.96 Mo32 O48 -","- Ba9.92 Mo64 O96 -","2","0.25","","Torardi, C.C.; McCarley, R.E.","Synthesis and structure of Ba5 (Mo4 O6)8. A compound having the Na Mo4 O6 structure type and superlattice ordering of barium ions","Journal of the Less-Common Metals","1986","116","","169","186","","","","","","","","","","","","","","","","","","","","","","has coordinates","156116","2020-10-21","18:00:00",""
"1530918","7.94","","8.44","","6.01","","90","","90","","90","","402.752","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi2 Fe4 O9 -","- Bi2 Fe4 O9 -","- Bi4 Fe8 O18 -","2","0.25","","Tutov, A.G.; Markin, V.N.","The X-ray structural analysis of the antiferromagnetic Bi2 Fe4 O9 and the isotypical combinations Bi2 Ga4 O9 and Bi2 Al4 O9","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1970","6","","2014","2017","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1530919","7.93","","8.31","","5.92","","90","","90","","90","","390.118","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi2 Ga4 O9 -","- Bi2 Ga4 O9 -","- Bi4 Ga8 O18 -","2","0.25","","Tutov, A.G.; Markin, V.N.","The X-ray structural analysis of the antiferromagnetic Bi2 Fe4 O9 and the isotypical combinations Bi2 Ga4 O9 and Bi2 Al4 O9","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1970","6","","2014","2017","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1531192","14.343","","10.196","","5.9075","","90","","90","","90","","863.92","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Mg28 Ge7.55 O32 F15.04","","- F15.04 Ge7.55 Mg28 O32 -","- F15.04 Ge7.552 Mg28 O32 -","- F15.04 Ge7.552 Mg28 O32 -","1","0.125","","Bless, P.W.; von Dreele, R.B.; Kostiner, E.; Hughes, R.E.","Anion and Cation Defect in Magnesium Fluorogermanate","Journal of Solid State Chemistry","1972","4","","262","268","","","","","","","","","","","","","","","","","","","","","","has coordinates","156543","2020-10-21","18:00:00",""
"1531229","5.528","","5.526","","28.651","","90","","90","","90","","875.223","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sr4 (Ru3 O10)","","- O10 Ru3 Sr4 -","- O10 Ru3 Sr4 -","- O40 Ru12 Sr16 -","4","0.5","","Crawford, M.K.; Harlow, R.L.; Marshall, W.; Cao, G.; Huang, Q.; Li, Z.; Lindstrom, R.L.; Lynn, J.W.","Structure and magnetism of single crysta Sr4 Ru3 O10: a ferromagnetic triple-layer ruthenate","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2002","65","","214412-1","214412-5","","","","","","","","","","","","","","","","","","","","","","has coordinates","156599","2020-10-21","18:00:00",""
"1531288","10.052","","8.192","","5.795","","90","","90","","90","","477.195","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Cu (Ge O3)","","- Cu Ge O3 -","- Cu Ge O3 -","- Cu8 Ge8 O24 -","8","1","","Dera, P.; Prewitt, C.T.; Jayaraman, A.; Gramsch, S.A.","Structural basis for high-pressure polymorphism in Cu Ge O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","2002","65","","134105-1","134105-10","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531355","15.835","","24.043","","4.134","","90","","90","","90","","1573.9","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Pb6 Sb6 Se17 -","- Pb6 Sb6 Se17 -","- Pb12 Sb12 Se34 -","2","0.25","","Emirdag-Eanes, M.; Kolis, J.W.","Structural characterization of Pb6 Sb6 Se17","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","10","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1531534","7.5516","","8.6453","","5.7078","","90","","90","","90","","372.639","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Pr (Mn2 O5)","","- Mn2 O5 Pr -","- Mn2 O5 Pr -","- Mn8 O20 Pr4 -","4","0.5","","Kagomiya, I.; Kohn, K.; Uchiyama, T.","Structure and ferroelectricity of R Mn2 O5","Ferroelectrics","2002","280","","131","143","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531537","7.5019","","8.6216","","5.7015","","90","","90","","90","","368.764","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Nd (Mn2 O5)","","- Mn2 Nd O5 -","- Mn2 Nd O5 -","- Mn8 Nd4 O20 -","4","0.5","","Kagomiya, I.; Kohn, K.; Uchiyama, T.","Structure and ferroelectricity of R Mn2 O5","Ferroelectrics","2002","280","","131","143","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531540","7.3917","","8.5645","","5.6901","","90","","90","","90","","360.219","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Eu (Mn2 O5)","","- Eu Mn2 O5 -","- Eu Mn2 O5 -","- Eu4 Mn8 O20 -","4","0.5","","Kagomiya, I.; Kohn, K.; Uchiyama, T.","Structure and ferroelectricity of R Mn2 O5","Ferroelectrics","2002","280","","131","143","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531543","7.3531","","8.5371","","5.6807","","90","","90","","90","","356.601","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Gd (Mn2 O5)","","- Gd Mn2 O5 -","- Gd Mn2 O5 -","- Gd4 Mn8 O20 -","4","0.5","","Kagomiya, I.; Kohn, K.; Uchiyama, T.","Structure and ferroelectricity of R Mn2 O5","Ferroelectrics","2002","280","","131","143","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531546","7.2303","","8.4438","","5.6524","","90","","90","","90","","345.086","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Er (Mn2 O5)","","- Er Mn2 O5 -","- Er Mn2 O5 -","- Er4 Mn8 O20 -","4","0.5","","Kagomiya, I.; Kohn, K.; Uchiyama, T.","Structure and ferroelectricity of R Mn2 O5","Ferroelectrics","2002","280","","131","143","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531549","7.195","","8.4236","","5.6572","","90","","90","","90","","342.87","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Yb (Mn2 O5)","","- Mn2 O5 Yb -","- Mn2 O5 Yb -","- Mn8 O20 Yb4 -","4","0.5","","Kagomiya, I.; Kohn, K.; Uchiyama, T.","Structure and ferroelectricity of R Mn2 O5","Ferroelectrics","2002","280","","131","143","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531552","7.1716","","8.4071","","5.655","","90","","90","","90","","340.953","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Lu (Mn2 O5)","","- Lu Mn2 O5 -","- Lu Mn2 O5 -","- Lu4 Mn8 O20 -","4","0.5","","Kagomiya, I.; Kohn, K.; Uchiyama, T.","Structure and ferroelectricity of R Mn2 O5","Ferroelectrics","2002","280","","131","143","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532810","7.5966","","7.68989","","2.8926","","90","","90","","90","","168.977","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","(Al1.52 Cr0.48) Al2.56 Si1.44 O9.87","","- Al4.08 Cr0.48 O9.87 Si1.44 -","- Al4.088 Cr0.48 O9.868 Si1.432 -","- Al4.088 Cr0.48 O9.868 Si1.432 -","1","0.125","","Li, J.F.; Li, L.; Stott, F.H.","Crystallographical analysis of surface layers of refractory ceramics formed using combined flame spray and simultaneous laser treatment","Journal of the European Ceramic Society","2004","24","","3129","3138","","","","","","","","","","","","","","","","","","","","","","has coordinates","158797","2020-10-21","18:00:00",""
"1533006","9.376","","10.516","","8.062","","90","","90","","90","","794.897","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Zr Rh Ge2","","- Ge2 Rh Zr -","- Ge2 Rh Zr -","- Ge24 Rh12 Zr12 -","12","1.5","","Kasahi, M.; Abe, S.; Taniguchi, T.; Ozawa, T.; Nagata, Y.; Samata, H.","Superconductivity of M Rh Ge2 (M = Zr, Hf)","Journal of Alloys Compd.","2004","368","","51","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533957","9.31","","10.465","","8.053","","90","","90","","90","","784.597","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Hf Rh Ge2","","- Ge2 Hf Rh -","- Ge2 Hf Rh -","- Ge24 Hf12 Rh12 -","12","1.5","","Kasahi, M.; Abe, S.; Samata, H.; Taniguchi, T.; Ozawa, T.; Nagata, Y.","Superconductivity of M Rh Ge2 (M = Zr, Hf)","Journal of Alloys Compd.","2004","368","","51","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534069","11.704","","12.141","","3.637","","90","","90","","90","","516.811","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","(Ca7 N4) In1.024","","- Ca7 In1.024 N4 -","- Ca7 In1.024 N4 -","- Ca14 In2.048 N8 -","2","0.25","","Ludwig, M.","Anwendung quantenmechanischer ab initio Rechnungen zum Studium ausgewaehlter Kristallstrukturprobleme","Dissertation Thesis Darmstadt","1998","1998","","1","1","","","","","","","","","","","","","","","","","","","","","","has coordinates","160389","2020-10-21","18:00:00",""
"1534070","11.44","","11.99","","3.65","","90","","90","","90","","500.654","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","(Ca7 N4) Ga1.34","","- Ca7 Ga1.34 N4 -","- Ca7 Ga1.34 N4 -","- Ca14 Ga2.68 N8 -","2","0.25","","Ludwig, M.","Anwendung quantenmechanischer ab initio Rechnungen zum Studium ausgewaehlter Kristallstrukturprobleme","Dissertation Thesis Darmstadt","1998","1998","","1","1","","","","","","","","","","","","","","","","","","","","","","has coordinates","160390","2020-10-21","18:00:00",""
"1534569","10.5973","","11.1687","","11.6179","","90","","90","","90","","1375.07","","","","","","","","","","","","","6","P b a m","-P 2 2ab","55","","Pr10 (Si9 Al O9.96 N16.04) Cl0.96","","- Al Cl0.96 N16.04 O9.96 Pr10 Si9 -","- Al Cl0.96 N16.04 O9.96 Pr10 Si9 -","- Al2 Cl1.92 N32.08 O19.92 Pr20 Si18 -","2","0.25","","Lieb, A.; Lauterbach, R.; Schnick, W.","Pr10 [Si(10-x) Al(x) O(9+x) N(17-x)] Cl with x= 1 - an oxonitridoalumosilicate chloride","Zeitschrift fuer Anorganische und Allgemeine Chemie","2006","632","","313","318","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535010","10.037","","18.336","","4.1244","","90","","90","","90","","759.048","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Cu Hg S Br","","- Br Cu Hg S -","- Br Cu Hg S -","- Br8 Cu8 Hg8 S8 -","8","1","","Beck, J.; Rompel, M.","Ueber Muenzmetall-Quecksilber-Chalkogenidhalogenide II: Hydrothermalsynthese, Kristallstruktur und Phasenumwandlung von Cu Hg S Cl und Cu Hg S Br","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","421","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535018","9.8401","","17.751","","4.0959","","90","","90","","90","","715.437","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Cu Hg S Cl","","- Cl Cu Hg S -","- Cl Cu Hg S -","- Cl8 Cu8 Hg8 S8 -","8","1","","Beck, J.; Rompel, M.","Ueber Muenzmetall-Quecksilber-Chalkogenidhalogenide II: Hydrothermalsynthese, Kristallstruktur und Phasenumwandlung von Cu Hg S Cl und Cu Hg S Br","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","421","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535020","6.604","","11.427","","6.161","","90","","90","","90","","464.933","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","K2 Ba (N O2)4","","- Ba K2 N4 O8 -","- Ba K2 N4 O8 -","- Ba2 K4 N8 O16 -","2","0.25","","Harada, M.","Room-temperature structure of K2 Ba (N O2)4","Journal of the Physical Society of Japan","1983","52","","3448","3453","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535185","11.25285","","16.51255","","3.334594","","90","","90","","90","","619.612","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Ca3 Tl2 O6","","- Ca3 O6 Tl2 -","- Ca3 O6 Tl2 -","- Ca12 O24 Tl8 -","4","0.5","","Berastegui, P.; Eriksson, S.; Eriksen, J.; Hull, S.; Garcia Garcia, F.J.","Synthesis and crystal structure of the alkaline-earth thallates Mn(n) Tl2 O(3+n) (M = Ca, Sr)","Solid State Sciences","2004","6","","433","441","","","","","","","","","","","","","","","","","","","","","","has coordinates","162413","2020-10-21","18:00:00",""
"1535309","6.942","","11.989","","3.856","","90","","90","","90","","320.926","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Na2 (Ti Cl4)","","- Cl4 Na2 Ti -","- Cl4 Na2 Ti -","- Cl8 Na4 Ti2 -","2","0.25","","Hinz, D.J.; Meyer, G.; Dedecke, T.; Urland, W.","Synthese, Kristallstruktur und Magnetismus von Natriumtetrachlorotitanat(II), Na2TiCl4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1994","620","","801","804","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535338","9.127","","11.46","","3.584","","90","","90","","90","","374.87","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Al Yb2 B6","","- Al B6 Yb2 -","- Al B6 Yb2 -","- Al4 B24 Yb8 -","4","0.5","","Mikhalenko, S.I.; Kuz'ma, Yu.B.; Korsukova, M.M.; Gurin, V.N.","Ternary borides containing rare earth metals and aluminum with structures of Y Cr B4 and Y2 Re B6 types","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1980","16","","1941","1944","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535342","5.906","","11.44","","3.48","","90","","90","","90","","235.125","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Al Lu B4","","- Al B4 Lu -","- Al B4 Lu -","- Al4 B16 Lu4 -","4","0.5","","Mikhalenko, S.I.; Kuz'ma, Yu.B.; Korsukova, M.M.; Gurin, V.N.","Ternary borides containing rare earth metals and aluminum with structures of Y Cr B4 and Y2 Re B6 types","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1980","16","","1941","1944","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535503","11.872","","5.9206","","3.9911","","90","","90","","90","","280.532","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","(Fe (N H3)2) Br2","","- Br2 Fe H6 N2 -","- Br2 Fe N2 -","- Br4 Fe2 N4 -","2","0.25","","Bremm, S.; Meyer, G.","Reactivity of ammonium halides: action of ammonium chloride and bromide on iron and iron(III) chloride and bromide","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","1875","1880","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535892","8.873","","12.946","","4.273","","90","","90","","90","","490.839","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","(C2) Ge2 La5","","- C2 Ge2 La5 -","- C2 Ge2 La5 -","- C4 Ge4 La10 -","2","0.25","","Carillo-Cabrera, W.; Peters, K.; Curda, J.; Kohout, M.; von Schnering, H.G.","Pentalanthanum ethenide(4-) digermanide(4-), La5 (C2) Ge2","Zeitschrift fuer Anorganische und Allgemeine Chemie","2004","630","","2186","2190","","","","","","","","","","","","","","","","","","","","","","has coordinates","163392","2020-10-21","18:00:00",""
"1536255","10.814","","17.05","","4.149","","90","","90","","90","","764.987","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi8 Ca3 Pd4 -","- Bi8 Ca3 Pd4 -","- Bi16 Ca6 Pd8 -","2","0.25","","Johrendt, D.; Mewis, A.","Ca3Pd4Bi8: Kristall- und elektronische Bandstruktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","2002","628","","2671","2674","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1536425","5.4937","","5.4937","","7.56979","","90","","90","","90","","228.462","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Y Ba Co Mn O5","","- Ba Co Mn O5 Y -","- Ba Co Mn O5 Y -","- Ba2 Co2 Mn2 O10 Y2 -","2","0.25","","Karen, P.; Suard, E.; Fauth, F.; Woodward, P.M.","Y Ba Mn Co O5: neither valence mixed nor charge ordered","Solid State Sciences","2004","6","","1195","1204","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536524","14.111","","5.809","","3.271","","90","","90","","90","","268.126","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sc2 Cr C3","","- C3 Cr Sc2 -","- C3 Cr Sc2 -","- C12 Cr4 Sc8 -","4","0.5","","Pecharskaya, A.O.; Marusin, E.P.; Bodak, O.I.; Mazus, M.D.","Crystal structure of Sc2CrC3","Kristallografiya","1990","35","","47","49","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538009","23.2173","","7.6108","","2.918","","90","","90","","90","","515.617","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Al5.33 Si0.67 O9.33","","- Al5.33 O9.33 Si0.67 -","- Al5.33333 O9.33333 Si0.666667 -","- Al16 O28 Si2 -","3","0.375","","Fischer, R.X.; Schneider, H.; Schmuecker, M.","Crystal structure of Al-rich mullite","American Mineralogist","1994","79","","983","990","","","","","","","","","","","","","","","","","","","","","","has coordinates","166409","2020-10-21","18:00:00",""
"1539292","11.02","","5.6","","4.239","","90","","90","","90","","261.597","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- In3 Pd5 -","- In3 Pd5 -","- In6 Pd10 -","2","0.25","","Schubert, K.; Lukas, H.L.; Bhan, S.; Meissner, H.G.","Zum Aufbau der Systeme Kobalt-Gallium, Palladium-Gallium, Palladium-Zinn und verwandter Legierungen","Zeitschrift fuer Metallkunde","1959","50","","534","540","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1541217","7.708","","7.708","","2.906","","90","","90","","90","","172.655","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al6 K O9.5 -","- Al6 K O9.5 -","- Al6 K O9.5 -","1","0.125","","Mazza, D.; Busca, G.; Vallino, M.","Mullite-type structures in the system Al2O3-Me2O (Me= Na, K) and Al2O3-B2O3","Journal of the American Ceramic Society","1992","75","","1929","1934","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1541218","7.64","","7.64","","2.937","","90","","90","","90","","171.432","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al6 Na O9.5 -","- Al6 Na O9.5 -","- Al6 Na O9.5 -","1","0.125","","Mazza, D.; Vallino, M.; Busca, G.","Mullite-type structures in the system Al2O3-Me2O (Me= Na, K) and Al2O3-B2O3","Journal of the American Ceramic Society","1992","75","","1929","1934","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1541219","7.621","","7.621","","2.833","","90","","90","","90","","164.54","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al5 B O9 -","- Al5 B O9 -","- Al5 B O9 -","1","0.125","","Mazza, D.; Vallino, M.; Busca, G.","Mullite-type structures in the system Al2O3-Me2O (Me= Na, K) and Al2O3-B2O3","Journal of the American Ceramic Society","1992","75","","1929","1934","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1541220","7.617","","7.617","","2.827","","90","","90","","90","","164.019","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al4 B2 O9 -","- Al4 B2 O9 -","- Al4 B2 O9 -","1","0.125","","Mazza, D.; Vallino, M.; Busca, G.","Mullite-type structures in the system Al2O3-Me2O (Me= Na, K) and Al2O3-B2O3","Journal of the American Ceramic Society","1992","75","","1929","1934","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1542920","9.1757","0.0012","12.3163","0.0016","2.9978","0.0004","90","","90","","90","","338.78","0.08","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- B4 Mn5.64 Ni6.36 O20 -","- B4 Mn5.64 Ni6.36 O20 -","- B4 Mn5.64 Ni6.36 O20 -","1","0.125","","Moshkina Evgeniya; Sofronova Svetlana; Veligzhanin Alexey; Molokeev Maxim; Nazarenko Ilya; Eremin Evgeniy; Bezmaternykh Leonard","Magnetism and Structure of Ni2MnBO5 ludwigite","Journal of Magnetism and Magnetic Materials","2016","402","0","69","75","10.1016/j.jmmm.2015.11.033","","","0.71073","MoKα","","0.0312","0.0286","","","0.0668","0.0691","","","","","","1.171","","","","has coordinates,has Fobs","179009","2020-10-21","18:00:00",""
"1544373","9.371","0.0006","12.1952","0.0006","2.7916","0.0002","90","","90","","90","","319.03","0.03","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","Mg2Al2O5","","","- Al2 Mg2 O5 -","- Al2 Mg2 O5 -","- Al8 Mg8 O20 -","4","0.5","","Enomoto, A.; Kojitani, H.; Akaogi, M.; Miura, H.; Yusa, H.","High-pressure transitions in MgAl2O4 and a new high-pressure phase of Mg2Al2O5","Journal of Solid State Chemistry","2009","395","","182","389","","","","","","","","","","","","","","","","","","","","","","has coordinates","187621","2020-10-21","18:00:00",""
"1544382","7.4389","0.0001","8.4798","0.0002","5.7169","0.0001","90","","90","","90","","360.624","0.012","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","EuCrGeO5","","","- Cr Eu Ge O5 -","- Cr Eu Ge O5 -","- Cr4 Eu4 Ge4 O20 -","4","0.5","","Shpanchenko, R.V.; Tsirlin, A.A.; Kondakova, E.S.; Antipov, E.V.; Bougerol, C.; Hadermann, J.; Tendeloo, van, G.; Sakurai, H.; Takayama-Muromachi, E.","New germanates RCrGeO5 (R=Nd-Er,Y): synthesis, structure, and properties","Journal of Solid State Chemistry","2008","181","","2433","2441","","","","","","","","","","","","","","","","","","","","","","has coordinates","187633","2020-10-21","18:00:00",""
"1544684","9.73","","12.357","","3.055","","90","","90","","90","","367.314","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","8(Fe0.625Mg0.375)O*2Fe2O3*2B2O3","","vonsenite","- B4 Fe9 Mg3 O20 -","- B4 Fe12 O20 -","- B4 Fe12 O20 -","1","0.125","","Takeuchi, Y.","The crystal structure of vonsenite","Mineralogical Journal","1956","2","","19","26","","","","","","","","","","","","","","","","","","","","","","has coordinates","188718","2020-10-21","18:00:00",""
"1546101","16.496","0.0007","15.8918","0.0006","11.4039","0.0004","90","","90","","90","","2989.5","0.2","240","0.14","240","0.14","","","","","","","","5","P b a m","-P 2 2ab","55","2","Zn(P-ip)(bipy)","","- C21 H18 N2 O5 Zn -","- C21.014 H11.008 N2 O5.004 Zn -","- C84.056 H44.032 N8 O20.016 Zn4 -","4","0.5","","Schneemann, Andreas; Rudolf, Robin; Henke, Sebastian; Takahashi, Yukiko; Banh, Hung; Hante, Inke; Schneider, Christian; Noro, Shin-ichiro; Fischer, Roland A.","Linker functionalisation triggers an alternative 3D-topology for Zn-isophthalate-4,4′-bipyridine frameworks","Dalton Transactions","2017","46","25","8198","8203","10.1039/C7DT01195D","","x-ray","1.54184","CuKα","","0.0797","0.0715","","","0.2113","0.2185","","","","","","1.095","","","","has coordinates,has disorder","282777","2023-04-20","11:56:45",""
"1548108","13.5923","0.0004","13.6702","0.0004","14.8894","0.0003","90","","90","","90","","2766.59","0.13","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","barium orthoborate","","- B2 Ba3 O6 -","- B2 Ba3 O6 -","- B32 Ba48 O96 -","16","2","","Bekker, Tatyana B.; Rashchenko, Sergey V.; Seryotkin, Yurii V.; Kokh, Alexander E.; Davydov, Aleksey V.; Fedorov, Pavel P.","BaO-B2O3 system and its mysterious member Ba3B2O6","Journal of the American Ceramic Society","2018","101","1","450","","10.1111/jace.15194","","","0.71073","MoKα","","0.1047","0.0966","","","0.1873","0.1916","","","","","","1.234","","","","has coordinates","203307","2020-10-21","18:00:00",""
"1548109","13.60119","0.00016","13.65014","0.00016","14.87279","0.00015","90","","90","","90","","2761.25","0.05","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","Barium Fluoride Orthoborate","","- B7.25 Ba12 F2.25 O21.75 -","- B7.195 Ba12 F2.513 O21.582 -","- B28.78 Ba48 F10.052 O86.328 -","4","0.5","","Rashchenko, Sergey V.; Bekker, Tatyana B.; Bakakin, Vladimir V.; Seryotkin, Yurii V.; Simonova, Ekaterina A.; Goryainov, Sergey V.","New fluoride borate with ‘anti-zeolite’ structure: A possible link to Ba 3 (BO 3 ) 2","Journal of Alloys and Compounds","2017","694","","1196","","10.1016/j.jallcom.2016.10.119","","","0.7107","MoKα","","0.0504","0.0368","","","0.0758","0.082","","","","","","1.058","","","","has coordinates","203309","2020-10-21","18:00:00",""
"1549598","7.5787","0.0007","7.6707","0.0004","2.8836","0.0001","90","","90","","90","","167.635","0.019","293","","293","","","","","","","","Sigma Aldrich","3","P b a m","-P 2 2ab","55","Mullite","","","- Al4.857 O9.571 Si1.143 -","- Al4.856 O9.57 Si1.144 -","- Al4.856 O9.57 Si1.144 -","1","0.125","GQ5008","Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon","Exploiting superspace to clarify vacancy and Al/Si ordering in mullite","IUCrJ","2018","5","4","","","10.1107/S2052252518007467","","x-ray","0.7231","synchrotron","","0.0384","0.0371","","","0.1028","0.1044","","","","1.12","1.12","1.01","","","","has coordinates","208623","2020-10-21","18:00:00",""
"1549599","7.577","0.002","7.6727","0.0018","2.8804","0.001","90","","90","","90","","167.46","0.08","293","","293","","","","","","","","","3","P b a m","-P 2 2ab","55","Mullite","","","- Al4.832 O9.584 Si1.168 -","- Al4.832 O9.584 Si1.168 -","- Al4.832 O9.584 Si1.168 -","1","0.125","GQ5008","Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon","Exploiting superspace to clarify vacancy and Al/Si ordering in mullite","IUCrJ","2018","5","4","","","10.1107/S2052252518007467","","x-ray","0.7231","synchrotron","","0.0347","0.0312","","","0.0846","0.0885","","","","1.27","1.27","1.08","","","","has coordinates","208623","2020-10-21","18:00:00",""
"1549600","7.5768","0.0013","7.676","0.0016","2.8833","0.0012","90","","90","","90","","167.69","0.08","293","","293","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al4.868 O9.566 Si1.132 -","- Al4.868 O9.566 Si1.132 -","- Al4.868 O9.566 Si1.132 -","1","0.125","GQ5008","Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon","Exploiting superspace to clarify vacancy and Al/Si ordering in mullite","IUCrJ","2018","5","4","","","10.1107/S2052252518007467","","x-ray","0.7231","synchrotron","","0.0423","0.0374","","","0.1056","0.1105","","","","1.95","1.95","1.44","","","","has coordinates","208623","2020-10-21","18:00:00",""
"1549601","7.577","0.002","7.6738","0.0019","2.8823","0.001","90","","90","","90","","167.59","0.08","293","","293","","","","","","","","Sigma Aldrich","3","P b a m","-P 2 2ab","55","Mullite","","","- Al4.853 O9.574 Si1.147 -","- Al4.8528 O9.5728 Si1.1472 -","- Al4.8528 O9.5728 Si1.1472 -","1","0.125","GQ5008","Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon","Exploiting superspace to clarify vacancy and Al/Si ordering in mullite","IUCrJ","2018","5","4","","","10.1107/S2052252518007467","","x-ray","0.7231","synchrotron","","0.031","0.0252","","","0.0916","0.0971","","","","1.37","1.37","1.03","","","","has coordinates","208623","2020-10-21","18:00:00",""
"1550747","9.0676","0.0004","15.524","0.0008","2.917","0.0001","90","","90","","90","","410.61","0.03","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","Na0.780Ti2.22Al4.78O12","","","- Al4.78 Na0.78 O12 Ti2.22 -","- Al4.78 Na0.78 O12 Ti2.22 -","- Al9.56 Na1.56 O24 Ti4.44 -","2","0.25","","Fukuda, K.; Hasegawa, S.; Hasegawa, E.; Urushihara, D.; Asaka, T.","Grain-oriented polycrystalline sodium titanoaluminate formed by reactive diffusion between solid Al2TiO5 and liquid [25mol% Na2O and 75mol% TiO2]","Journal of the Ceramic Society of Japan","2019","127","","150","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","214128","2020-10-21","18:00:00",""
"1551077","9.6091","0.0002","12.4324","0.0002","2.8498","0.0001","90","","90","","90","","340.449","0.015","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","Mg2Cr2O5","","Mg2Cr2O5 modified ludwigite","- Cr2 Mg2 O5 -","- Cr1.995 Mg2.005 O5 -","- Cr7.98 Mg8.02 O20 -","4","0.5","","Ishii, T.; Tsujino, N.; Arii, H.; Fujino, K.; Miyajima, N.; Kojitani, H.; Kunimoto, T.; Akaogi, M.","A shallow origin of so-called ultrahigh-pressure chromitites, based on single-crystal X-ray structure analysis of the high-pressure Mg2Cr2O5 phase, with modified ludwigite-type structure","American Mineralogist","2017","102","","2113","2118","","","","","","","","","","","","","","","","","","","","","","has coordinates","215348","2020-10-21","18:00:00",""
"1551402","35.1918","0.0018","47.1545","0.0018","33.4757","0.001","90","","90","","90","","55551","4","200","2","100","2","","","","","","","synthesis as described","8","P b a m","-P 2 2ab","55","","","","- C448 H415 B7 F6 Fe6 N40 O15 P -","- C508.94 H401 B7.67 F6 Fe6 N40 O15 P -","- C2035.76 H1604 B30.68 F24 Fe24 N160 O60 P4 -","4","0.5","","David A. Leigh; Robin G. Pritchard; Alexander J. Stephens","A Star of David catenane","Nature Chemistry","2013","6","","978","982","10.1038/nchem.2056","","x-ray","0.6889","synchrotron","","0.2373","0.1727","","","0.3425","0.3685","","","","","","1.586","","","","has coordinates,has disorder","215932","2020-10-21","18:00:00",""
"1552713","14.8195","0.0008","20.8662","0.0012","9.5394","0.0007","90","","90","","90","","2949.8","0.3","100","2","99.99","","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C44 H42 F18 N6 P3 S2 -","- C44 H42 F18 N6 P3 S2 -","- C88 H84 F36 N12 P6 S4 -","2","0.25","","Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser","Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes.","Chemical science","2020","11","1","107","112","10.1039/c9sc04860j","","","1.54178","CuKα","","0.1185","0.1123","","","0.2975","0.3018","","","","","","1.05","","","","has coordinates,has disorder","248866","2020-10-21","18:00:00",""
"1552715","14.1423","0.0006","21.9108","0.0007","9.5937","0.0003","90","","90","","90","","2972.79","0.18","100","2","100","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C48 H46 F18 N6 P3 -","- C48 H46 F18 N6 P3 -","- C96 H92 F36 N12 P6 -","2","0.25","","Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser","Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes.","Chemical science","2020","11","1","107","112","10.1039/c9sc04860j","","","1.54178","CuKα","","0.1427","0.1009","","","0.314","0.3523","","","","","","1.195","","","","has coordinates,has disorder","248866","2020-10-21","18:00:00",""
"1552717","10.3821","0.0005","21.5348","0.0009","9.6558","0.0004","90","","90","","90","","2158.81","0.16","100","2","99.98","","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C32 H28 F12 N4 P2 S2 -","- C32 H28 F12 N4 P2 S2 -","- C64 H56 F24 N8 P4 S4 -","2","0.25","","Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser","Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes.","Chemical science","2020","11","1","107","112","10.1039/c9sc04860j","","","1.54178","CuKα","","0.0525","0.0471","","","0.1507","0.1561","","","","","","1.08","","","","has coordinates","248866","2020-10-21","18:00:00",""
"1552719","10.266","0.0006","21.7433","0.0014","9.8244","0.0006","90","","90","","90","","2193","0.2","100","2","100.01","","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C34 H30 F12 N4 P2 S -","- C34 H30 F12 N4 P2 S -","- C68 H60 F24 N8 P4 S2 -","2","0.25","","Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser","Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes.","Chemical science","2020","11","1","107","112","10.1039/c9sc04860j","","","1.54178","CuKα","","0.0585","0.0509","","","0.1542","0.1601","","","","","","1.073","","","","has coordinates,has disorder","248866","2020-10-21","18:00:00",""
"1552720","14.8597","0.0015","21.003","0.002","9.5902","0.0009","90","","90","","90","","2993.1","0.5","100","2","99.95","","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C44 H42 F18 N6 P3 S -","- C44 H42 F18 N6 P3 S -","- C88 H84 F36 N12 P6 S2 -","2","0.25","","Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser","Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes.","Chemical science","2020","11","1","107","112","10.1039/c9sc04860j","","","1.54178","CuKα","","0.1497","0.1358","","","0.3484","0.3577","","","","","","1.062","","","","has coordinates,has disorder","248866","2020-10-21","18:00:00",""
"1552722","14.1183","0.0009","21.8905","0.0011","9.5412","0.0005","90","","90","","90","","2948.8","0.3","100","2","99.98","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C47 H45 F18 N7 P3 -","- C47 H45 F18 N7 P3 -","- C94 H90 F36 N14 P6 -","2","0.25","","Cai, Kang; Shi, Yi; Cao, Changsu; Vemuri, Suneal; Cui, Binbin; Shen, Dengke; Wu, Huang; Zhang, Long; Qiu, Yunyan; Chen, Hongliang; Jiao, Yang; Stern, Charlotte L.; Alsubaie, Fehaid M.; Xiao, Hai; Li, Jun; Stoddart, J. Fraser","Tuning radical interactions in trisradical tricationic complexes by varying host-cavity sizes.","Chemical science","2020","11","1","107","112","10.1039/c9sc04860j","","","1.54178","CuKα","","0.1384","0.125","","","0.3812","0.4081","","","","","","1.821","","","","has coordinates,has disorder","248866","2020-10-21","18:00:00",""
"1554796","12.939","0.003","13.093","0.003","15.573","0.004","90","","90","","90","","2638.2","1.1","193","2","193","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C24 H44 B2 N2 O4 -","- C24 H44 B2 N2 O4 -","- C96 H176 B8 N8 O16 -","4","0.5","","Onuma, Kaoru; Suzuki, Katsunori; Yamashita, Makoto","Rhombic cyclobutadiene with a boryl/amino-substitution pattern: boryl group migration induced by reaction with water.","Organic letters","2015","17","5","1212","1215","10.1021/acs.orglett.5b00163","","","0.71075","MoKα","","0.1042","0.0729","","","0.1696","0.1916","","","","","","1.09","","","","has coordinates,has disorder","238124","2020-10-21","18:00:00",""
"1559946","12.8322","0.0003","19.9878","0.0003","20.044","0.0005","90","","90","","90","","5141.03","0.19","100","2","100","2","","","","","","","","6","P b a m","-P 2 2ab","55","","csiMOF-6","","- C30 H14 Cd N4 O8 S -","- C30 H14 Cd N4 O8 S -","- C120 H56 Cd4 N16 O32 S4 -","4","0.5","","Ding, Bowen; Chan, Bun; Proschogo, Nicholas; Solomon, Marcello B.; Kepert, Cameron J.; D'Alessandro, Deanna M.","A cofacial metal‒organic framework based photocathode for carbon dioxide reduction","Chemical Science","2021","12","10","3608","3614","10.1039/D0SC04691D","","","1.54178","CuKα","","0.0723","0.0611","","","0.1993","0.2123","","","","","","0.924","","","","has coordinates,has disorder","263672","2021-04-05","14:16:17",""
"1559947","12.9936","0.0001","19.8725","0.0001","20.0366","0.0003","90","","90","","90","","5173.76","0.09","100","2","100","2","","","","","","","","6","P b a m","-P 2 2ab","55","","csiMOF-6","","- C30 H14 Cd N4 O8 S -","- C30 H14 Cd N4 O8 S -","- C120 H56 Cd4 N16 O32 S4 -","4","0.5","","Ding, Bowen; Chan, Bun; Proschogo, Nicholas; Solomon, Marcello B.; Kepert, Cameron J.; D'Alessandro, Deanna M.","A cofacial metal‒organic framework based photocathode for carbon dioxide reduction","Chemical Science","2021","12","10","3608","3614","10.1039/D0SC04691D","","","1.54178","CuKα","","0.0679","0.0615","","","0.1811","0.1861","","","","","","1.155","","","","has coordinates,has disorder","263672","2021-04-05","14:16:21",""
"1561358","9.2877","0.0007","21.0328","0.0016","6.4213","0.0005","90","","90","","90","","1254.38","0.17","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Cl1.23 Cu1.9 O2.33 Te0.67 -","- Cl1.23333 Cu1.9 O2.33333 Te0.666667 -","- Cl14.8 Cu22.8 O28 Te8 -","12","1.5","","Markovski, Mishel R.; Siidra, Oleg I.; Kayukov, Roman A.; Nazarchuk, Evgeni W.","Porous layered and open-framework mixed-valence copper tellurites","Journal of Solid State Chemistry","2016","243","","215","220","10.1016/j.jssc.2016.08.028","","","0.71073","MoKα","","0.0985","0.0549","","","0.1326","0.1545","","","","","","1.029","","","","has coordinates","263437","2021-03-30","08:48:47",""
"1561675","11.8713","0.0019","13.776","0.002","4.3467","0.0007","90","","90","","90","","710.86","0.19","200","2","199.99","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- As6 Eu5 In2 -","- As6 Eu5 In2 -","- As12 Eu10 In4 -","2","0.25","","Childs, Amanda B.; Baranets, Sviatoslav; Bobev, Svilen","Five new ternary indium-arsenides discovered. Synthesis and structural characterization of the Zintl phases Sr3In2As4, Ba3In2As4, Eu3In2As4, Sr5In2As6 and Eu5In2As6","Journal of Solid State Chemistry","2019","278","","120889","","10.1016/j.jssc.2019.07.050","","","0.71073","MoKα","","0.0605","0.0358","","","0.0691","0.0773","","","","","","0.984","","","","has coordinates","264075","2021-04-13","07:40:44",""
"1561677","12.039","0.002","13.936","0.003","4.382","0.0008","90","","90","","90","","735.2","0.2","200","2","199.99","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- As6 In2 Sr5 -","- As6 In2 Sr5 -","- As12 In4 Sr10 -","2","0.25","","Childs, Amanda B.; Baranets, Sviatoslav; Bobev, Svilen","Five new ternary indium-arsenides discovered. Synthesis and structural characterization of the Zintl phases Sr3In2As4, Ba3In2As4, Eu3In2As4, Sr5In2As6 and Eu5In2As6","Journal of Solid State Chemistry","2019","278","","120889","","10.1016/j.jssc.2019.07.050","","","0.71073","MoKα","","0.0729","0.0451","","","0.0921","0.1026","","","","","","1.018","","","","has coordinates","264077","2021-04-13","07:43:08",""
"1561756","16.9005","0.001","10.6248","0.0002","2.8834","0.0001","90","","90","","90","","517.76","0.04","293","","293","","","","3400000","","","","high-pressure high-temperature synthesis","2","P b a m","-P 2 2ab","55","diiron heptaboride","diiron heptaboride","","- B7 Fe2 -","- B7 Fe2 -","- B56 Fe16 -","8","1","","Bykova, E.; Gou, H.; Bykov, M.; Hanfland, M.; Dubrovinsky, L.; Dubrovinskaia, N.","Crystal structures and compressibility of novel iron borides Fe2B7 and Fe B50 synthesized at high pressure and high temperature","Journal of Solid State Chemistry","2015","230","","102","109","10.1016/j.jssc.2015.06.040","","x-ray","0.41441","synchrotron","","0.0427","0.0359","","","0.0895","0.101","","","","1.87","1.87","1.95","","","","has coordinates","264151","2021-04-14","09:57:26",""
"1561757","16.846","0.0008","10.6107","0.0001","2.8751","0.0001","90","","90","","90","","513.92","0.03","293","","293","","","","5650000","","","","high-pressure high-temperature synthesis","2","P b a m","-P 2 2ab","55","diiron heptaboride","diiron heptaboride","","- B7 Fe2 -","- B7 Fe2 -","- B56 Fe16 -","8","1","","Bykova, E.; Gou, H.; Bykov, M.; Hanfland, M.; Dubrovinsky, L.; Dubrovinskaia, N.","Crystal structures and compressibility of novel iron borides Fe2B7 and Fe B50 synthesized at high pressure and high temperature","Journal of Solid State Chemistry","2015","230","","102","109","10.1016/j.jssc.2015.06.040","","x-ray","0.41441","synchrotron","","0.0347","0.0295","","","0.0741","0.0827","","","","1.48","1.48","1.53","","","","has coordinates","264152","2021-04-14","09:59:01",""
"1561758","16.6754","0.001","10.5521","0.0002","2.8464","0.0001","90","","90","","90","","500.85","0.04","293","","293","","","","12500000","","","","high-pressure high-temperature synthesis","2","P b a m","-P 2 2ab","55","diiron heptaboride","diiron heptaboride","","- B7 Fe2 -","- B7 Fe2 -","- B56 Fe16 -","8","1","","Bykova, E.; Gou, H.; Bykov, M.; Hanfland, M.; Dubrovinsky, L.; Dubrovinskaia, N.","Crystal structures and compressibility of novel iron borides Fe2B7 and Fe B50 synthesized at high pressure and high temperature","Journal of Solid State Chemistry","2015","230","","102","109","10.1016/j.jssc.2015.06.040","","x-ray","0.41441","synchrotron","","0.0415","0.0364","","","0.0843","0.0915","","","","1.92","1.92","1.92","","","","has coordinates","264153","2021-04-14","10:00:43",""
"1561759","16.6018","0.0011","10.529","0.0002","2.834","0.0001","90","","90","","90","","495.38","0.04","293","","293","","","","16100000","","","","high-pressure high-temperature synthesis","2","P b a m","-P 2 2ab","55","diiron heptaboride","diiron heptaboride","","- B7 Fe2 -","- B7 Fe2 -","- B56 Fe16 -","8","1","","Bykova, E.; Gou, H.; Bykov, M.; Hanfland, M.; Dubrovinsky, L.; Dubrovinskaia, N.","Crystal structures and compressibility of novel iron borides Fe2B7 and Fe B50 synthesized at high pressure and high temperature","Journal of Solid State Chemistry","2015","230","","102","109","10.1016/j.jssc.2015.06.040","","x-ray","0.41441","synchrotron","","0.0425","0.0398","","","0.0872","0.0891","","","","2.08","2.08","1.97","","","","has coordinates","264154","2021-04-14","10:02:28",""
"1561760","16.5418","0.0013","10.5067","0.0002","2.8218","0.0001","90","","90","","90","","490.43","0.04","293","","293","","","","19200000","","","","","2","P b a m","-P 2 2ab","55","diiron heptaboride","diiron heptaboride","","- B7 Fe2 -","- B7 Fe2 -","- B56 Fe16 -","8","1","","Bykova, E.; Gou, H.; Bykov, M.; Hanfland, M.; Dubrovinsky, L.; Dubrovinskaia, N.","Crystal structures and compressibility of novel iron borides Fe2B7 and Fe B50 synthesized at high pressure and high temperature","Journal of Solid State Chemistry","2015","230","","102","109","10.1016/j.jssc.2015.06.040","","x-ray","0.41441","synchrotron","","0.0471","0.0393","","","0.0847","0.0905","","","","1.9","1.9","1.84","","","","has coordinates","264155","2021-04-14","10:04:02",""
"1561761","16.4469","0.0008","10.4785","0.0001","2.8089","0.0001","90","","90","","90","","484.08","0.03","293","","293","","","","23500000","","","","high-pressure high-temperature synthesis","2","P b a m","-P 2 2ab","55","diiron heptaboride","diiron heptaboride","","- B7 Fe2 -","- B7 Fe2 -","- B56 Fe16 -","8","1","","Bykova, E.; Gou, H.; Bykov, M.; Hanfland, M.; Dubrovinsky, L.; Dubrovinskaia, N.","Crystal structures and compressibility of novel iron borides Fe2B7 and Fe B50 synthesized at high pressure and high temperature","Journal of Solid State Chemistry","2015","230","","102","109","10.1016/j.jssc.2015.06.040","","x-ray","0.41441","synchrotron","","0.0457","0.0404","","","0.0918","0.0949","","","","2.23","2.23","2.13","","","","has coordinates","264156","2021-04-14","10:05:34",""
"1561762","16.363","0.002","10.4485","0.0003","2.7948","0.0001","90","","90","","90","","477.82","0.06","293","","293","","","","28000000","","","","high-pressure high-temperature synthesis","2","P b a m","-P 2 2ab","55","diiron heptaboride","diiron heptaboride","","- B7 Fe2 -","- B7 Fe2 -","- B56 Fe16 -","8","1","","Bykova, E.; Gou, H.; Bykov, M.; Hanfland, M.; Dubrovinsky, L.; Dubrovinskaia, N.","Crystal structures and compressibility of novel iron borides Fe2B7 and Fe B50 synthesized at high pressure and high temperature","Journal of Solid State Chemistry","2015","230","","102","109","10.1016/j.jssc.2015.06.040","","x-ray","0.41441","synchrotron","","0.0505","0.0404","","","0.0891","0.0944","","","","2.02","2.02","1.92","","","","has coordinates","264157","2021-04-14","10:07:25",""
"1561763","16.2755","0.0014","10.4254","0.0002","2.7831","0.0001","90","","90","","90","","472.23","0.04","293","","293","","","","32100000","","","","high-pressure high-temperature synthesis","2","P b a m","-P 2 2ab","55","diiron heptaboride","diiron heptaboride","","- B7 Fe2 -","- B7 Fe2 -","- B56 Fe16 -","8","1","","Bykova, E.; Gou, H.; Bykov, M.; Hanfland, M.; Dubrovinsky, L.; Dubrovinskaia, N.","Crystal structures and compressibility of novel iron borides Fe2B7 and Fe B50 synthesized at high pressure and high temperature","Journal of Solid State Chemistry","2015","230","","102","109","10.1016/j.jssc.2015.06.040","","x-ray","0.41441","synchrotron","","0.0474","0.0398","","","0.0856","0.0896","","","","1.9","1.9","1.8","","","","has coordinates","264158","2021-04-14","10:08:45",""
"1561764","16.1899","0.0017","10.3983","0.0003","2.7692","0.0001","90","","90","","90","","466.19","0.05","293","","293","","","","37200000","","","","high-pressure high-temperature synthesis","2","P b a m","-P 2 2ab","55","diiron heptaboride","diiron heptaboride","","- B7 Fe2 -","- B7 Fe2 -","- B56 Fe16 -","8","1","","Bykova, E.; Gou, H.; Bykov, M.; Hanfland, M.; Dubrovinsky, L.; Dubrovinskaia, N.","Crystal structures and compressibility of novel iron borides Fe2B7 and Fe B50 synthesized at high pressure and high temperature","Journal of Solid State Chemistry","2015","230","","102","109","10.1016/j.jssc.2015.06.040","","x-ray","0.41441","synchrotron","","0.051","0.044","","","0.0937","0.0964","","","","2.25","2.25","2.14","","","","has coordinates","264159","2021-04-14","10:10:29",""
"1561765","16.1256","0.0017","10.3762","0.0003","2.7585","0.0001","90","","90","","90","","461.56","0.05","293","","293","","","","41100000","","","","high-pressure high-temperature synthesis","2","P b a m","-P 2 2ab","55","diiron heptaboride","diiron heptaboride","","- B7 Fe2 -","- B7 Fe2 -","- B56 Fe16 -","8","1","","Bykova, E.; Gou, H.; Bykov, M.; Hanfland, M.; Dubrovinsky, L.; Dubrovinskaia, N.","Crystal structures and compressibility of novel iron borides Fe2B7 and Fe B50 synthesized at high pressure and high temperature","Journal of Solid State Chemistry","2015","230","","102","109","10.1016/j.jssc.2015.06.040","","x-ray","0.41441","synchrotron","","0.0474","0.0413","","","0.0889","0.0939","","","","1.88","1.88","1.81","","","","has coordinates","264160","2021-04-14","10:12:52",""
"1561766","16.9699","0.0015","10.652","0.0009","2.8938","0.0003","90","","90","","90","","523.09","0.08","296","2","296","2","","","","","","","","2","P b a m","-P 2 2ab","55","diiron heptaboride","diiron heptaboride","","- B7 Fe2 -","- B7 Fe2 -","- B56 Fe16 -","8","1","","Bykova, E.; Gou, H.; Bykov, M.; Hanfland, M.; Dubrovinsky, L.; Dubrovinskaia, N.","Crystal structures and compressibility of novel iron borides Fe2B7 and Fe B50 synthesized at high pressure and high temperature","Journal of Solid State Chemistry","2015","230","","102","109","10.1016/j.jssc.2015.06.040","","x-ray","0.71073","MoKα","","0.1024","0.0529","","","0.0736","0.0868","","","","","","0.978","","","","has coordinates","264161","2021-04-14","10:14:25",""
"1561928","15.283","0.0002","24.9021","0.0006","10.6168","0.0003","90","","90","","90","","4040.53","0.16","150","2","150","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C60 H88 N26 O38 Tb2 -","- C60 H88 N26 O38 Tb2 -","- C120 H176 N52 O76 Tb4 -","2","0.25","","Thuéry, Pierre","Structural variations in terbium(III) complexes with 1,3-adamantanedicarboxylate and diverse co-ligands","Journal of Solid State Chemistry","2015","227","","265","272","10.1016/j.jssc.2015.01.036","","","0.71073","MoKα","","0.0418","0.036","","","0.1059","0.1083","","","","","","1.072","","","","has coordinates","264308","2021-04-19","09:29:25",""
"1562953","8.62","0.001","14.9947","0.0017","3.2337","0.0004","90","","90","","90","","417.97","0.09","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- B3 Ir1.94 Rh2.38 Ti1.68 -","- B3 Ir1.946 Rh2.377 Ti1.677 -","- B12 Ir7.784 Rh9.508 Ti6.708 -","4","0.5","","Goerens, Christian; Fokwa, Boniface P.T.","The complex metal-rich boride Ti1+xRh2−x+yIr3−yB3 (x=0.68, y=1.06) with a new structure type containing B4 zigzag fragments: Synthesis, crystal chemistry and theoretical calculations","Journal of Solid State Chemistry","2012","192","","113","119","10.1016/j.jssc.2012.04.005","","","0.71073","MoKα","","0.0577","0.0479","","","0.09","0.0931","","","","","","1.158","","","","has coordinates","265581","2021-05-28","09:32:59",""
"1563072","6.9724","0.0004","14.8052","0.0007","3.9678","0.0002","90","","90","","90","","409.59","0.04","100","2","100","2","","","","","","","","4","P b a m","-P 2 2ab","55","Uranium Gadolinium Oxyselenide","","","- Gd2 O4 Se3 U2 -","- Gd2 O4 Se3 U2 -","- Gd4 O8 Se6 U4 -","2","0.25","","Raw, Adam D.; Ibers, James A.","Syntheses and crystal structures of the quaternary uranium lanthanide oxyselenides UYb2O2Se3 and U2Ln2O4Se3 (Ln=Pr, Sm, Gd)","Journal of Solid State Chemistry","2012","186","","177","181","10.1016/j.jssc.2011.12.002","","","0.71073","MoKα","","0.0222","0.0217","","","0.0576","0.0577","","","","","","1.777","","","","has coordinates","265665","2021-06-02","07:27:10",""
"1563073","7.0466","0.0003","14.9241","0.0005","4.0235","0.0001","90","","90","","90","","423.13","0.03","100","2","100","2","","","","","","","","4","P b a m","-P 2 2ab","55","Uranium Praseodymium Oxyselenide","","","- O4 Pr2 Se3 U2 -","- O4 Pr2 Se3 U2 -","- O8 Pr4 Se6 U4 -","2","0.25","","Raw, Adam D.; Ibers, James A.","Syntheses and crystal structures of the quaternary uranium lanthanide oxyselenides UYb2O2Se3 and U2Ln2O4Se3 (Ln=Pr, Sm, Gd)","Journal of Solid State Chemistry","2012","186","","177","181","10.1016/j.jssc.2011.12.002","","","0.71073","MoKα","","0.0185","0.0185","","","0.0548","0.0548","","","","","","1.919","","","","has coordinates","265665","2021-06-02","07:27:11",""
"1563074","6.9873","0.0002","14.7923","0.0004","3.9854","0.0001","90","","90","","90","","411.924","0.019","100","2","100","2","","","","","","","","4","P b a m","-P 2 2ab","55","Uranium Samarium Oxyselenide","","","- O4 Se3 Sm2 U2 -","- O4 Se3 Sm2 U2 -","- O8 Se6 Sm4 U4 -","2","0.25","","Raw, Adam D.; Ibers, James A.","Syntheses and crystal structures of the quaternary uranium lanthanide oxyselenides UYb2O2Se3 and U2Ln2O4Se3 (Ln=Pr, Sm, Gd)","Journal of Solid State Chemistry","2012","186","","177","181","10.1016/j.jssc.2011.12.002","","","0.71073","MoKα","","0.0157","0.0154","","","0.0399","0.0399","","","","","","1.473","","","","has coordinates","265665","2021-06-02","07:27:11",""
"1563076","8.1895","0.0016","20.169","0.004","7.6988","0.0015","90","","90","","90","","1271.6","0.4","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","Cobaltborate","","","- B24 Co7 H6 O46 -","- B24 Co7 H6 O46 -","- B48 Co14 H12 O92 -","2","0.25","","Neumair, Stephanie C.; Kaindl, Reinhard; Huppertz, Hubert","The new high-pressure borate Co7B24O42(OH)2·2H2O—Formation of edge-sharing BO4 tetrahedra in a hydrated borate","Journal of Solid State Chemistry","2012","185","","1","9","10.1016/j.jssc.2011.10.028","","","0.71073","MoKα","","0.0758","0.0454","","","0.0757","0.0836","","","","","","1.067","","","","has coordinates","265666","2021-06-02","07:38:23",""
"1563218","16.68","0.005","17.652","0.005","9.512","0.005","90","0.005","90","0.005","90","0.005","2800.7","1.9","293","2","293","2","","","","","","","synthesis as described","3","P b a m","-P 2 2ab","55","","","","- B41 Si1.25 Y -","- B41.042 Si1.25 Y -","- B328.336 Si10 Y8 -","8","1","","Berthebaud, D.; Sato, A.; Michiue, Y.; Mori, T.; Nomura, A.; Shishido, T.; Nakajima, K.","Effect of transition element doping on crystal structure of rare earth borosilicides REB44Si2","Journal of Solid State Chemistry","2011","184","7","1682","1687","10.1016/j.jssc.2011.04.038","","x-ray","0.71073","MoKα","","0.0445","0.0358","","","0.0947","0.107","","","","","","1.131","","","","has coordinates","266261","2021-06-08","08:47:12",""
"1563219","16.708","","17.674","","9.532","","90","","90","","90","","2814.77","","293","","293","","","","","","","","synthesis as described","3","P b a m","-P 2 2ab","55","","","","- B41.2 Si1.42 Y -","- B41.204 Si1.428 Y -","- B329.632 Si11.424 Y8 -","8","1","","Berthebaud, D.; Sato, A.; Michiue, Y.; Mori, T.; Nomura, A.; Shishido, T.; Nakajima, K.","Effect of transition element doping on crystal structure of rare earth borosilicides REB44Si2","Journal of Solid State Chemistry","2011","184","7","1682","1687","10.1016/j.jssc.2011.04.038","","x-ray","0.71073","MoKα","","0.0454","0.0359","","","0.0939","0.106","","","","","","1.084","","","","has coordinates","266261","2021-06-08","08:47:17",""
"1563220","16.673","0.005","17.659","0.005","9.511","0.005","90","0.005","90","0.005","90","0.005","2800.3","1.9","293","2","293","2","","","","","","","synthesis as described","4","P b a m","-P 2 2ab","55","","","","- B41.1 Rh0.02 Si1.1 Y -","- B41.168 Rh0.022 Si1.11 Y -","- B329.344 Rh0.176 Si8.88 Y8 -","8","1","","Berthebaud, D.; Sato, A.; Michiue, Y.; Mori, T.; Nomura, A.; Shishido, T.; Nakajima, K.","Effect of transition element doping on crystal structure of rare earth borosilicides REB44Si2","Journal of Solid State Chemistry","2011","184","7","1682","1687","10.1016/j.jssc.2011.04.038","","x-ray","0.71073","MoKα","","0.0544","0.0407","","","0.1059","0.1207","","","","","","1.105","","","","has coordinates","266261","2021-06-08","08:47:20",""
"1563221","16.702","0.005","17.666","0.005","9.522","0.005","90","","90","","90","","2809.5","1.9","293","2","293","2","","","","","","","synthesis as described","4","P b a m","-P 2 2ab","55","","","","- B41 Ni0.06 Si1.33 Y -","- B41.0115 Ni0.061 Si1.335 Y -","- B328.092 Ni0.488 Si10.68 Y8 -","8","1","","Berthebaud, D.; Sato, A.; Michiue, Y.; Mori, T.; Nomura, A.; Shishido, T.; Nakajima, K.","Effect of transition element doping on crystal structure of rare earth borosilicides REB44Si2","Journal of Solid State Chemistry","2011","184","7","1682","1687","10.1016/j.jssc.2011.04.038","","x-ray","0.71073","MoKα","","0.0548","0.0469","","","0.1079","0.1183","","","","","","1.164","","","","has coordinates","266261","2021-06-08","08:47:22",""
"1563572","6.3488","0.0002","8.6803","0.0002","4.0324","0.0002","90","","90","","90","","222.224","0.014","298","2","298","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Pt3 Sc2 Si2 -","- Pt3 Sc2 Si2 -","- Pt6 Sc4 Si4 -","2","0.25","","Gribanov, Alexander; Grytsiv, Andriy; Rogl, Peter; Seropegin, Yurii; Giester, Gerald","X-ray structural study of intermetallic alloys RT2Si and RTSi2 (R=rare earth, T=noble metal)","Journal of Solid State Chemistry","2010","183","6","1278","1289","10.1016/j.jssc.2010.03.038","","","0.71069","MoKα","","0.0394","0.037","","","0.096","0.0978","","","","","","1.135","","","","has coordinates","266560","2021-06-18","08:38:48",""
"1566708","20.9374","0.0006","10.9959","0.0003","14.9555","0.0005","90","","90","","90","","3443.14","0.18","297.05","0.16","297.05","0.16","","","","","","","","8","P b a m","-P 2 2ab","55","","","","- C29.25 H31.5 B Cl0.5 F4 P2 Pt S -","- C29.25 H31.5 B Cl0.5 F4 P2 Pt S -","- C117 H126 B4 Cl2 F16 P8 Pt4 S4 -","4","0.5","","Li, Ruiping; Barel, Nitsan; Subramaniyan, Vasudevan; Cohen, Orit; Tibika, Françoise; Tulchinsky, Yuri","Sulfonium cations as versatile strongly π-acidic ligands","Chemical Science","2022","","","","","10.1039/D2SC00588C","","x-ray","0.71073","MoKα","","0.0652","0.0454","","","0.1063","0.1137","","","","","","1.083","","","","has coordinates,has disorder","274010","2022-03-25","23:16:09",""
"1568158","7.483","0.0002","16.0919","0.0004","4.1041","0.0001","90","","90","","90","","494.2","0.02","100","","100","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- Ba0.63 Cu1.83 K0.87 S0.9 Se1.1 -","- Ba0.634 Cu1.828 K0.866 S0.906 Se1.094 -","- Ba2.536 Cu7.312 K3.464 S3.624 Se4.376 -","4","0.5","","Zhou, Xiuquan; Kolluru, Venkata Surya Chaitanya; Xu, Wenqian; Wang, Luqing; Chang, Tieyan; Chen, Yu-Sheng; Yu, Lei; Wen, Jianguo; Chan, Maria K. Y.; Chung, Duck Young; Kanatzidis, Mercouri G.","Discovery of chalcogenides structures and compositions using mixed fluxes","Nature","2022","612","7938","72","77","10.1038/s41586-022-05307-7","","","0.41328","Sychrotron","","0.0431","0.0385","","","0.1191","0.1226","","","","","","1.143","","","","has coordinates,has disorder","279984","2022-12-21","16:21:17",""
"1568162","7.417","0.0015","15.192","0.003","3.9244","0.0008","90","","90","","90","","442.2","0.15","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Cu7.66 Na6 Se8 -","- Cu7.656 Na6 Se8 -","- Cu7.656 Na6 Se8 -","1","0.125","","Zhou, Xiuquan; Kolluru, Venkata Surya Chaitanya; Xu, Wenqian; Wang, Luqing; Chang, Tieyan; Chen, Yu-Sheng; Yu, Lei; Wen, Jianguo; Chan, Maria K. Y.; Chung, Duck Young; Kanatzidis, Mercouri G.","Discovery of chalcogenides structures and compositions using mixed fluxes","Nature","2022","612","7938","72","77","10.1038/s41586-022-05307-7","","","0.71073","MoKα","","0.1204","0.0378","","","0.051","0.0576","","","","","","0.465","","","","has coordinates","279988","2022-12-21","16:28:57",""
"2001191","7.471","0.001","8.588","0.002","5.684","0.001","90","","90","","90","","364.69","0.12","293","","","","","","","","","","","3","P b a m","-P 2 2ab","","","","","- Mn2 Nd O5 -","- Mn2 Nd O5 -","- Mn8 Nd4 O20 -","4","0.5","DU1038","Euzen, P.; Leone, P.; Gueho, C.; Palvadeau, P.","Structure of NdMn~2~O~5~","Acta Crystallographica Section C","1993","49","11","1875","1877","10.1107/S0108270193003221","","","0.71069","MoKα","","","0.02","","","0.021","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2001418","5.549","0.0001","10.4774","0.0002","3.8796","0.0001","90","","90","","90","","225.556","0.008","","","","","","","","","","","","3","P b a m","-P 2 2ab","","","","","- Cu2 La2 O5 -","- Cu2 La2 O5 -","- Cu4 La4 O10 -","2","0.25","BR1018","La Placa, S. J.; Bringley, J. F.; Scott, B. A.; Cox, D. E.","Structure of La~2~Cu~2~O~5~ by high-resolution synchrotron X-ray powder diffraction","Acta Crystallographica Section C","1993","49","8","1415","1417","10.1107/S0108270193001891","","","1.2","","","","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002188","11.046","","16.62999","","3.279","","90","","90","","90","","602.3","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Dicalcium diindium strontium oxide","","- Ca2 In2 O6 Sr -","- Ca2 In2 O6 Sr -","- Ca8 In8 O24 Sr4 -","4","0.5","","Muschick, W; Mueller-Buschbaum, Hk","Zur Kenntnis von Sr Ca2 In2 O6","Zeitschrift fuer Anorganische und Allgemeine Chemie","1977","435","","56","60","10.1002/zaac.19774350107","","","","","","0.064","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002267","10.908","","16.45","","3.228","","90","","90","","90","","579.2","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Tricalcium diindium oxide","","- Ca3 In2 O6 -","- Ca3 In2 O6 -","- Ca12 In8 O24 -","4","0.5","","Schenck, R von; Mueller-Buschbaum, Hk","Ein neues calcium indat: Ca3 In2 O6","Zeitschrift fuer Anorganische und Allgemeine Chemie","1973","398","","15","23","10.1002/zaac.19733980103","","","","","","0.1","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002313","7.959","","8.431","","5.986","","90","","90","","90","","401.7","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Dibismuth digallium diiron(III) oxide","","- Bi2 Fe2 Ga2 O9 -","- Bi2 Fe2 Ga2 O9 -","- Bi4 Fe4 Ga4 O18 -","2","0.25","","Mueller-Buschbaum, Hk; Chales de Beaulieu, D","Zur Besetzung von Oktaeder- und Tetraederpositionen in Bi2 Ga2 Fe2 O9","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1978","33","","669","670","","","","","","","0.1","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002314","7.934","","8.301","","5.903","","90","","90","","90","","388.8","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Dibismuth tetragallium oxide","","- Bi2 Ga4 O9 -","- Bi2 Ga4 O9 -","- Bi4 Ga8 O18 -","2","0.25","","Mueller-Buschbaum, Hk; Chales de Beaulieu, D","Zur Besetzung von Oktaeder- und Tetraederpositionen in Bi2 Ga2 Fe2 O9","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1978","33","","669","670","","","","","","","0.1","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002331","7.722","","8.112","","5.703","","90","","90","","90","","357.2","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Tetraaluminium dibismuth oxide","","- Al4 Bi2 O9 -","- Al4 Bi2 O9 -","- Al8 Bi4 O18 -","2","0.25","","Arpe, R; Mueller-Buschbaum, Hk","Zur Kristallstruktur von Al4 Bi2 O9","Journal of Inorganic and Nuclear Chemistry","1977","39","","233","235","10.1016/0022-1902(77)80005-5","","","","","","0.047","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002435","9.182","0.005","12.14","0.006","2.984","0.002","90","","90","","90","","332.6","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Pentanickel germanium tetraoxide bis(borate)","","- B2 Ge Ni5 O10 -","- B2 Ge Ni5 O10 -","- B4 Ge2 Ni10 O20 -","2","0.25","","Bluhm, K; Mueller-Buschbaum, Hk","Oxometallate mit inselfoermigen Bor-Einlagerungen Ni5 M B2 O10","Journal of the Less-Common Metals","1989","147","","133","139","10.1016/0022-5088(89)90156-2","","","","","","0.04","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002436","9.312","0.004","12.328","0.006","3.06","0.002","90","","90","","90","","351.3","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Pentanickel zirconium tetraoxide bis(borate)","","- B2 Ni5 O10 Zr -","- B2 Ni5 O10 Zr -","- B4 Ni10 O20 Zr2 -","2","0.25","","Bluhm, K; Mueller-Buschbaum, Hk","Oxometallate mit inselfoermigen Bor-Einlagerungen Ni5 M B2 O10","Journal of the Less-Common Metals","1989","147","","133","139","10.1016/0022-5088(89)90156-2","","","","","","0.046","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002445","9.183","0.005","12.189","0.008","2.989","0.005","90","","90","","90","","334.6","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Pentanickel vanadium(IV) tetraoxide bis(borate)","","- B2 Ni5 O10 V -","- B2 Ni5 O10 V -","- B4 Ni10 O20 V2 -","2","0.25","","Bluhm, K; Mueller-Buschbaum, Hk","Zur Stabilisierung der Oxidationsstufen M(IV) im Ni5 M B2 O10-Typ","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","579","","111","115","10.1002/zaac.19895790112","","","","","","0.041","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002446","9.131","0.001","12.164","0.002","2.97","0.001","90","","90","","90","","329.9","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Pentanickel manganese(IV) tetraoxide bis(borate)","","- B2 Mn Ni5 O10 -","- B2 Mn Ni5 O10 -","- B4 Mn2 Ni10 O20 -","2","0.25","","Bluhm, K; Mueller-Buschbaum, Hk","Zur Stabilisierung der Oxidationsstufen M(IV) im Ni5 M B2 O10-Typ","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","579","","111","115","10.1002/zaac.19895790112","","","","","","0.048","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002515","9.102","0.003","12.011","0.002","2.944","0.001","90","","90","","90","","321.9","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Dinickel aluminium borate dioxide","","- Al B Ni2 O5 -","- Al B Ni2 O5 -","- Al4 B4 Ni8 O20 -","4","0.5","","Bluhm, K; Mueller-Buschbaum, Hk","Ein Beitrag ueber Oxometallate mit trigonal planaren B O3 Polyedern Ni2 M B O5 (M=Ga, Fe, Al, Cr)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1990","582","","15","20","10.1002/zaac.19905820103","","","","","","0.055","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002516","9.2","0.002","12.21","0.006","3.006","0.001","90","","90","","90","","337.7","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Dinickel iron(III) borate dioxide","","- B Fe Ni2 O5 -","- B Fe Ni2 O5 -","- B4 Fe4 Ni8 O20 -","4","0.5","","Bluhm, K; Mueller-Buschbaum, Hk","Ein Beitrag ueber Oxometallate mit trigonal planaren B O3 Polyedern Ni2 M B O5 (M=Ga, Fe, Al, Cr)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1990","582","","15","20","10.1002/zaac.19905820103","","","","","","0.059","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002517","9.2","0.002","12.154","0.005","2.986","0.001","90","","90","","90","","333.9","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Dinickel gallium borate dioxide","","- B Ga Ni2 O5 -","- B Ga Ni2 O5 -","- B4 Ga4 Ni8 O20 -","4","0.5","","Bluhm, K; Mueller-Buschbaum, Hk","Ein Beitrag ueber Oxometallate mit trigonal planaren B O3 Polyedern Ni2 M B O5 (M=Ga, Fe, Al, Cr)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1990","582","","15","20","10.1002/zaac.19905820103","","","","","","0.042","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002530","5.832","0.001","9.766","0.011","3.375","0.001","90","","90","","90","","192.2","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Dicalcium lead(IV) oxide","","- Ca2 O4 Pb -","- Ca2 O4 Pb -","- Ca4 O8 Pb2 -","2","0.25","","Teichert, A; Mueller-Buschbaum, Hk","Zur Kristallstruktur von Ca2 Pb O4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1992","607","","128","130","10.1002/zaac.19926070122","","","","","","0.044","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2003071","5.8884","0.0019","11.771","0.004","8.226","0.003","90","","90","","90","","570.2","0.3","300","","","","","","","","","","","3","P b a m","-P 2 2ab","","","","","- O3 Pb Zr -","- O3 Pb Zr -","- O24 Pb8 Zr8 -","8","1","OH0059","Yamasaki, K.; Soejima, Y.","Superstructure Determination of PbZrO~3~","Acta Crystallographica Section B","1998","54","5","524","530","10.1107/S0108768197018466","","","0.35","synchrotron","","","0.047","","","0.045","","","","","0.06","0.06","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003138","5.8779","0.0004","11.7846","0.0006","8.2042","0.0006","90","","90","","90","","568.27","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb2 Zr4 -","- O40 Pb8 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003139","5.8822","0.0004","11.7813","0.0006","8.2293","0.0004","90","","90","","90","","570.28","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb2 Zr4 -","- O40 Pb8 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003140","5.8779","0.0004","11.7846","0.0006","8.2042","0.0006","90","","90","","90","","568.27","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb2 Zr4 -","- O40 Pb8 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003141","5.8775","0.0003","11.7835","0.0004","8.2088","0.0004","90","","90","","90","","568.5","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb2 Zr4 -","- O40 Pb8 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003142","5.8797","0.0003","11.7827","0.0004","8.2162","0.0003","90","","90","","90","","569.17","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb2 Zr4 -","- O40 Pb8 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003143","5.8819","0.0004","11.782","0.0006","8.2294","0.0006","90","","90","","90","","570.3","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb2 Zr4 -","- O40 Pb8 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003144","5.8808","0.0005","11.7703","0.0006","8.2539","0.0005","90","","90","","90","","571.31","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb2 Zr4 -","- O40 Pb8 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003145","5.8822","0.0004","11.7813","0.0006","8.2293","0.0004","90","","90","","90","","570.28","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb2 Zr4 -","- O40 Pb8 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003146","5.8775","0.0003","11.7835","0.0004","8.2088","0.0004","90","","90","","90","","568.5","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb2 Zr4 -","- O40 Pb8 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003147","5.8797","0.0003","11.7827","0.0004","8.2162","0.0003","90","","90","","90","","569.17","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb4 Zr4 -","- O40 Pb16 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003148","5.8819","0.0004","11.782","0.0006","8.2294","0.0006","90","","90","","90","","570.3","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb4 Zr4 -","- O40 Pb16 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003149","5.8808","0.0005","11.7703","0.0006","8.2539","0.0005","90","","90","","90","","571.31","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O10 Pb4 Zr4 -","- O40 Pb16 Zr16 -","4","0.5","","","","Acta Crystallographica, Section B","1998","54","","750","765","","","neutron","0.71073","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2004052","9.845","0.002","11.513","0.004","3.775","0.001","90","","90","","90","","427.9","0.2","295","","","","","","","","","","see text","4","P b a m","-P 2 2ab","55","","","","- O8 S2 Sm2 Ta3 -","- O8 S2 Sm2 Ta4 -","- O16 S4 Sm4 Ta8 -","2","0.25","OH1081","Guo, G.; Wang, Y.; Chen, J.; Zhuang, H.; Huang, J.; Zhang, Q.","Samarium Tantalum Oxysulfide, Sm~2~Ta~3~S~2~O~8~","Acta Crystallographica Section C","1995","51","10","1964","1966","10.1107/S0108270195005026","","","0.71069","MoKα","","","0.058","","","0.076","","","","","1.33","1.33","","","","","has coordinates","208743","2020-10-21","18:00:00",""
"2004827","26.618","0.009","8.95","0.004","10.889","0.004","90","","90","","90","","2594.1","1.7","293","2","293","2","","","","","","","","8","P b a m","-P 2 2ab","55","","","","- C17 H27 Cl Cu F6 N3 O4 P -","- C17 H27 Cl Cu F6 N3 O6 P -","- C68 H108 Cl4 Cu4 F24 N12 O24 P4 -","4","0.5","AB1348","Alcock, N. W.; Busch, D. H.; Vance, A. L.","A Copper(II) Complex of a Macrocyclic Schiff Base Ligand with a Polyether Bridge","Acta Crystallographica Section C","1996","52","5","1134","1136","10.1107/S0108270196001278","","","0.71073","MoKα","","0.0794","0.0584","","0.1768","0.1554","","","","1.016","1.033","1.033","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2005541","5.5464","0.00013","10.472","0.0003","3.87959","0.00008","90","","90","","90","","225.334","0.01","296","","296","","","","","","","","","3","P b a m","-P 2 2ab","55","","dicopper(II) lanthanum cuprate","","- Cu2 La2 O5 -","- Cu2 La2 O5 -","- Cu4 La4 O10 -","2","0.25","OH1097","Khasanova, N. R.; Izumi, F.; Hiroi, Z.; Takano, M.; Huang, Q.; Santoro, A.","Redetermination of the Structure of La~2~Cu~2~O~5~ by Neutron Powder Diffraction","Acta Crystallographica Section C","1996","52","10","2381","2384","10.1107/S0108270196006646","","neutron","1.5396","neutron","","0.0171","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2005542","5.53528","0.00014","10.449","0.0003","3.87265","0.00008","90","","90","","90","","223.987","0.01","10","","10","","","","","","","","","3","P b a m","-P 2 2ab","55","","dicopper(II) lanthanum cuprate","","- Cu2 La2 O5 -","- Cu2 La2 O5 -","- Cu4 La4 O10 -","2","0.25","OH1097","Khasanova, N. R.; Izumi, F.; Hiroi, Z.; Takano, M.; Huang, Q.; Santoro, A.","Redetermination of the Structure of La~2~Cu~2~O~5~ by Neutron Powder Diffraction","Acta Crystallographica Section C","1996","52","10","2381","2384","10.1107/S0108270196006646","","neutron","1.5396","neutron","","0.0263","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2011977","12.4228","0.0011","12.63","0.003","5.101","0.003","90","","90","","90","","800.3","0.5","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","tribarium diantimonide oxide","","- Ba3 O Sb2 -","- Ba3 O Sb2 -","- Ba12 O4 Sb8 -","4","0.5","IZ1006","Boss, Michael; Pickhard, Frank; Zumdick, Markus; Röhr, Caroline","Barium antimonide oxide, Ba~3~Sb~2~O","Acta Crystallographica Section C","2001","57","5","503","504","10.1107/S0108270101002785","","","0.7107","MoKα","","0.039","0.034","","","","0.078","","","","","","1.228","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2015408","11.9697","0.0013","18.18","0.002","4.4626","0.0005","90","","90","","90","","971.1","0.19","295","1","295","1","","","","","","","","4","P b a m","-P 2 2ab","55","cadaverinium dichloride","Pentane-1,5-diammonium dichloride","","- C5 H16 Cl2 N2 -","- C5 H16 Cl2 N2 -","- C20 H64 Cl8 N8 -","4","0.5","DN3013","Pospieszna-Markiewicz, Izabela; Radecka-Paryzek, Wanda; Kubicki, Maciej","Cadaverinium dichloride: a case of centro‒non-centrosymmetric ambiguity","Acta Crystallographica Section C","2006","62","7","o399","o401","10.1107/S0108270106018397","","","0.71073","MoKα","","0.0501","0.0368","","","0.1","0.1086","","","","","","1.061","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2017847","9.2636","0.0005","12.2989","0.0005","3.01309","0.00015","90","","90","","90","","343.29","0.03","298","2","298","2","","","","","","","","4","P b a m","-P 2 2ab","55","","pentamagnesium titanium(IV) tetraoxide bis(borate)","","- B2 Mg5 O10 Ti -","- B2 Mg5 O10 Ti -","- B4 Mg10 O20 Ti2 -","2","0.25","KU3033","Kawano, Tetsuya; Yamane, Hisanori","Mg~5~TiO~4~(BO~3~)~2~","Acta Crystallographica Section C","2010","66","10","i92","i94","10.1107/S0108270110036577","","","0.71073","MoKα","","0.0243","0.0203","","","0.065","0.0704","","","","","","1.287","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2017971","9.084","0.004","26.311","0.01","2.8223","0.0011","90","","90","","90","","674.6","0.5","296","2","296","2","","","","","","","","3","P b a m","-P 2 2ab","55","","Tetrasodium nonamanganese octadecaoxide","","- Mn9 Na4.32 O18 -","- Mn9 Na4.322 O18 -","- Mn18 Na8.644 O36 -","2","0.25","BI3006","Chu, Qingxin; Wang, Xiaofeng; Li, Qiliang; Liu, Xiaoyang","The tunnel manganese oxide Na~4.32~Mn~9~O~18~: a new Na^+^ site discovered by single-crystal X-ray diffraction","Acta Crystallographica Section C","2011","67","2","i10","i12","10.1107/S0108270110052856","","","0.71073","MoKα","","0.0441","0.0315","","","0.0632","0.0677","","","","","","1.093","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2018870","12.221","","9.199","","2.996","","90","","90","","90","","336.813","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Ni5 Ti O4 (B O3)2","","- B2 Ni5 O10 Ti -","- B2 Ni5 O10 Ti -","- B4 Ni10 O20 Ti2 -","2","0.25","","Lager, G.A.; Armbruster, T.","Structure of Pentanickel Titanium Diboron Oxide, Ni5 Ti B2 O10","Acta Crystallographica C (39,1983-)","1985","41","","1400","1402","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2019660","15.504","0.005","17.105","0.006","4.4705","0.0013","90","","90","","90","","1185.6","0.7","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","Heptacerium docosazinc silicon","","- Ce7 Si1.05 Zn21.95 -","- Ce7 Si1.054 Zn21.946 -","- Ce14 Si2.108 Zn43.892 -","2","0.25","FN3179","Hoos, James; Suen, Nian-Tzu; Bobev, Svilen","Synthesis and crystal structures of <i>RE</i>~7~Zn~21+<i>x~</i>Si~2{‒~<i>x</i>} [<i>RE</i> = Ce, Pr, and Nd; 0.09(1) < <i>x</i> < 0.95(1)]","Acta Crystallographica Section C","2014","70","10","945","948","10.1107/S2053229614019822","","","0.71073","MoKα","","0.03","0.0218","","","0.0321","0.0341","","","","","","1.046","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019661","15.361","0.002","16.984","0.002","4.4555","0.0006","90","","90","","90","","1162.4","0.3","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","Heptapraseodymium henicosazinc disilicon","","- Pr7 Si1.91 Zn21.09 -","- Pr7 Si1.914 Zn21.086 -","- Pr14 Si3.828 Zn42.172 -","2","0.25","","Hoos, James; Suen, Nian-Tzu; Bobev, Svilen","Synthesis and crystal structures of <i>RE</i>~7~Zn~21+<i>x~</i>Si~2{‒~<i>x</i>} [<i>RE</i> = Ce, Pr, and Nd; 0.09(1) < <i>x</i> < 0.95(1)]","Acta Crystallographica Section C","2014","70","10","945","948","10.1107/S2053229614019822","","","0.71073","MoKα","","0.0446","0.0275","","","0.0446","0.0495","","","","","","1.078","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019662","15.345","0.002","17.001","0.002","4.433","0.0006","90","","90","","90","","1156.5","0.3","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","Heptaneodymium docosazinc silicon","","- Nd7 Si1.47 Zn21.53 -","- Nd7 Si1.472 Zn21.528 -","- Nd14 Si2.944 Zn43.056 -","2","0.25","","Hoos, James; Suen, Nian-Tzu; Bobev, Svilen","Synthesis and crystal structures of <i>RE</i>~7~Zn~21+<i>x~</i>Si~2{‒~<i>x</i>} [<i>RE</i> = Ce, Pr, and Nd; 0.09(1) < <i>x</i> < 0.95(1)]","Acta Crystallographica Section C","2014","70","10","945","948","10.1107/S2053229614019822","","","0.71073","MoKα","","0.0661","0.035","","","0.0504","0.059","","","","","","1.033","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2021988","12.3564","0.0018","6.5165","0.0007","9.9337","0.0011","90","","90","","90","","799.87","0.17","200","","200","","","","","","","","","4","P b a m","-P 2 2ab","55","","Magnesium carbonate hexahysrate","","- C2 H24 Mg2 O18 -","- C2 H24 Mg2 O18 -","- C4 H48 Mg4 O36 -","2","0.25","LG3251","Rincke, Christine; Schmidt, Horst; Voigt, Wolfgang","A new hydrate of magnesium carbonate, MgCO~3~·6H~2~O","Acta Crystallographica Section C","2020","76","3","","","10.1107/S2053229620001540","","","0.71073","MoKα","","0.0356","0.0287","","","0.0796","0.0854","","","","","","1.178","","","","has coordinates,has Fobs","280578","2023-01-25","08:34:37",""
"2022928","5.9425","0.0002","11.4831","0.0004","3.46425","0.00012","90","","90","","90","","236.395","0.014","294","2","294","2","","","","","","","synthesised by authors, see text","3","P b a m","-P 2 2ab","55","","Yttrium chromium tetraboride","","- B4 Cr Y -","- B4 Cr Y -","- B16 Cr4 Y4 -","4","0.5","PK2696","Tokuda, Makoto; Yubuta, Kunio; Shishido, Toetsu; Sugiyama, Kazumasa","Redetermination of the crystal structure of yttrium chromium tetra-boride, YCrB<sub>4</sub>, from single-crystal X-ray diffraction data.","Acta crystallographica. Section E, Crystallographic communications","2023","79","Pt 11","1072","1075","10.1107/S2056989023008952","","","0.71073","MoKα","","0.0222","0.0146","","","0.028","0.0292","","","","","","1.114","","","","has coordinates,has Fobs","288142","2023-12-07","11:50:40",""
"2101039","5.889","0.003","11.784","0.004","8.226","0.002","90","","90","","90","","570.9","0.4","","","","","","","","","","","","3","P b a m","-P 2 2ab","","","","","- O3 Pb Zr -","- O5.5 Pb Zr -","- O44 Pb8 Zr8 -","8","1","HU0418","Glazer, A. M.; Roleder, K.; Dec, J.","Structure and disorder in single-crystal lead zirconate, PbZrO~3~","Acta Crystallographica Section B","1993","49","5","846","852","10.1107/S0108768193005129","","","0.71069","MoKα","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2101654","5.884","0.001","11.787","0.003","8.231","0.002","90","","90","","90","","570.9","0.2","100","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O3 Pb Zr -","- O24 Pb8 Zr8 -","8","1","BM0006","Corker, D. L.; Glazer, A. M.; Dec, J.; Roleder, K.; Whatmore, R. W.","A Re-investigation of the Crystal Structure of the Perovskite PbZrO~3~ by X-ray and Neutron Diffraction","Acta Crystallographica Section B","1997","53","1","135","142","10.1107/S0108768196012414","","","0.71069","MoKα","","","0.0326","","","0.0607","","","","","0.996","0.996","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2101655","5.8878","0.0002","11.789","0.0004","8.2527","0.0002","90","","90","","90","","572.83","0.03","398","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- O3 Pb Zr -","- O3 Pb Zr -","- O24 Pb8 Zr8 -","8","1","BM0006","Corker, D. L.; Glazer, A. M.; Dec, J.; Roleder, K.; Whatmore, R. W.","A Re-investigation of the Crystal Structure of the Perovskite PbZrO~3~ by X-ray and Neutron Diffraction","Acta Crystallographica Section B","1997","53","1","135","142","10.1107/S0108768196012414","","neutron","1.90788","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102069","16.008","0.002","15.004","0.002","7.2794","0.0007","90","","90","","90","","1748.4","0.4","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","","","","","- H4 K3 Nd O17 Si6 -","- K3 Nd O20 Si6 -","- K12 Nd4 O80 Si24 -","4","0.5","BS0005","Haile, S. M.; Wuensch, B. J.","Structure, phase transitions and ionic conductivity of K~3~NdSi~6~O~15~·<i>x</i>H~2~O. I. α-K~3~NdSi~6~O~15~·2H~2~O and its polymorphs","Acta Crystallographica Section B","2000","56","3","335","348","10.1107/S0108768199015785","","","0.71073","MoKα","","0.0578","0.0528","","0.1571","","0.1562","","","1.016","","","1.016","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2104053","7.8195","0.0009","11.2145","0.0014","3.9462","0.0005","90","","90","","90","","346.05","0.07","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Pr2 S5 Sn -","- Pr2 S5 Sn -","- Pr4 S10 Sn2 -","2","0.25","BS5058","Daszkiewicz, Marek; Gulay, Lubomir D.; Shemet, Vasylyna Ya.","Crystal architecture of <i>R</i>~2~SnS~5~ (<i>R</i> = Pr, Nd, Gd and Tb): crystal structure relationships in chalcogenides","Acta Crystallographica Section B","2008","64","2","172","176","10.1107/S0108768108004175","","","0.71073","MoKα","","0.0156","0.0131","","","0.0241","0.0245","","","","","","1.119","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2104054","7.7721","0.0014","11.218","0.002","3.9272","0.0009","90","","90","","90","","342.4","0.12","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Nd2 S5 Sn -","- Nd2 S5 Sn -","- Nd4 S10 Sn2 -","2","0.25","BS5058","Daszkiewicz, Marek; Gulay, Lubomir D.; Shemet, Vasylyna Ya.","Crystal architecture of <i>R</i>~2~SnS~5~ (<i>R</i> = Pr, Nd, Gd and Tb): crystal structure relationships in chalcogenides","Acta Crystallographica Section B","2008","64","2","172","176","10.1107/S0108768108004175","","","0.71073","MoKα","","0.0267","0.0261","","","0.0663","0.0668","","","","","","1.093","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2104055","7.733","0.0017","11.29","0.002","3.8217","0.0009","90","","90","","90","","333.66","0.12","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Gd2 S5 Sn -","- Gd2 S5 Sn -","- Gd4 S10 Sn2 -","2","0.25","BS5058","Daszkiewicz, Marek; Gulay, Lubomir D.; Shemet, Vasylyna Ya.","Crystal architecture of <i>R</i>~2~SnS~5~ (<i>R</i> = Pr, Nd, Gd and Tb): crystal structure relationships in chalcogenides","Acta Crystallographica Section B","2008","64","2","172","176","10.1107/S0108768108004175","","","0.71073","MoKα","","0.0276","0.0184","","","0.0253","0.0271","","","","","","0.869","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2104056","7.717","0.002","11.246","0.0015","3.8056","0.0008","90","","90","","90","","330.27","0.12","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- S5 Sn Tb2 -","- S5 Sn Tb2 -","- S10 Sn2 Tb4 -","2","0.25","BS5058","Daszkiewicz, Marek; Gulay, Lubomir D.; Shemet, Vasylyna Ya.","Crystal architecture of <i>R</i>~2~SnS~5~ (<i>R</i> = Pr, Nd, Gd and Tb): crystal structure relationships in chalcogenides","Acta Crystallographica Section B","2008","64","2","172","176","10.1107/S0108768108004175","","","0.71073","MoKα","","0.0186","0.0155","","","0.0269","0.0276","","","","","","1.041","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2104615","13.266","0.0005","16.846","0.0007","16.703","0.0008","90","","90","","90","","3732.8","0.3","296.1","","","","","","","","","","","6","P b a m","-P 2 2ab","55","","catena-[tetrakis(mu(2)-1,2-bis(4-pyridyl)ethane)-tetrakis(isoselenocyanato)- di(iron(ii) bis(ethanol) clathrate]","","- C30 H36 Fe N6 O2 Se2 -","- C32 H24 Fe N6 Se2 -","- C128 H96 Fe4 N24 Se8 -","4","0.5","BK5088","Marsh, Richard E.","Space groups <i>P</i>1 and <i>Cc</i>: how are they doing?","Acta Crystallographica Section B","2009","65","6","782","783","10.1107/S0108768109046448","","","0.7107","MoKα","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2104767","7.9264","0.0004","8.2922","0.0004","5.8892","0.0003","90","","90","","90","","387.08","0.03","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","bismuth gallium oxide","","- Bi2 Ga4 O9 -","- Bi2 Ga4 O9 -","- Bi4 Ga8 O18 -","2","0.25","SN5096","Friedrich, Alexandra; Juarez-Arellano, Erick A.; Haussühl, Eiken; Boehler, Reinhard; Winkler, Björn; Wiehl, Leonore; Morgenroth, Wolfgang; Burianek, Manfred; Mühlberg, Manfred","Persistence of the stereochemical activity of the Bi^3+^ lone electron pair in Bi~2~Ga~4~O~9~ up to 50GPa and crystal structure of the high-pressure phase","Acta Crystallographica Section B","2010","66","3","323","337","10.1107/S0108768110010104","","","0.71073","MoKα","","0.0228","0.0212","","","0.05","0.0506","","","","","","1.259","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2104768","7.848","0.006","8.23","0.005","5.875","0.003","90","","90","","90","","379.5","0.4","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","bismuth gallium oxide","","- Bi2 Ga4 O9 -","- Bi2 Ga4 O9 -","- Bi4 Ga8 O18 -","2","0.25","SN5096","Friedrich, Alexandra; Juarez-Arellano, Erick A.; Haussühl, Eiken; Boehler, Reinhard; Winkler, Björn; Wiehl, Leonore; Morgenroth, Wolfgang; Burianek, Manfred; Mühlberg, Manfred","Persistence of the stereochemical activity of the Bi^3+^ lone electron pair in Bi~2~Ga~4~O~9~ up to 50GPa and crystal structure of the high-pressure phase","Acta Crystallographica Section B","2010","66","3","323","337","10.1107/S0108768110010104","","","0.71073","MoKα","","0.0279","0.0279","","","0.0766","0.0766","","","","","","1.192","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2104769","7.7333","0.0017","8.173","0.01","5.8228","0.0012","90","","90","","90","","368","0.5","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","bismuth gallium oxide","","- Bi2 Ga4 O9 -","- Bi2 Ga4 O9 -","- Bi4 Ga8 O18 -","2","0.25","SN5096","Friedrich, Alexandra; Juarez-Arellano, Erick A.; Haussühl, Eiken; Boehler, Reinhard; Winkler, Björn; Wiehl, Leonore; Morgenroth, Wolfgang; Burianek, Manfred; Mühlberg, Manfred","Persistence of the stereochemical activity of the Bi^3+^ lone electron pair in Bi~2~Ga~4~O~9~ up to 50GPa and crystal structure of the high-pressure phase","Acta Crystallographica Section B","2010","66","3","323","337","10.1107/S0108768110010104","","","0.71073","MoKα","","0.0409","0.0409","","","0.1059","0.1059","","","","","","1.063","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2104770","7.64","0.002","8.114","0.009","5.794","0.001","90","","90","","90","","359.2","0.4","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","bismuth gallium oxide","","- Bi2 Ga4 O9 -","- Bi2 Ga4 O9 -","- Bi4 Ga8 O18 -","2","0.25","SN5096","Friedrich, Alexandra; Juarez-Arellano, Erick A.; Haussühl, Eiken; Boehler, Reinhard; Winkler, Björn; Wiehl, Leonore; Morgenroth, Wolfgang; Burianek, Manfred; Mühlberg, Manfred","Persistence of the stereochemical activity of the Bi^3+^ lone electron pair in Bi~2~Ga~4~O~9~ up to 50GPa and crystal structure of the high-pressure phase","Acta Crystallographica Section B","2010","66","3","323","337","10.1107/S0108768110010104","","","0.71073","MoKα","","0.0446","0.0426","","","0.1143","0.1168","","","","","","1.149","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2104771","7.4596","0.001","8.058","0.002","5.747","0.002","90","0.03","90","0.03","90","0.017","345.45","0.15","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","bismuth gallium oxide","","- Bi2 Ga4 O9 -","- Bi2 Ga4 O9 -","- Bi4 Ga8 O18 -","2","0.25","SN5096","Friedrich, Alexandra; Juarez-Arellano, Erick A.; Haussühl, Eiken; Boehler, Reinhard; Winkler, Björn; Wiehl, Leonore; Morgenroth, Wolfgang; Burianek, Manfred; Mühlberg, Manfred","Persistence of the stereochemical activity of the Bi^3+^ lone electron pair in Bi~2~Ga~4~O~9~ up to 50GPa and crystal structure of the high-pressure phase","Acta Crystallographica Section B","2010","66","3","323","337","10.1107/S0108768110010104","","","0.45","synchrotron","","0.0751","0.0481","","","0.0785","0.0839","","","","","","1.108","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2105362","10.947","","18.968","","5.3127","","90","","90","","90","","1103.14","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Ag2 Hg I2 (N O3)2 H2 O","","- Ag2 Hg I2 N2 O6 -","- Ag2 Hg I2 N2 O6 -","- Ag8 Hg4 I8 N8 O24 -","4","0.5","","Holmberg, B.; Persson, K.","Structure of Mercury Disilver Diiodide Dinitrate Monohydrate","Acta Crystallographica B (24,1968-38,1982)","1982","38","","904","907","10.1107/S056774088200435X","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105435","5.958","","11.53","","3.465","","90","","90","","90","","238.031","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sm Fe B4","","- B4 Fe Sm -","- B4 Fe Sm -","- B16 Fe4 Sm4 -","4","0.5","","Yvon, K.; Braun, H.F.","Sm Fe B4 - A New Ternary Boride of the Y Cr B4 Type","Acta Crystallographica B (24,1968-38,1982)","1980","36","","2400","2402","10.1107/S0567740880008837","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105548","5.856","0.001","11.729","0.003","8.212","0.002","90","","90","","90","","564","0.2","100","","","","","","","","","","","3","P b a m","-P 2 2ab","","","","","- Hf O3 Pb -","- Hf O3 Pb -","- Hf8 O24 Pb8 -","8","1","BM0011","Corker, D. L.; Glazer, A. M.; Kaminsky, W.; Whatmore, R. W.; Dec, J.; Roleder, K.","Investigation into the Crystal Structure of the Perovskite Lead Hafnate, PbHfO~3~","Acta Crystallographica Section B","1998","54","1","18","28","10.1107/S0108768197009208","","","0.71069","MoKα","","","0.0383","","","0.0447","","","","","1.07","1.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105549","5.8582","0.0003","11.7224","0.0005","8.2246","0.0003","90","","90","","90","","564.8","0.04","","","","","","","","","","","","3","P b a m","-P 2 2ab","","","","","- Hf O3 Pb -","- Hf O3 Pb -","- Hf8 O24 Pb8 -","8","1","BM0011","Corker, D. L.; Glazer, A. M.; Kaminsky, W.; Whatmore, R. W.; Dec, J.; Roleder, K.","Investigation into the Crystal Structure of the Perovskite Lead Hafnate, PbHfO~3~","Acta Crystallographica Section B","1998","54","1","18","28","10.1107/S0108768197009208","","neutron","1.90788","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2106200","6.93","","11.86","","3.86","","90","","90","","90","","317.253","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Na2 (Mn Cl4)","","- Cl4 Mn Na2 -","- Cl4 Mn Na2 -","- Cl8 Mn2 Na4 -","2","0.25","","Goodyear, J.; Ali, S.A.D.; Steigmann, G.A.","The crystal structure of Na2 Mn Cl4","Acta Crystallographica B (24,1968-38,1982)","1971","27","","1672","1674","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106340","6.443","","26.851","","4.071","","90","","90","","90","","704.287","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Zr7 O8.79 F9.71","","- F9.71 O8.79 Zr7 -","- F9.708 O8.79 Zr7 -","- F19.416 O17.58 Zr14 -","2","0.25","","Holmberg, B.","The crystal structure of Zr7 O9 F10","Acta Crystallographica B (24,1968-38,1982)","1970","26","","830","835","","","","","","","","","","","","","","","","","","","","","","has coordinates","149138","2020-10-21","18:00:00",""
"2106346","11.542","","12.69","","3.974","","90","","90","","90","","582.064","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Eu3 Sn2 S7","","- Eu3 S7 Sn2 -","- Eu3 S7 Sn2 -","- Eu6 S14 Sn4 -","2","0.25","","Jaulmes, S.; Julien-Pouzol, M.","Sulfure d'europium et d'etain Eu3 Sn2 S7","Acta Crystallographica B (24,1968-38,1982)","1977","33","","3898","3901","","","","","","","","","","","","","","","","","","","","","","has coordinates","149228","2020-10-21","18:00:00",""
"2106534","6.175","","29.175","","3.93","","90","","90","","90","","708.012","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- Nb16.8 O42 -","- Nb16.8 O42 -","- Nb16.8 O42 -","1","0.125","","Kato, K.; Tamura, S.","Die Kristallstruktur von T-Nb2 O5","Acta Crystallographica B (24,1968-38,1982)","1975","31","","673","677","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106546","15.727","","12.328","","9.521","","90","","90","","90","","1845.95","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","(Sr (H2 O)8)2 (Bi2 Br10)","","- Bi2 Br10 H32 O16 Sr2 -","- Bi2 Br10 O16 Sr2 -","- Bi4 Br20 O32 Sr4 -","2","0.25","","Lazarini, F.; Leban, I.","Octaaquastrontium(II) Decabromodibismuthate(III)","Acta Crystallographica B (24,1968-38,1982)","1980","36","","2745","2747","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106863","36.69","","36.57","","3.945","","90","","90","","90","","5293.22","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Nb8 W9 O47","","- Nb8 O32 W9 -","- Nb8 O32 W9 -","- Nb48 O192 W54 -","6","0.75","","Craig, D.C.; Stephenson, N.C.","The crystal structure of Nb8 W9 O47","Acta Crystallographica B (24,1968-38,1982)","1969","25","","2071","2083","","","","","","","","","","","","","","","","","","","","","","has coordinates","161063","2020-10-21","18:00:00",""
"2106910","6.851","","14.529","","3.958","","90","","90","","90","","393.972","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ce4 O4 S3 -","- Ce4 O4 S3 -","- Ce8 O8 S6 -","2","0.25","","Dugue, J.; Guittard, M.; Carre, D.","Etude structurale des oxysulfures de cerium(III) et cerium (IV). I. Structure cristalline de l'oxysulfure de cerium Ce4 O4 S3","Acta Crystallographica B (24,1968-38,1982)","1978","34","","3564","3568","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2107122","7.408","","14.198","","7.148","","90","","90","","90","","751.818","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Na4.26 Nb3.94 Si8 O24.12 O2.8 (O H)1.2 (H2 O)8","","- H17.2 Na4.26 Nb3.94 O36.12 Si8 -","- Na4.264 Nb3.944 O36 Si8 -","- Na4.264 Nb3.944 O36 Si8 -","1","0.125","","Perrault, G.; Boucher, C.; Rossi, G.; Vicat, J.; Cannillo, E.","Structure cristalline du Nenadkevichite (Na,K)2-x (Nb,Ti) (O, O H) Su2 O6 (H2 O)2","Acta Crystallographica B (24,1968-38,1982)","1973","29","","1432","1438","","","","","","","","","","","","","","","","","","","","","","has coordinates","167031","2020-10-21","18:00:00",""
"2107209","13.224","","11.357","","4.138","","90","","90","","90","","621.465","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Ca5 ((As2) (Ga As2)2)","","- As6 Ca5 Ga2 -","- As6 Ca5 Ga2 -","- As12 Ca10 Ga4 -","2","0.25","","Verdier, P.; l'Haridon, P.; Laurent, Y.; Maunaye, M.","Etude structurale de Ca5 Ga2 As6","Acta Crystallographica B (24,1968-38,1982)","1976","32","","726","728","","","","","","","","","","","","","","","","","","","","","","has coordinates","168410","2020-10-21","18:00:00",""
"2107343","12.195","","36.74","","3.951","","90","","90","","90","","1770.22","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Nb22 W20 O102","","- Nb22 O102 W20 -","- Nb21.924 O102 W20.076 -","- Nb21.924 O102 W20.076 -","1","0.125","","Stephenson, N.C.","A Structural Investigation of Some Stable Phases in the Region Nb2 O5 W O3 - W O3","Acta Crystallographica B (24,1968-38,1982)","1968","24","","637","653","","","","","","","","","","","","","","","","","","","","","","has coordinates","173050","2020-10-21","18:00:00",""
"2107344","12.195","","36.73999","","3.951","","90","","90","","90","","1770.22","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Nb18 W16 O93","","- Nb18 O93 W16 -","- Nb18 O93 W16 -","- Nb18 O93 W16 -","1","0.125","","Stephenson, N.C.","A structural investigation of some stable phases in the region Nb2 O5 W O3 - W O3","Acta Crystallographica B (24,1968-38,1982)","1968","24","","637","653","","","","","","","","","","","","","","","","","","","","","","has coordinates","173052","2020-10-21","18:00:00",""
"2107380","15.32","","16.63","","9.3","","90","","90","","90","","2369.38","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","H K8 Rh3 Br18 (H2 O)10","","- Br18 H21 K8 O10 Rh3 -","- Br18 K8 O10 Rh3 -","- Br36 K16 O20 Rh6 -","2","0.25","","Coetzer, J.; Robb, W.; Bekker, P.; Bekker, Z.","The crystal and molecular structure of H K8 Rh3 Br18 (H2 O)10","Acta Crystallographica B (24,1968-38,1982)","1972","28","","3587","3591","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107433","15.25","","17.8","","3.996","","90","","90","","90","","1084.71","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","U O Cl2","","- Cl2 O U -","- Cl2 O U -","- Cl24 O12 U12 -","12","1.5","","Taylor, J.C.; Wilson, P.W.","The Structure of U O Cl2 by Neutron Diffraction","Acta Crystallographica B (24,1968-38,1982)","1974","30","","175","177","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107994","9.268","0.005","26.601","0.005","2.888","0.002","90","","90","","90","","712","0.6","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","Na4Mn4Ti5O18, W.G. Mumme, Acta Cryst.,","","","- Mn4 Na4 O18 Ti5 -","- Mn4 Na6 O18 Ti5 -","- Mn8 Na12 O36 Ti10 -","2","0.25","","Mumme, W. G.","The structure of Na~4~Mn~4~Ti~5~O~18~","Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry","1968","24","8","1114","1120","10.1107/s0567740868003778","","","","","","","","","","","","","","","","","","","","","has coordinates","200777","2020-10-21","18:00:00",""
"2108042","7.5817","0.0006","7.6752","0.0007","2.8843","0.0003","90","","90","","90","","167.84","0.03","293","","293","","","","","","","","Sigma Aldrich","3","P b a m","-P 2 2ab","55","Mullite","","","- Al4.847 O9.577 Si1.153 -","- Al3.76851 O7.5 Si0.731492 -","- Al3.76851 O7.5 Si0.731492 -","1","0.125","","Klar, Paul B.; de la Pinta, Noelia; Lopez, Gabriel A.; Etxebarria, Iñigo; Breczewski, Tomasz; Madariaga, Gotzon","Ordered vacancy distribution in 2/1 mullite: a superspace model","Acta Crystallographica Section B","2017","73","3","","","10.1107/S2052520617001652","","x-ray","0.71069","MoKα","","0.0629","0.0354","","","0.0886","0.1115","","","","1.03","1.03","0.98","","","","has coordinates,has Fobs","196647","2020-10-21","18:00:00",""
"2108648","9.3914","0.001","12.3034","0.001","3.0697","0.0006","90","","90","","90","","354.69","0.08","293","","293","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- B Fe2.654 Mg0.346 O5 -","- B Fe2.65 Mg0.35 O5 -","- B4 Fe10.6 Mg1.4 O20 -","4","0.5","RA5077","Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Bubnova, Rimma S.; Vagizov, Farit G.; Shablinskii, Andrey P.; Filatov, Stanislav K.; Shilovskikh, Vladimir V.; Pekov, Igor V.","Investigation of thermal behavior of mixed-valent iron borates vonsenite and hulsite containing [O<i>M</i>~4~]<i>^n^</i>^+^ and [O<i>M</i>~5~]<i>^n^</i>^+^ oxocentred polyhedra by <i>in situ</i> high-temperature Mössbauer spectroscopy, X-ray diffraction and thermal analysis","Acta Crystallographica Section B","2020","76","4","543","553","10.1107/S2052520620006538","","x-ray","0.71069","MoKα","","0.0452","0.0362","","","0.0376","0.0388","","","","1.82","1.82","1.66","","","","has coordinates","255154","2020-10-21","18:00:00",""
"2108649","9.425","0.001","12.3528","0.001","3.0799","0.0006","90","","90","","90","","358.58","0.08","400","","400","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- B Fe2.654 Mg0.346 O5 -","- B Fe2.6544 Mg0.3456 O5 -","- B4 Fe10.6176 Mg1.3824 O20 -","4","0.5","RA5077","Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Bubnova, Rimma S.; Vagizov, Farit G.; Shablinskii, Andrey P.; Filatov, Stanislav K.; Shilovskikh, Vladimir V.; Pekov, Igor V.","Investigation of thermal behavior of mixed-valent iron borates vonsenite and hulsite containing [O<i>M</i>~4~]<i>^n^</i>^+^ and [O<i>M</i>~5~]<i>^n^</i>^+^ oxocentred polyhedra by <i>in situ</i> high-temperature Mössbauer spectroscopy, X-ray diffraction and thermal analysis","Acta Crystallographica Section B","2020","76","4","543","553","10.1107/S2052520620006538","","x-ray","0.71069","MoKα","","0.0347","0.029","","","0.0316","0.0324","","","","1.6","1.6","1.48","","","","has coordinates","255154","2020-10-21","18:00:00",""
"2109076","9.246","0.0014","12.2731","0.0018","3.0092","0.0005","90","","90","","90","","341.48","0.09","293","","293","","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- Al0.1 B Fe0.45 Mg2.15 O5 Ti0.3 -","- Al0.1 B Fe0.45 Mg2.15 O5 Ti0.3 -","- Al0.4 B4 Fe1.8 Mg8.6 O20 Ti1.2 -","4","0.5","","Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Levashova, Irina O.; Shablinskii, Andrey P.; Cherosov, Mikhail A.; Bubnova, Rimma S.; Vagizov, Farit G.; Krzhizhanovskaya, Maria G.; Filatov, Stanislav K.; Shilovskikh, Vladimir V.; Pekov, Igor V.","X-ray diffraction and Mössbauer spectroscopy study of oxoborate azoproite (Mg,Fe^2+^)~2~(Fe^3+^,Ti,Mg,Al)O~2~(BO~3~): an <i>in situ</i> temperature-dependent investigation (5 {łeq} <i>T</i> {łeq} 1650K)","Acta Crystallographica Section B","2022","78","6","","","10.1107/S2052520622009349","","x-ray","0.71069","MoKα","","0.0601","0.0497","","","0.0679","0.069","","","","3.02","3.02","2.76","","","","has coordinates","278940","2022-11-04","02:49:47",""
"2201833","26.219","0.006","7.4283","0.001","7.3914","0.001","90","","90","","90","","1439.6","0.4","295","","297","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Cs3 O14 Ta5 -","- Cs3 O14 Ta5 -","- Cs12 O56 Ta20 -","4","0.5","BT6274","Douglas du Boulay; Atsuko Oono; Nobuo Ishizawa","A reinvestigation of the structure of Cs~3~Ta~5~O~14~","Acta Crystallographica Section E","2003","59","6","i86","i88","10.1107/S1600536803010122","","","0.71073","MoKα","","0.044","0.044","","0.032","","0.032","","","0.909","","","0.909","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2208745","8.2088","0.0014","18.579","0.004","3.8188","0.0008","90","","90","","90","","582.4","0.2","291","2","291","2","","","","","","","","3","P b a m","-P 2 2ab","55","cerium platinum indide","pentacerium diplatinum tetraindide","","- Ce5 In4 Pt2 -","- Ce5 In4 Pt2 -","- Ce10 In8 Pt4 -","2","0.25","WM2005","Tursina, Anna I.; Kurenbaeva, Zhanaphiya M.; Shtepa, Denis V.; Nesterenko, Sergei N.; Noël, Henri","A new ternary indide, Ce~5~Pt~2~In~4~, with the Lu~5~Ni~2~In~4~ structure type","Acta Crystallographica Section E","2006","62","4","i80","i82","10.1107/S1600536806007264","","","0.71073","MoKα","","0.0588","0.0365","","","0.1014","0.1152","","","","","","0.821","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2213722","16.332","0.002","16.344","0.002","6.5957","0.0012","90","","90","","90","","1760.6","0.4","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","4-Hydroxy-3-iodo-5-methoxybenzaldehyde","","- C8 H7 I O3 -","- C8 H7 I O3 -","- C64 H56 I8 O24 -","8","1","CI2356","Zhou, Qing-Li; Wang, Chang-Lu; Jing, Zuo-Liang","4-Hydroxy-3-iodo-5-methoxybenzaldehyde","Acta Crystallographica Section E","2007","63","6","o2795","o2795","10.1107/S1600536807020983","","","0.71073","MoKα","","0.0311","0.0221","","","0.0493","0.0529","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2227712","11.1013","0.0011","12.6742","0.0012","7.3483","0.0007","90","","90","","90","","1033.91","0.17","100","2","100","2","","","","","","","","5","P b a m","-P 2 2ab","55","","1,1'-(<i>p</i>-Phenylenedimethylene)dipyridinium bis(hexafluoridophosphate)","","- C18 H18 F12 N2 P2 -","- C18 H18 F12 N2 P2 -","- C36 H36 F24 N4 P4 -","2","0.25","JH2207","Abdul Rahim, Munirah Sufiyah; Alias, Yatimah; Ng, Seik Weng","1,1'-(<i>p</i>-Phenylenedimethylene)dipyridinium bis(hexafluoridophosphate)","Acta Crystallographica Section E","2010","66","10","o2653","","10.1107/S1600536810037992","","","0.71073","MoKα","","0.0337","0.029","","","0.084","0.0881","","","","","","1.053","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2238939","7.9488","0.0004","15.1248","0.0008","4.4661","0.0002","90","","90","","90","","536.93","0.05","100","2","100","2","","","","","","","","2","P b a m","-P 2 2ab","55","Lithium Silicide","Tridecalithium tetrasilicide","","- Li13 Si4 -","- Li13 Si4 -","- Li26 Si8 -","2","0.25","WM2778","Zeilinger, Michael; Fässler, Thomas F.","Revision of the Li~13~Si~4~ structure","Acta Crystallographica Section E","2013","69","12","i81","i82","10.1107/S1600536813029759","","","0.71073","MoKα","","0.0155","0.0148","","","0.0433","0.0437","","","","","","1.079","","","","has coordinates,has disorder","176798","2020-10-21","18:00:00",""
"2241363","11.5137","0.0005","12.0584","0.0006","10.3426","0.0004","90","","90","","90","","1435.93","0.11","150","2","150","2","","","","","","","","2","P b a m","-P 2 2ab","55","","Tetracalcium triarsenide","","- As3 Ca4 -","- As3 Ca4 -","- As24 Ca32 -","8","1","RU2065","Hoffmann, Andrea V.; Hlukhyy, Viktor; Fässler, Thomas F.","Ca~4~As~3~ ‒ a new binary calcium arsenide","Acta Crystallographica Section E","2015","71","12","1548","1550","10.1107/S2056989015022367","","","0.71073","MoKα","","0.0991","0.0335","","","0.0481","0.0537","","","","","","0.68","","","","has coordinates,has Fobs","170597","2020-10-21","18:00:00",""
"2300485","6.462","0.002","16.147","0.003","3.988","0.002","90","","90","","90","","416.1","0.3","100","2","100","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Pt7 Sc4 Si2 -","- Pt7 Sc4 Si2 -","- Pt14 Sc8 Si4 -","2","0.25","AJ5242","Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar","Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination","Journal of Applied Crystallography","2015","48","1","","","10.1107/S1600576714022985","","","0.56086","AgKα","","0.0358","0.024","","","0.0459","0.0469","","","","","","1.241","","","","has coordinates,has Fobs","176809","2020-10-21","18:00:00",""
"2300486","6.447","0.002","16.121","0.003","3.982","0.002","90","","90","","90","","413.9","0.3","100","2","100","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Pt7 Sc4 Si2 -","- Pt7 Sc4 Si2 -","- Pt14 Sc8 Si4 -","2","0.25","AJ5242","Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar","Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination","Journal of Applied Crystallography","2015","48","1","","","10.1107/S1600576714022985","","","0.71073","MoKα","","0.0262","0.0257","","","0.0675","0.0678","","","","","","1.286","","","","has coordinates,has Fobs","176809","2020-10-21","18:00:00",""
"2310087","9.14","","12.45","","3.05","","90","","90","","90","","347.069","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Mg3 (Mg0.4 Fe0.6) Fe2 (B2 O10)","","- B2 Fe2.6 Mg3.4 O10 -","- B2 Fe2.6 Mg3.4 O10 -","- B4 Fe5.2 Mg6.8 O20 -","2","0.25","","Ito, T.; Watanabe, T.; Takeuchi, Y.","The crystal structures of warwickite, ludwigite and pinakiolite","Acta Crystallographica (1,1948-23,1967)","1950","3","","98","107","10.1107/S0365110X50000252","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2310454","9.08","","15.519","","2.919","","90","","90","","90","","411.324","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Na Ti2 Al5 O12","","- Al5 Na O12 Ti2 -","- Al5 Na O12 Ti2 -","- Al10 Na2 O24 Ti4 -","2","0.25","","Mumme, W.G.; Wadsley, A.D.","The crystal structure of Na Ti2 Al5 O12","Acta Crystallographica (1,1948-23,1967)","1967","23","","754","758","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310734","13.5","","11.68","","7.74","","90","","90","","90","","1220.44","","","","","","","","","","","","","1","P b a m","-P 2 2ab","55","","(N H4)2 (Zr F6)","","- Zr -","- Zr -","- Zr8 -","8","1","","Bode, H.","Ueber die Kristallstrukturen der Hexafluorozirkonate","Acta Crystallographica (1,1948-23,1967)","1954","7","","637","637","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310785","7.5911","","7.6924","","2.8899","","90","","90","","90","","168.752","","293","","293","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al4.8 O9.6 Si1.2 -","- Al4.8148 O9.5926 Si1.1852 -","- Al4.8148 O9.5926 Si1.1852 -","1","0.125","WF5116","Birkenstock, Johannes; Petříček, Václav; Pedersen, Bjoern; Schneider, Hartmut; Fischer, Reinhard X.","The modulated average structure of mullite.","Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials","2015","71","3","358","368","10.1107/S205252061500757X","","x-ray","0.71073","MoKα","","0.0461","0.0277","","","0.0558","0.0572","","","","3.82","3.82","3.01","","","","has coordinates","201373","2020-10-21","18:00:00",""
"2310786","7.5757","","7.6651","","2.885","","90","","90","","90","","167.528","","293","","293","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al4.78 O9.61 Si1.22 -","- Al4.76 O9.62 Si1.2 -","- Al4.76 O9.62 Si1.2 -","1","0.125","WF5116","Birkenstock, Johannes; Petříček, Václav; Pedersen, Bjoern; Schneider, Hartmut; Fischer, Reinhard X.","The modulated average structure of mullite.","Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials","2015","71","3","358","368","10.1107/S205252061500757X","","neutron","1.0408","X-ray","","0.0504","0.0497","","","0.0668","0.0671","","","","2.68","2.68","2.68","","","","has coordinates","201373","2020-10-21","18:00:00",""
"2312283","9.2532","0.0014","12.3025","0.0018","3.0256","0.0005","90","","90","","90","","344.43","0.09","293","","293","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- Al0.08 B Fe1.183 Mg1.737 O5 -","- Al0.08 B Fe1.1835 Mg1.7365 O5 -","- Al0.32 B4 Fe4.734 Mg6.946 O20 -","4","0.5","","Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Levashova, Irina O.; Shablinskii, Andrey P.; Bubnova, Rimma S.; Vagizov, Farit G.; Ugolkov, Valery L.; Filatov, Stanislav K.; Pekov, Igor V.","Crystal structure refinement, low- and high-temperature X-ray diffraction and Mössbauer spectroscopy study of the oxoborate ludwigite from the Iten'yurginskoe deposit.","Acta crystallographica Section B, Structural science, crystal engineering and materials","2023","79","5","","","10.1107/S2052520623006455","","x-ray","0.71073","MoKα","","0.073","0.0469","","","0.0397","0.0434","","","","1.72","1.72","1.53","","","","has coordinates","286220","2023-09-06","01:45:35",""
"3000233","4.9128","","9.354","","2.773","","90","","90","","90","","127.431","","","","","","","","","","","","","3","P b a m","-P 2 2ab","","Zn2SiO4","","Zn2SiO4 with Pbam","- O4 Si Zn2 -","","","","","","Kanzaki, M.","High-pressure phase relations in Zn2SiO4 system: A first-principles study (DFT optimized Zn2SiO4 structure with Pbam space group at 0 K)","To be published","","","","","","","","","","","","","","","","","","","","","","","","","","","","215368","2020-10-21","18:00:00","2020-04-22"
"3000300","9.42623","","12.3374","","3.09543","","90","","90","","90","","359.984","","293","","293","","","","","","","","","4","P b a m","-P 2 2ab","55","ludwigite","","","- B4 Co10.3 Hf1.7 O20 -","- B4 Co10.2962 Hf1.70384 O20 -","- B4 Co10.2962 Hf1.70384 O20 -","1","0.125","","Mariano, D.L.; Heringer, M.A.V.; Freitas, D.C.; Andrade,V.M.; Saitovitch,E.B.; Continentino, M.A.; Ghivelder, L.; Passamani, E.C.; Sanchez, D.R.","'Metamagnetic transitions induced by doping with non-magnetic 4+ ions in ludwigites Co5A(BO5)2 (A=Zr and Hf)'","Journal of Alloys and Compounds","2022","890","","161717","","","powder diffraction","","","CoKα","","","","","","","","","3.1185","","","","","","","","has coordinates","279404","2022-11-18","19:15:42",""
"3000301","9.41497","0.00013","12.33136","0.00013","3.09365","0.00004","90","","90","","90","","359.171","0.008","293","","293","","","","","","","","","4","P b a m","-P 2 2ab","55","ludwigite","","","- B4 Co10.33 O20 Zr1.67 -","- B4 Co10.3291 O20 Zr1.67088 -","- B4 Co10.3291 O20 Zr1.67088 -","1","0.125","","Mariano, D.L.; Heringer, M.A.V.; Freitas, D.C.; Andrade,V.M.; Saitovitch,E.B.; Continentino, M.A.; Ghivelder, L.; Passamani, E.C.; Sanchez, D.R.","'Metamagnetic transitions induced by doping with non-magnetic 4+ ions in ludwigites Co5A(BO5)2 (A=Zr and Hf)'","Journal of Alloys and Compounds","2022","890","","161717","","","powder diffraction","","","CoKα","","","","","","","","","3.465","","","","","","","","has coordinates","279405","2022-11-18","19:18:09",""
"4000446","5.4747","0.0002","5.4747","0.0002","28.8137","0.0012","90","","90","","90","","863.61","0.06","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","strontium rhodium oxide","","","- O10 Rh3 Sr4 -","- O10 Rh3 Sr4 -","- O40 Rh12 Sr16 -","4","0.5","","","","Chemistry of Materials","2004","","","","","10.1021/cm0491072","","","","","","","","","","","","","","","","","","","","","has coordinates","277839","2022-09-14","18:07:03",""
"4000447","5.4935","0.0005","5.4935","0.0005","28.8004","0.0026","90","","90","","90","","869.15","0.14","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","strontium rhodium oxide","","","- O10 Rh3 Sr4 -","- O10 Rh3 Sr4 -","- O40 Rh12 Sr16 -","4","0.5","","","","Chemistry of Materials","2004","","","","","10.1021/cm0491072","","","","","","","","","","","","","","","","","","","","","has coordinates","277839","2022-09-14","18:07:03",""
"4000929","22.014","0.0017","12.2313","0.001","4.6081","0.0004","90","","90","","90","","1240.78","0.18","90","2","90","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Mn4.18 Sb9 Yb9 -","- Mn4.18 Sb9 Yb9 -","- Mn8.36 Sb18 Yb18 -","2","0.25","","Xia, Sheng-Qing; Bobev, Svilen","New Manganese-Bearing Antimonides and Bismuthides with Complex Structures. Synthesis, Structural Characterization, and Electronic Properties of Yb9Mn4+xPn9(Pn= Sb or Bi)†","Chemistry of Materials","2010","22","3","840","","10.1021/cm901633r","","","0.71073","MoKα","","0.0299","0.0241","","","0.0525","0.0549","","","","","","1.067","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000930","21.668","0.002","12.3168","0.0012","4.5234","0.0004","90","","90","","90","","1207.21","0.19","90","2","90","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Sb9 Yb9 Zn4.18 -","- Sb9 Yb9 Zn4.172 -","- Sb18 Yb18 Zn8.344 -","2","0.25","","Xia, Sheng-Qing; Bobev, Svilen","New Manganese-Bearing Antimonides and Bismuthides with Complex Structures. Synthesis, Structural Characterization, and Electronic Properties of Yb9Mn4+xPn9(Pn= Sb or Bi)†","Chemistry of Materials","2010","22","3","840","","10.1021/cm901633r","","","0.71073","MoKα","","0.028","0.0243","","","0.0587","0.0599","","","","","","1.126","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000931","21.874","0.003","12.2929","0.0014","4.5796","0.0005","90","","90","","90","","1231.4","0.3","90","2","120","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Mn2.78 Sb9 Yb9 Zn1.63 -","- Mn2.76 Sb9 Yb9 Zn1.616 -","- Mn5.52 Sb18 Yb18 Zn3.232 -","2","0.25","","Xia, Sheng-Qing; Bobev, Svilen","New Manganese-Bearing Antimonides and Bismuthides with Complex Structures. Synthesis, Structural Characterization, and Electronic Properties of Yb9Mn4+xPn9(Pn= Sb or Bi)†","Chemistry of Materials","2010","22","3","840","","10.1021/cm901633r","","","0.71073","MoKα","","0.0385","0.0276","","","0.0565","0.0606","","","","","","1.095","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000932","21.7391","0.0019","12.3474","0.0011","4.5384","0.0004","90","","90","","90","","1218.2","0.19","90","2","120","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Mn0.45 Sb9 Yb9 Zn3.9 -","- Mn0.46 Sb9 Yb9 Zn3.88 -","- Mn0.92 Sb18 Yb18 Zn7.76 -","2","0.25","","Xia, Sheng-Qing; Bobev, Svilen","New Manganese-Bearing Antimonides and Bismuthides with Complex Structures. Synthesis, Structural Characterization, and Electronic Properties of Yb9Mn4+xPn9(Pn= Sb or Bi)†","Chemistry of Materials","2010","22","3","840","","10.1021/cm901633r","","","0.71073","MoKα","","0.0395","0.0311","","","0.074","0.0781","","","","","","1.046","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4000933","22.265","0.002","12.4098","0.0013","4.707","0.0005","90","","90","","90","","1300.6","0.2","90","2","90","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Mn4 Yb9 -","- Bi9 Mn4 Yb9 -","- Bi18 Mn8 Yb18 -","2","0.25","","Xia, Sheng-Qing; Bobev, Svilen","New Manganese-Bearing Antimonides and Bismuthides with Complex Structures. Synthesis, Structural Characterization, and Electronic Properties of Yb9Mn4+xPn9(Pn= Sb or Bi)†","Chemistry of Materials","2010","22","3","840","","10.1021/cm901633r","","","0.71073","MoKα","","0.0278","0.026","","","0.068","0.0687","","","","","","1.098","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000934","22.367","0.005","12.499","0.003","4.706","0.001","90","","90","","90","","1315.6","0.5","90","2","90","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Ca9 Mn4 -","- Bi9 Ca9 Mn4 -","- Bi18 Ca18 Mn8 -","2","0.25","","Xia, Sheng-Qing; Bobev, Svilen","New Manganese-Bearing Antimonides and Bismuthides with Complex Structures. Synthesis, Structural Characterization, and Electronic Properties of Yb9Mn4+xPn9(Pn= Sb or Bi)†","Chemistry of Materials","2010","22","3","840","","10.1021/cm901633r","","","0.71073","MoKα","","0.0275","0.0231","","","0.0509","0.052","","","","","","1.078","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001120","5.5786","0.0016","10.9046","0.0032","3.8684","0.0011","90","","90","","90","","235.32","0.12","773","5","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- La0.4 Mn4 O10.2 Sr3.6 -","- La0.4 Mn4 O10.2 Sr3.6 -","- La0.4 Mn4 O10.2 Sr3.6 -","1","0.125","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001121","5.5902","0.001","10.8814","0.0019","3.8793","0.0007","90","","90","","90","","235.97","0.07","773","5","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- La0.2 Mn2 O5 Sr1.8 -","- La0.2 Mn2 O5 Sr1.8 -","- La0.4 Mn4 O10 Sr3.6 -","2","0.25","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001122","5.60595","0.00012","10.92454","0.00025","3.88944","0.00011","90","","90","","90","","238.199","0.01","973","5","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- La0.2 Mn4 O5 Sr1.8 -","- La0.2 Mn2 O5 Sr1.8 -","- La0.4 Mn4 O10 Sr3.6 -","2","0.25","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001126","5.5674","0.0021","10.798","0.004","3.8903","0.0014","90","","90","","90","","233.87","0.15","573","5","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- La0.4 Mn2 O5 Sr1.6 -","- La0.4 Mn2 O5 Sr1.6 -","- La0.8 Mn4 O10 Sr3.2 -","2","0.25","","Suescun, Leopoldo; Dabrowski, Bogdan; Mais, James; Remsen, Steven; Richardson, James W.; Maxey, Evan R.; Jorgensen, James D.","Oxygen Ordered Phases in LaxSr1−xMnOy(0 ≤x≤ 0.2, 2.5 ≤ y ≤ 3): An In situ Neutron Powder Diffraction Study","Chemistry of Materials","2008","20","4","1636","","10.1021/cm703139c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001181","15.298","0.002","38.847","0.004","7.83","0.001","90","","90","","90","","4653.2","1","298","","298","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ag19 Br7 Se0.961 Te5.039 -","- Ag19.0173 Br7 Se0.96 Te5.04 -","- Ag114.104 Br42 Se5.76 Te30.24 -","6","0.75","","Nilges, Tom; Messel, Julia; Bawohl, Melanie; Lange, Stefan","Silver(I) Chalcogenide Halides Ag19Te6Br7, Ag19Te6Br5.4I1.6, and Ag19Te5SeBr7","Chemistry of Materials","2008","20","12","4080","","10.1021/cm800425u","","","0.71073","MoKα","","0.2469","0.022","","","0.0216","0.0503","","","","0.43","0.43","0.47","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002011","5.905","0.0001","11.444","0.0002","3.51","0.0004","90","","90","","90","","237.19","0.03","299","2","299","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al1.33 B5.33 Lu1.33 -","- Al1.33333 B5.33333 Lu1.33333 -","- Al4 B16 Lu4 -","3","0.375","","Macaluso, Robin T.; Nakatsuji, Satoru; Kuga, Kentaro; Thomas, Evan Lyle; Machida, Yo; Maeno, Yoshiteru; Fisk, Zachary; Chan, Julia Y.","Crystal Structure and Physical Properties of Polymorphs of LnAlB4(Ln = Yb, Lu)","Chemistry of Materials","2007","19","8","1918","","10.1021/cm062244+","","","0.71073","MoKα","","0.0257","0.0249","","","0.0624","0.063","","","","","","1.234","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002012","5.922","0.0002","11.473","0.0003","3.506","0.0005","90","","90","","90","","238.21","0.04","298","2","298","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al B4 Yb -","- Al B4 Yb -","- Al4 B16 Yb4 -","4","0.5","","Macaluso, Robin T.; Nakatsuji, Satoru; Kuga, Kentaro; Thomas, Evan Lyle; Machida, Yo; Maeno, Yoshiteru; Fisk, Zachary; Chan, Julia Y.","Crystal Structure and Physical Properties of Polymorphs of LnAlB4(Ln = Yb, Lu)","Chemistry of Materials","2007","19","8","1918","","10.1021/cm062244+","","","0.71073","MoKα","","0.0573","0.053","","","0.1368","0.1423","","","","","","0.996","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002741","11.962","0.006","13.929","0.008","4.427","0.002","90","","90","","90","","737.6","0.7","273","2","273","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al2 Ca3.6 Sb6 Yb1.4 -","- Al2 Ca3.6 Sb6 Yb1.4 -","- Al4 Ca7.2 Sb12 Yb2.8 -","2","0.25","","Nam, Gnu; Choi, Woongjin; Jo, Hongil; Ok, Kang Min; Ahn, Kyunghan; You, Tae-Soo","Influence of Thermally Activated Solid-State Crystal-to-Crystal Structural Transformation on the Thermoelectric Properties of the Ca5‒xYbxAl2Sb6 (1.0 ≤ x ≤ 5.0) System","Chemistry of Materials","2017","29","3","1384","","10.1021/acs.chemmater.6b05281","","","0.71073","MoKα","","0.0454","0.0321","","","0.0753","0.0825","","","","","","1.134","","","","has coordinates","192864","2020-10-21","18:00:00",""
"4002742","12.0006","0.0003","13.9925","0.0004","4.4457","0.0001","90","","90","","90","","746.51","0.03","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al2 Ca1.55 Sb6 Yb3.45 -","- Al2 Ca1.553 Sb6 Yb3.447 -","- Al4 Ca3.106 Sb12 Yb6.894 -","2","0.25","","Nam, Gnu; Choi, Woongjin; Jo, Hongil; Ok, Kang Min; Ahn, Kyunghan; You, Tae-Soo","Influence of Thermally Activated Solid-State Crystal-to-Crystal Structural Transformation on the Thermoelectric Properties of the Ca5‒xYbxAl2Sb6 (1.0 ≤ x ≤ 5.0) System","Chemistry of Materials","2017","29","3","1384","","10.1021/acs.chemmater.6b05281","","","0.71073","MoKα","","0.0284","0.0217","","","0.0394","0.0408","","","","","","1.127","","","","has coordinates","192865","2020-10-21","18:00:00",""
"4002743","12.0321","0.0002","14.023","0.0003","4.4532","0.0001","90","","90","","90","","751.37","0.03","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al2 Ca2.79 Sb6 Yb2.22 -","- Al2 Ca2.784 Sb6 Yb2.216 -","- Al4 Ca5.568 Sb12 Yb4.432 -","2","0.25","","Nam, Gnu; Choi, Woongjin; Jo, Hongil; Ok, Kang Min; Ahn, Kyunghan; You, Tae-Soo","Influence of Thermally Activated Solid-State Crystal-to-Crystal Structural Transformation on the Thermoelectric Properties of the Ca5‒xYbxAl2Sb6 (1.0 ≤ x ≤ 5.0) System","Chemistry of Materials","2017","29","3","1384","","10.1021/acs.chemmater.6b05281","","","0.71073","MoKα","","0.0225","0.0214","","","0.0536","0.0541","","","","","","1.219","","","","has coordinates","192866","2020-10-21","18:00:00",""
"4002744","7.3254","0.0006","22.9041","0.0017","4.4094","0.0004","90","","90","","90","","739.82","0.11","273","2","273","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al2 Ca1.58 Sb6 Yb3.42 -","- Al2 Ca1.586 Sb6 Yb3.414 -","- Al4 Ca3.172 Sb12 Yb6.828 -","2","0.25","","Nam, Gnu; Choi, Woongjin; Jo, Hongil; Ok, Kang Min; Ahn, Kyunghan; You, Tae-Soo","Influence of Thermally Activated Solid-State Crystal-to-Crystal Structural Transformation on the Thermoelectric Properties of the Ca5‒xYbxAl2Sb6 (1.0 ≤ x ≤ 5.0) System","Chemistry of Materials","2017","29","3","1384","","10.1021/acs.chemmater.6b05281","","","0.71073","MoKα","","0.0327","0.03","","","0.0624","0.0643","","","","","","1.212","","","","has coordinates","192867","2020-10-21","18:00:00",""
"4003091","12.4552","0.0009","22.1","0.0015","4.6212","0.0003","90","","90","","90","","1272.03","0.15","200","2","200","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ca8.27 La0.73 Mn4 Sb9 -","- Ca8.276 La0.724 Mn4 Sb9 -","- Ca16.552 La1.448 Mn8 Sb18 -","2","0.25","","Wang, Yi; Bobev, Svilen","Rare-Earth Metal Substitutions in Ca9‒xRExMn4Sb9 (RE = La‒Nd, Sm; x ≈ 1). Synthesis and Characterization of a New Series of Narrow-Gap Semiconductors","Chemistry of Materials","2018","30","10","3518","","10.1021/acs.chemmater.8b01316","","","0.71073","MoKα","","0.0309","0.0241","","","0.0505","0.0531","","","","","","1.043","","","","has coordinates","226201","2020-10-21","18:00:00",""
"4003092","12.4347","0.0006","22.0664","0.001","4.6189","0.0002","90","","90","","90","","1267.38","0.1","200","2","200","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ca8.16 Ce0.84 Mn4 Sb9 -","- Ca8.168 Ce0.832 Mn4 Sb9 -","- Ca16.336 Ce1.664 Mn8 Sb18 -","2","0.25","","Wang, Yi; Bobev, Svilen","Rare-Earth Metal Substitutions in Ca9‒xRExMn4Sb9 (RE = La‒Nd, Sm; x ≈ 1). Synthesis and Characterization of a New Series of Narrow-Gap Semiconductors","Chemistry of Materials","2018","30","10","3518","","10.1021/acs.chemmater.8b01316","","","0.71073","MoKα","","0.0245","0.0205","","","0.0458","0.0473","","","","","","1.102","","","","has coordinates","226201","2020-10-21","18:00:00",""
"4003093","12.4143","0.0011","22.059","0.002","4.6139","0.0004","90","","90","","90","","1263.5","0.19","200","2","200","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ca8.15 Mn4 Pr0.85 Sb9 -","- Ca8.156 Mn4 Pr0.844 Sb9 -","- Ca16.312 Mn8 Pr1.688 Sb18 -","2","0.25","","Wang, Yi; Bobev, Svilen","Rare-Earth Metal Substitutions in Ca9‒xRExMn4Sb9 (RE = La‒Nd, Sm; x ≈ 1). Synthesis and Characterization of a New Series of Narrow-Gap Semiconductors","Chemistry of Materials","2018","30","10","3518","","10.1021/acs.chemmater.8b01316","","","0.71073","MoKα","","0.0359","0.0279","","","0.0576","0.0608","","","","","","1.051","","","","has coordinates","226201","2020-10-21","18:00:00",""
"4003094","12.4062","0.0009","22.0551","0.0015","4.612","0.0003","90","","90","","90","","1261.94","0.15","200","2","200","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ca8.11 Mn4 Nd0.89 Sb9 -","- Ca8.132 Mn4 Nd0.868 Sb9 -","- Ca16.264 Mn8 Nd1.736 Sb18 -","2","0.25","","Wang, Yi; Bobev, Svilen","Rare-Earth Metal Substitutions in Ca9‒xRExMn4Sb9 (RE = La‒Nd, Sm; x ≈ 1). Synthesis and Characterization of a New Series of Narrow-Gap Semiconductors","Chemistry of Materials","2018","30","10","3518","","10.1021/acs.chemmater.8b01316","","","0.71073","MoKα","","0.0288","0.0242","","","0.0532","0.0549","","","","","","1.096","","","","has coordinates","226201","2020-10-21","18:00:00",""
"4003095","12.3883","0.0005","22.0164","0.001","4.6077","0.0002","90","","90","","90","","1256.73","0.09","200","2","200","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ca7.88 Mn4 Sb9 Sm1.12 -","- Ca7.873 Mn4 Sb9 Sm1.127 -","- Ca15.746 Mn8 Sb18 Sm2.254 -","2","0.25","","Wang, Yi; Bobev, Svilen","Rare-Earth Metal Substitutions in Ca9‒xRExMn4Sb9 (RE = La‒Nd, Sm; x ≈ 1). Synthesis and Characterization of a New Series of Narrow-Gap Semiconductors","Chemistry of Materials","2018","30","10","3518","","10.1021/acs.chemmater.8b01316","","","0.71073","MoKα","","0.0287","0.0244","","","0.0535","0.0557","","","","","","1.055","","","","has coordinates","226201","2020-10-21","18:00:00",""
"4030868","23.783","0.005","15.781","0.005","4.052","0.001","90","","90","","90","","1520.8","0.7","","","293","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- In18.88 Pb7.12 Se34 -","- In18.88 Pb7.12 Se34 -","- In18.88 Pb7.12 Se34 -","1","0.125","","Eddike, D.; Ramdani, A.; Brun, G.; Liautard, B.; Tedenac, J. C.; Tillard, M.; Belin, C.","Crystal structure of Pb7.12In18.88Se34","European Journal of Solid State and Inorganic Chemistry","1997","34","","309","316","","","x-ray","0.71073","MoKα","","","0.067","","","","","","","","","","","","","","has coordinates","178487","2020-10-21","18:00:00",""
"4030947","28","0.003","8.7129","0.0009","7.2091","0.0007","90","","90","","90","","1758.7","0.3","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","E-(CF3,CO2Me)2 TTF","Trans-4,4'-bis(trifluoromethyl)-5,5'-bis(methoxycarbonyl)tetrathiafulvalene","","- C12 H6 F6 O4 S4 -","- C12 H6 F6 O4 S4 -","- C48 H24 F24 O16 S16 -","4","0.5","","Jeannin, Olivier; Barrière, Frédéric; Fourmigué, Marc","Trifluoromethyl-substituted tetrathiafulvalenes.","Beilstein journal of organic chemistry","2015","11","","647","658","10.3762/bjoc.11.73","","","0.71073","MoKα","","0.1057","0.0342","","","0.053","0.0647","","","","","","0.767","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031256","7.2793","","8.506","","5.621","","90","","90","","90","","348.04","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Ho Fe0.92 Mn1.08 O4.74","","- Fe0.92 Ho Mn1.08 O4.74 -","- Fe0.92 Ho Mn1.08 O4.75 -","- Fe3.68 Ho4 Mn4.32 O19 -","4","0.5","","Munoz, A.; Alonso, J.A.; Martinez-Lope, M.J.; Martinez, J.L.","Synthesis and study of the crystallographic and magnetic structure of Ho Fe Mn O3","European Journal of Inorganic Chemistry","2007","2007","","1972","1979","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031418","13.245","","13.223","","9.266","","90","","90","","90","","1622.83","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Se4 (Al Cl4)2","","- Al2 Cl8 Se4 -","- Al2 Cl8 Se4 -","- Al8 Cl32 Se16 -","4","0.5","","Cardinal, G.; Gillespie, R.J.; Sawyer, J.F.; Vekris, J.E.","Charge-transfer interactions in the square-planar chalcogen cations, M4(2+), preparation and crystal structures of the compounds (Se4) (Sb2 F4) (Sb2 F5) (Sb F6)5, (Se4) (Al Cl4)2 and (Te4) (Sb F6)2","Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-)","1982","1982","","765","779","","","","","","","","","","","","","","","","","","","","","","has coordinates","154324","2020-10-21","18:00:00",""
"4031523","6.949","","19.71","","7.3955","","90","","90","","90","","1012.92","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","Cs2 U7 O22","","- Cs2 U7 -","- Cs2 U7 -","- Cs4 U14 -","2","0.25","","van Egmond, A.B.","Investigations on Cesium Uranates - V. The Crystal Structures of (Cs2 U O4), (Cs4 U5 O17), (Cs2 U7 O22) and (Cs2 U15 O46)","Journal of Inorganic and Nuclear Chemistry","1976","38","","1649","1651","","","","","","","","","","","","","","","","","","","","","","has coordinates","158064","2020-10-21","18:00:00",""
"4033490","29.4324","0.0013","26.5753","0.0012","6.9714","0.0004","90","","90","","90","","5452.9","0.5","293.59","0.1","293.59","0.1","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C28 H29 N O2 S -","- C28 H29 N O2 S -","- C224 H232 N8 O16 S8 -","8","1","","Witalewska, Marzena; Wrona-Piotrowicz, Anna; Makal, Anna; Zakrzewski, Janusz","Polycyclic Aromatic N-Ethoxycarbonyl Thioamide S-Oxides and Their Triflic Acid Promoted Cyclization to Fluorescent Thiophene Imine-Fused Arenes.","The Journal of organic chemistry","2018","83","4","1933","1939","10.1021/acs.joc.7b02867","","x-ray","1.54184","CuKα","","0.1208","0.0905","","","0.2444","0.2668","","","","","","1.059","","","","has coordinates,has disorder","227536","2020-10-21","18:00:00",""
"4081849","14.1671","0.0003","20.0121","0.0005","9.5338","0.0002","90","","90","","90","","2702.96","0.11","85","2","85","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C10 H14 B12 Cl11 N -","- C10 H14 B12 Cl11 N -","- C40 H56 B48 Cl44 N4 -","4","0.5","","Prokofjevs, Aleksandrs; Jermaks, Janis; Borovika, Alina; Kampf, Jeff W.; Vedejs, Edwin","Electrophilic C‒H Borylation and Related Reactions of B‒H Boron Cations","Organometallics","2013","32","22","6701","","10.1021/om400651p","","","0.71073","MoKα","","0.057","0.0398","","","0.0923","0.1005","","","","","","1.039","","","","has coordinates,has disorder","178707","2020-10-21","18:00:00",""
"4102346","13.7","0.003","21.05","0.004","11.72","0.002","90","","90","","90","","3379.9","1.1","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C18 H13 Cd N3 O4 -","- C18 H13 Cd N3 O4 -","- C72 H52 Cd4 N12 O16 -","4","0.5","","Hai-Long Jiang; Yoshiro Tatsu; Zhang-Hui Lu; Qiang Xu","Non-, Micro-, and Mesoporous Metal-Organic Framework Isomers: Reversible Transformation, Fluorescence Sensing, and Large Molecule Separation","Journal of the American Chemical Society","2010","132","","5586","5587","10.1021/ja101541s","","","0.71073","MoKα","","0.0622","0.0443","","","0.1022","0.1065","","","","","","0.805","","","","has coordinates,has disorder","178769","2020-10-21","18:00:00",""
"4105402","12.9491","0.0005","21.29","0.0006","11.6829","0.0005","90","","90","","90","","3220.8","0.2","100","2","100","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C18 H12 Cd N2 O4 -","- C18 H12 Cd N2 O4 -","- C72 H48 Cd4 N8 O16 -","4","0.5","","JianJun Zhang; Lukasz Wojtas; Randy W. Larsen; Mohamed Eddaoudi; Michael J. Zaworotko","Temperature and Concentration Control over Interpenetration in a Metal-Organic Material","Journal of the American Chemical Society","2009","131","","17040","17041","10.1021/ja906911q","","","1.54178","CuKα","","0.057","0.0428","","","0.1033","0.1081","","","","","","1.019","","","","has coordinates","178800","2020-10-21","18:00:00",""
"4109759","23.181","0.002","13.0498","0.0013","4.795","0.0005","90","","90","","90","","1450.5","0.2","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Cd4.49 Sb9 Sr9 -","- Cd4.492 Sb9 Sr9 -","- Cd8.984 Sb18 Sr18 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0299","0.0263","","","0.0516","0.0526","","","","","","1.148","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109760","22.499","0.003","12.7079","0.0019","4.7229","0.0007","90","","90","","90","","1350.3","0.3","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Ca9 Cd4.06 -","- Bi9 Ca9 Cd4.058 -","- Bi18 Ca18 Cd8.116 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0291","0.0279","","","0.0618","0.0623","","","","","","1.185","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109761","22.426","0.003","12.629","0.0018","4.72","0.0007","90","","90","","90","","1336.8","0.3","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Cd4 Yb9 -","- Bi9 Cd4.012 Yb9 -","- Bi18 Cd8.024 Yb18 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0412","0.0367","","","0.0731","0.0744","","","","","","1.255","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109762","23.402","0.004","13.186","0.002","4.8906","0.0009","90","","90","","90","","1509.1","0.4","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Cd4.27 Sr9 -","- Bi9 Cd4.266 Sr9 -","- Bi18 Cd8.532 Sr18 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0495","0.0409","","","0.0818","0.0851","","","","","","1.168","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109763","23.1615","0.0015","13.0114","0.0009","4.8588","0.0003","90","","90","","90","","1464.27","0.17","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Cd4.21 Eu9 -","- Bi9 Cd4.21 Eu9 -","- Bi18 Cd8.42 Eu18 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0286","0.0266","","","0.0552","0.0561","","","","","","1.137","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109764","21.997","0.003","12.5243","0.0014","4.6283","0.0005","90","","90","","90","","1275.1","0.3","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Yb9 Zn4.03 -","- Bi9 Yb9 Zn4.028 -","- Bi18 Yb18 Zn8.056 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0486","0.0362","","","0.0813","0.0856","","","","","","1.091","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109765","22.0688","0.0016","12.5898","0.0006","4.6336","0.0004","90","","90","","90","","1287.41","0.16","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Ca9 Zn4.09 -","- Bi9 Ca9 Zn4.102 -","- Bi18 Ca18 Zn8.204 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0187","0.0174","","","0.0394","0.0397","","","","","","1.218","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4114807","9.184","0.002","17.409","0.004","18.815","0.004","90","0.03","90","0.03","90","0.03","3008.2","1.1","140","2","140","2","","","","","","","","4","P b a m","-P 2 2ab","55","[Au(2-py)]3","","","- C15 H12 Au3 N3 -","- C15 H12 Au3 N3 -","- C120 H96 Au24 N24 -","8","1","","Akari Hayashi; Marilyn M. Olmstead; Saeed Attar; Alan L. Balch","Crystal Chemistry of the Gold (I) Trimer, Au3(NC5H4)3: Formation of Hourglass Figures and Self-Association through Aurophilic Attraction","Journal of the American Chemical Society","2002","124","","5791","5795","10.1021/ja012416y","","","0.71073","MoKα","","0.1133","0.0523","","","0.1266","0.1545","","","","","","1.037","","","","has coordinates,has disorder","178919","2020-10-21","18:00:00",""
"4114918","12.689","0.003","14.915","0.003","6.9835","0.0014","90","","90","","90","","1321.7","0.5","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- Cs2 H2 O12 Si4 V -","- Cs2.013 O12.176 Si4 V -","- Cs8.052 O48.704 Si16 V4 -","4","0.5","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.1314","0.1131","","","0.2378","0.2443","","","","","","1.261","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4114919","12.859","0.003","14.911","0.004","7.078","0.002","90","","90","","90","","1357.1","0.6","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- H5.5 Li2 O13.75 Si4 V -","- Li1.99 O13.8 Si4 V -","- Li7.96 O55.2 Si16 V4 -","4","0.5","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.2733","0.0868","","","0.209","0.2708","","","","","","0.879","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4115854","12.5705","0.0013","22.028","0.002","4.6401","0.0005","90","","90","","90","","1284.9","0.2","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Yb9 Zn4 -","- Bi9 Yb9 Zn4 -","- Bi18 Yb18 Zn8 -","2","0.25","","Sung-Jin Kim; Jim Salvador; Daniel Bilc; S. D. Mahanti; Mercouri G. Kanatzidis","Yb9Zn4Bi9: Extension of the Zintl Concept to the Mixed-Valent Spectator Cations","Journal of the American Chemical Society","2001","123","","12704","12705","10.1021/ja0168965","","","0.71073","MoKα","","0.0436","0.0378","","","0.1331","0.1364","","","","","","1.087","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4118395","7.875","0.003","14.873","0.005","4.5444","0.0015","90","","90","","90","","532.3","0.3","200","2","200","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ca0.68 Eu1.32 Ge2 Pb -","- Ca0.676 Eu1.324 Ge2 Pb -","- Ca2.704 Eu5.296 Ge8 Pb4 -","4","0.5","","Nian-Tzu Suen; James Hooper; Eva Zurek; Svilen Bobev","On the Nature of Ge-Pb Bonding in the Solid State. Synthesis, Structural Characterization, and Electronic Structures of Two Unprecedented Germanide-Plumbides","Journal of the American Chemical Society","2012","134","","12708","12716","10.1021/ja3042838","","","0.71073","MoKα","","0.0203","0.0182","","","0.0378","0.0385","","","","","","1.034","","","","has coordinates","178954","2020-10-21","18:00:00",""
"4128420","22.959","0.002","9.4933","0.0008","18.771","0.002","90","","90","","90","","4091.3","0.7","173","2","173","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C36 H60 B2 K2 O12 -","- C36 H60 B2 K2 O12 -","- C144 H240 B8 K8 O48 -","4","0.5","","von Grotthuss, Esther; Prey, Sven E.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Dual Role of Doubly Reduced Arylboranes as Dihydrogen- and Hydride-Transfer Catalysts.","Journal of the American Chemical Society","2019","141","14","6082","6091","10.1021/jacs.9b01998","","","0.71073","MoKα","","0.1055","0.0422","","","0.0586","0.0699","","","","","","0.872","","","","has coordinates","221533","2020-10-21","18:00:00",""
"4129325","18.0006","0.0013","22.0279","0.0015","11.4933","0.0008","90","","90","","90","","4557.3","0.6","102","2","102","2","","","","","","","","8","P b a m","-P 2 2ab","55","","","","- C24 H41 F12 Fe N7 O13 S4 Sc -","- C24 H41 F12 Fe N7 O13 S4 Sc -","- C96 H164 F48 Fe4 N28 O52 S16 Sc4 -","4","0.5","","Prakash, Jai; Rohde, Gregory T.; Meier, Katlyn K.; Jasniewski, Andrew J.; Van Heuvelen, Katherine M.; Münck, Eckard; Que, Jr, Lawrence","Spectroscopic identification of an Fe(III) center, not Fe(IV), in the crystalline Sc-O-Fe adduct derived from [Fe(IV)(O)(TMC)]²⁺.","Journal of the American Chemical Society","2015","137","10","3478","3481","10.1021/jacs.5b00535","","","0.71073","MoKα","","0.108","0.0791","","","0.1984","0.2196","","","","","","1.043","","","","has coordinates,has disorder","240060","2020-10-21","18:00:00",""
"4302187","7.2971","0.0015","22.78","0.005","4.4115","0.0009","90","","90","","90","","733.3","0.3","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","Yb5Al2Sb6","","","- Al2 Sb6 Yb5 -","- Al2 Sb6 Yb5 -","- Al4 Sb12 Yb10 -","2","0.25","","Iliya Todorov; Duck Young Chung; Linhui Ye; Arthur J. Freeman; Mercouri G. Kanatzidis","Synthesis, Structure and Charge Transport Properties of Yb5Al2Sb6: A Zintl Phase with Incomplete Electron Transfer","Inorganic Chemistry","2009","48","","4768","4776","10.1021/ic900035a","","","0.71073","MoKα","","0.0331","0.0299","","","0.0704","0.0717","","","","","","1.139","","","","has coordinates","179059","2020-10-21","18:00:00",""
"4302188","7.3313","0.0015","23.118","0.005","4.4497","0.0009","90","","90","","90","","754.2","0.3","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","Sr0.85Yb4.15Al2Sb6","","","- Al2 Sb6 Sr0.85 Yb4.15 -","- Al2 Sb6 Sr0.856 Yb4.144 -","- Al4 Sb12 Sr1.712 Yb8.288 -","2","0.25","","Iliya Todorov; Duck Young Chung; Linhui Ye; Arthur J. Freeman; Mercouri G. Kanatzidis","Synthesis, Structure and Charge Transport Properties of Yb5Al2Sb6: A Zintl Phase with Incomplete Electron Transfer","Inorganic Chemistry","2009","48","","4768","4776","10.1021/ic900035a","","","0.71073","MoKα","","0.0369","0.0342","","","0.0884","0.0899","","","","","","1.094","","","","has coordinates","179059","2020-10-21","18:00:00",""
"4302601","21.722","0.004","27.14","0.005","4.0621","0.0008","90","","90","","90","","2394.8","0.8","298","2","298","2","","","","","","","","4","P b a m","-P 2 2ab","55","","indium lead antimony selenide (2/4/4/13)","","- In2 Pb4 Sb4 Se13 -","- In2 Pb4 Sb4 Se13 -","- In8 Pb16 Sb16 Se52 -","4","0.5","","Chi-Shen Lee; Ming-Fang Wang; Wen-Hen Huang","Synthesis and Phase Width of Quaternary Selenides Pb4InxM6-xSe13 (M = Bi,x= 2.1-2.8; Sb,x= 2)","Inorganic Chemistry","2009","48","","6402","6408","10.1021/ic8023875","","x-ray","0.71073","MoKα","","0.0864","0.0576","","","0.1247","0.1339","","","","","","1.201","","","","has coordinates","179064","2020-10-21","18:00:00",""
"4302602","22.273","0.005","27.488","0.006","4.1418","0.0008","90","","90","","90","","2535.8","0.9","298","2","298","2","","","","","","","","4","P b a m","-P 2 2ab","55","","bismuth indium lead selenide(3.9/2.1/4/13)","","- Bi3.9 In2.1 Pb4 Se13 -","- Bi3.902 In2.098 Pb4 Se13 -","- Bi15.608 In8.392 Pb16 Se52 -","4","0.5","","Chi-Shen Lee; Ming-Fang Wang; Wen-Hen Huang","Synthesis and Phase Width of Quaternary Selenides Pb4InxM6-xSe13 (M = Bi,x= 2.1-2.8; Sb,x= 2)","Inorganic Chemistry","2009","48","","6402","6408","10.1021/ic8023875","","","0.71073","MoKα","","0.0398","0.0315","","","0.0676","0.07","","","","","","1.168","","","","has coordinates","179064","2020-10-21","18:00:00",""
"4302603","22.065","0.004","27.42","0.006","4.1272","0.0008","90","","90","","90","","2497","0.9","298","2","298","2","","","","","","","","4","P b a m","-P 2 2ab","55","","bismuth indium lead selenide (3.2/2.8/4/13)","","- Bi3.2 In2.8 Pb4 Se13 -","- Bi3.2055 In2.7945 Pb4 Se13 -","- Bi12.822 In11.178 Pb16 Se52 -","4","0.5","","Chi-Shen Lee; Ming-Fang Wang; Wen-Hen Huang","Synthesis and Phase Width of Quaternary Selenides Pb4InxM6-xSe13 (M = Bi,x= 2.1-2.8; Sb,x= 2)","Inorganic Chemistry","2009","48","","6402","6408","10.1021/ic8023875","","x-ray","0.71073","MoKα","","0.0447","0.0365","","","0.0877","0.0918","","","","","","1.141","","","","has coordinates","179064","2020-10-21","18:00:00",""
"4304120","20.0535","0.0006","12.12","0.0005","15.0831","0.0006","90","","90","","90","","3665.9","0.2","200","2","200","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C8 H12 Li N4 P Se4 -","- C8 H12 Li N4 P Se4 -","- C64 H96 Li8 N32 P8 Se32 -","8","1","","Christiane Rotter; Michael Schuster; Mustafa Kidik; Oliver Schön; Thomas M. Klapötke; Konstantin Karaghiosoff","Structural and NMR Spectroscopic Investigations of Chair and Twist Conformers of the P2Se82- Anion","Inorganic Chemistry","2008","47","","1663","1673","10.1021/ic7015534","","","0.71073","MoKα","","0.1207","0.1075","","","0.1295","0.1342","","","","","","1.364","","","","has coordinates","179079","2020-10-21","18:00:00",""
"4307200","9.0036","0.0016","11.703","0.002","3.9092","0.0007","90","","90","","90","","411.91","0.13","150","2","150","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Cs F3 O V -","- Cs F3 O V -","- Cs4 F12 O4 V4 -","4","0.5","","David W. Aldous; Richard J. Goff; J. Paul Attfield; Philip Lightfoot","Novel Vanadium(IV) Oxyfluorides with 'Spin-Ladder'-Like Structures, and Their Relationship to (VO)2P2O7","Inorganic Chemistry","2007","46","","1277","1282","10.1021/ic0617386","","","0.8462","synchrotron","","0.0458","0.0384","","","0.0912","0.0958","","","","","","0.997","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307201","8.559","0.004","11.526","0.006","3.8591","0.0019","90","","90","","90","","380.7","0.3","93","2","93","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- F3 O Rb V -","- F3 O Rb V -","- F12 O4 Rb4 V4 -","4","0.5","","David W. Aldous; Richard J. Goff; J. Paul Attfield; Philip Lightfoot","Novel Vanadium(IV) Oxyfluorides with 'Spin-Ladder'-Like Structures, and Their Relationship to (VO)2P2O7","Inorganic Chemistry","2007","46","","1277","1282","10.1021/ic0617386","","","0.7107","MoKα","","0.0813","0.0607","","","0.1414","0.1572","","","","","","1.134","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307342","8.0558","0.0003","13.3799","0.0004","3.7029","0.0001","90","","90","","90","","399.12","0.02","150","1","150","1","","","","","","","","5","P b a m","-P 2 2ab","55","","acetonitriledichloroiron(II)","","- C4 H6 Cl2 Fe N2 -","- C4 H6 Cl2 Fe N2 -","- C8 H12 Cl4 Fe2 N4 -","2","0.25","","Konstantin I. Pokhodnya; Michael Bonner; Antonio G. DiPasquale; Arnold L. Rheingold; Jae-Hyuk Her; Peter W. Stephens; Jong-Won Park; Bretni S. Kennon; Atta M. Arif; Joel S. Miller","Structural and Magnetic Properties of MCl2 (M = Fe, Mn, Co): Acetonitrile Solvates","Inorganic Chemistry","2007","46","","2471","2477","10.1021/ic061877n","","","0.71069","MoKα","","0.0179","0.0167","","","0.0415","0.0423","","","","","","1.125","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307343","8.125","0.003","13.368","0.005","3.743","0.0015","90","","90","","90","","406.5","0.3","100","2","100","2","","","","","","","","5","P b a m","-P 2 2ab","55","","acetonitriledichloroiron(II)","","- C4 H6 Cl2 Mn N2 -","- C4 H6 Cl2 Mn N2 -","- C8 H12 Cl4 Mn2 N4 -","2","0.25","","Konstantin I. Pokhodnya; Michael Bonner; Antonio G. DiPasquale; Arnold L. Rheingold; Jae-Hyuk Her; Peter W. Stephens; Jong-Won Park; Bretni S. Kennon; Atta M. Arif; Joel S. Miller","Structural and Magnetic Properties of MCl2 (M = Fe, Mn, Co): Acetonitrile Solvates","Inorganic Chemistry","2007","46","","2471","2477","10.1021/ic061877n","","","0.71073","MoKα","","0.0239","0.0228","","","0.0592","0.0598","","","","","","1.167","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4310384","15.359","0.003","19.81","0.004","11.806","0.002","90","","90","","90","","3592.1","1.2","193","2","273","2","","","","","","","","9","P b a m","-P 2 2ab","55","","","","- C42 H80 B2 Br4 Fe6 Mo2 N14 O2 S8 -","- C42 H40 B2 Br4 Fe6 Mo2 N14 O2 S8 -","- C84 H80 B4 Br8 Fe12 Mo4 N28 O4 S16 -","2","0.25","","Yugen Zhang; R. H. Holm","Structural Conversions of Molybdenum-Iron-Sulfur Edge-Bridged Double Cubanes and PN-Type Clusters Topologically Related to the Nitrogenase P-Cluster","Inorganic Chemistry","2004","43","","674","682","10.1021/ic030259t","","","0.71073","MoKα","","0.0705","0.0419","","","0.0976","0.1095","","","","","","1.067","","","","has coordinates","179142","2020-10-21","18:00:00",""
"4310408","8.9767","0.001","15.1687","0.0018","5.3202","0.0006","90","","90","","90","","724.42","0.14","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- As2 F16 Mg Xe2 -","- As2 F16 Mg Xe2 -","- As4 F32 Mg2 Xe4 -","2","0.25","","Melita Tramšek; Primož Benkič; Boris Žemva","[Mg(XeF~2~)~n~](AsF~6~)~2~ (n = 4, 2): the first compounds of magnesium with XeF~2~","Inorganic Chemistry","2004","43","","699","703","10.1021/ic034826o","","","0.71069","MoKα","","0.0444","0.039","","","0.0753","0.0772","","","","","","1.142","","","","has coordinates","179143","2020-10-21","18:00:00",""
"4311458","21.677","0.002","12.322","0.001","4.5259","0.0004","90","","90","","90","","1208.89","0.18","90","3","90","3","","","","","","","","3","P b a m","-P 2 2ab","55","Yb18Zn8.45Sb18","","","- Sb18 Yb18 Zn8.45 -","- Sb18 Yb18 Zn8.452 -","- Sb18 Yb18 Zn8.452 -","1","0.125","","Svilen Bobev; Joe D. Thompson; John L. Sarrao; Marilyn M. Olmstead; Håkon Hope; Susan M. Kauzlarich","Probing the Limits of the Zintl Concept: Structure and Bonding in Rare-Earth and Alkaline-Earth Zinc-Antimonides Yb9Zn4+xSb9 and Ca9Zn4.5Sb9","Inorganic Chemistry","2004","43","","5044","5052","10.1021/ic049836j","","","0.71073","MoKα","","0.0423","0.0309","","","0.0718","0.077","","","","","","1.069","","","","has coordinates","179153","2020-10-21","18:00:00",""
"4311459","21.706","0.002","12.3381","0.0013","4.5297","0.0005","90","","90","","90","","1213.1","0.2","90","3","90","3","","","","","","","","3","P b a m","-P 2 2ab","55","Yb18Zn8.76Sb18","","","- Sb18 Yb18 Zn8.76 -","- Sb18 Yb18 Zn8.76 -","- Sb18 Yb18 Zn8.76 -","1","0.125","","Svilen Bobev; Joe D. Thompson; John L. Sarrao; Marilyn M. Olmstead; Håkon Hope; Susan M. Kauzlarich","Probing the Limits of the Zintl Concept: Structure and Bonding in Rare-Earth and Alkaline-Earth Zinc-Antimonides Yb9Zn4+xSb9 and Ca9Zn4.5Sb9","Inorganic Chemistry","2004","43","","5044","5052","10.1021/ic049836j","","","0.71073","MoKα","","0.0447","0.0298","","","0.0563","0.0604","","","","","","1.024","","","","has coordinates","179153","2020-10-21","18:00:00",""
"4311460","21.7","0.002","12.34","0.0009","4.5339","0.0004","90","","90","","90","","1214.08","0.18","90","3","90","3","","","","","","","","3","P b a m","-P 2 2ab","55","Yb18Zn8.77Sb18","","","- Sb18 Yb18 Zn8.77 -","- Sb18 Yb18 Zn8.768 -","- Sb18 Yb18 Zn8.768 -","1","0.125","","Svilen Bobev; Joe D. Thompson; John L. Sarrao; Marilyn M. Olmstead; Håkon Hope; Susan M. Kauzlarich","Probing the Limits of the Zintl Concept: Structure and Bonding in Rare-Earth and Alkaline-Earth Zinc-Antimonides Yb9Zn4+xSb9 and Ca9Zn4.5Sb9","Inorganic Chemistry","2004","43","","5044","5052","10.1021/ic049836j","","","0.71073","MoKα","","0.0356","0.0275","","","0.0565","0.0591","","","","","","1.028","","","","has coordinates","179153","2020-10-21","18:00:00",""
"4311461","21.83","0.001","12.4476","0.0009","4.5414","0.0003","90","","90","","90","","1234.04","0.13","90","3","90","3","","","","","","","","3","P b a m","-P 2 2ab","55","Ca18Zn8.96Sb18","","","- Ca18 Sb18 Zn8.96 -","- Ca18 Sb18 Zn8.956 -","- Ca18 Sb18 Zn8.956 -","1","0.125","","Svilen Bobev; Joe D. Thompson; John L. Sarrao; Marilyn M. Olmstead; Håkon Hope; Susan M. Kauzlarich","Probing the Limits of the Zintl Concept: Structure and Bonding in Rare-Earth and Alkaline-Earth Zinc-Antimonides Yb9Zn4+xSb9 and Ca9Zn4.5Sb9","Inorganic Chemistry","2004","43","","5044","5052","10.1021/ic049836j","","","0.71073","MoKα","","0.0588","0.0333","","","0.0583","0.0661","","","","","","1.014","","","","has coordinates","179153","2020-10-21","18:00:00",""
"4311783","11.973","0.002","16.12","0.003","8.594","0.002","90","","90","","90","","1658.7","0.6","293","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Se18 Sn4 Sr8 -","- Se18 Sn4 Sr8 -","- Se36 Sn8 Sr16 -","2","0.25","","Regina Pocha; Dirk Johrendt","Crystal Structures of Sr4Sn2Se9 and Sr4Sn2Se10 and the Oxidation State of Tin in an Unusual Geometry","Inorganic Chemistry","2004","43","","6830","6837","10.1021/ic049663y","","","0.71073","MoKα","","0.0817","0.065","","","0.1488","0.1547","","","","","","1.27","","","","has coordinates","288183","2023-12-08","14:42:58",""
"4313231","11.28797","0.00007","6.29475","0.00004","3.622102","0.000022","90","","90","","90","","257.368","0.003","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- C2 O4 Rb2 -","- C2 O4 Rb2 -","- C4 O8 Rb4 -","2","0.25","","Robert E. Dinnebier; Sascha Vensky; Martin Panthöfer; Martin Jansen","Crystal and Molecular Structures of Alkali Oxalates: First Proof of a Staggered Oxalate Anion in the Solid State","Inorganic Chemistry","2003","42","","1499","1507","10.1021/ic0205536","powder diffraction","","0.82978","","","","","","","","","","","1.29","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4313233","10.91176","0.00007","6.11592","0.00004","3.440033","0.000024","90","","90","","90","","229.572","0.003","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- C2 K2 O4 -","- C2 K2 O4 -","- C4 K4 O8 -","2","0.25","","Robert E. Dinnebier; Sascha Vensky; Martin Panthöfer; Martin Jansen","Crystal and Molecular Structures of Alkali Oxalates: First Proof of a Staggered Oxalate Anion in the Solid State","Inorganic Chemistry","2003","42","","1499","1507","10.1021/ic0205536","powder diffraction","","0.70003","","","","","","","","","","","1.18","","","","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4314328","33.9194","0.0008","8.2355","0.0009","9.774","0.0001","90","","90","","90","","2730.3","0.3","295.2","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- C22 H24 N14 Pd3 -","- C22 H18 N14 Pd3 -","- C88 H72 N56 Pd12 -","4","0.5","","Umakoshi, Keisuke; Yamauchi, Yoko; Nakamiya, Keiko; Kojima, Takashi; Yamasaki, Mikio; Kawano, Hiroyuki; Onishi, Masayoshi","Pyrazolato-Bridged Polynuclear Palladium and Platinum Complexes. Synthesis, Structure, and Reactivity","Inorganic Chemistry","2003","42","20","6584","6584","10.1021/ic030215k","","","0.71069","MoKα","","","0.0233","","","","0.0777","","","","","","1.017","","","","has coordinates","210296","2020-10-21","18:00:00",""
"4318001","10.87","0.0007","16.0957","0.0014","5.7178","0.0002","90","","90","","90","","1000.39","0.11","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Mo4 O11 Sm4 -","- Mo4 O11 Sm4 -","- Mo16 O44 Sm16 -","4","0.5","","P. Gall; N. Barrier; R. Gautier; P. Gougeon","Synthesis, Structural Trends, and Physical and Electronic Properties of the Reduced Molybdenum Oxides R4Mo4O11 (R = Nd-Tm and Y) Containing Infinite Chains of Trans-Edge-Shared Octahedral Clusters","Inorganic Chemistry","2002","41","","2879","2885","10.1021/ic011000i","","","0.7107","MoKα","","0.0391","0.0236","","","0.0529","0.0558","","","","","","1.095","","","","has coordinates","179260","2020-10-21","18:00:00",""
"4318002","10.8351","0.0007","16.0477","0.0013","5.7042","0.0002","90","","90","","90","","991.84","0.11","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Eu4 Mo4 O11 -","- Eu4 Mo4 O11 -","- Eu16 Mo16 O44 -","4","0.5","","P. Gall; N. Barrier; R. Gautier; P. Gougeon","Synthesis, Structural Trends, and Physical and Electronic Properties of the Reduced Molybdenum Oxides R4Mo4O11 (R = Nd-Tm and Y) Containing Infinite Chains of Trans-Edge-Shared Octahedral Clusters","Inorganic Chemistry","2002","41","","2879","2885","10.1021/ic011000i","","","0.7107","MoKα","","0.0318","0.0216","","","0.0499","0.0521","","","","","","1.189","","","","has coordinates","179260","2020-10-21","18:00:00",""
"4318003","10.794","0.0007","15.9876","0.0013","5.6942","0.0002","90","","90","","90","","982.65","0.11","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Gd4 Mo4 O11 -","- Gd4 Mo4 O11 -","- Gd16 Mo16 O44 -","4","0.5","","P. Gall; N. Barrier; R. Gautier; P. Gougeon","Synthesis, Structural Trends, and Physical and Electronic Properties of the Reduced Molybdenum Oxides R4Mo4O11 (R = Nd-Tm and Y) Containing Infinite Chains of Trans-Edge-Shared Octahedral Clusters","Inorganic Chemistry","2002","41","","2879","2885","10.1021/ic011000i","","","0.7107","MoKα","","0.0506","0.0265","","","0.0557","0.0591","","","","","","1.148","","","","has coordinates","179260","2020-10-21","18:00:00",""
"4318004","10.7369","0.0006","15.9112","0.0012","5.6764","0.0002","90","","90","","90","","969.74","0.1","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Mo4 O11 Tb4 -","- Mo4 O11 Tb4 -","- Mo16 O44 Tb16 -","4","0.5","","P. Gall; N. Barrier; R. Gautier; P. Gougeon","Synthesis, Structural Trends, and Physical and Electronic Properties of the Reduced Molybdenum Oxides R4Mo4O11 (R = Nd-Tm and Y) Containing Infinite Chains of Trans-Edge-Shared Octahedral Clusters","Inorganic Chemistry","2002","41","","2879","2885","10.1021/ic011000i","","","0.7107","MoKα","","0.0402","0.0261","","","0.0638","0.067","","","","","","1.077","","","","has coordinates","179260","2020-10-21","18:00:00",""
"4318005","10.7055","0.0008","15.8721","0.0015","5.664","0.0002","90","","90","","90","","962.42","0.12","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Dy4 Mo4 O11 -","- Dy4 Mo4 O11 -","- Dy16 Mo16 O44 -","4","0.5","","P. Gall; N. Barrier; R. Gautier; P. Gougeon","Synthesis, Structural Trends, and Physical and Electronic Properties of the Reduced Molybdenum Oxides R4Mo4O11 (R = Nd-Tm and Y) Containing Infinite Chains of Trans-Edge-Shared Octahedral Clusters","Inorganic Chemistry","2002","41","","2879","2885","10.1021/ic011000i","","","0.7107","MoKα","","0.0508","0.034","","","0.086","0.0899","","","","","","1.093","","","","has coordinates","179260","2020-10-21","18:00:00",""
"4318006","10.627","0.0008","15.7629","0.0015","5.6396","0.0002","90","","90","","90","","944.7","0.12","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Er4 Mo4 O11 -","- Er4 Mo4 O11 -","- Er16 Mo16 O44 -","4","0.5","","P. Gall; N. Barrier; R. Gautier; P. Gougeon","Synthesis, Structural Trends, and Physical and Electronic Properties of the Reduced Molybdenum Oxides R4Mo4O11 (R = Nd-Tm and Y) Containing Infinite Chains of Trans-Edge-Shared Octahedral Clusters","Inorganic Chemistry","2002","41","","2879","2885","10.1021/ic011000i","","","0.7107","MoKα","","0.0437","0.0254","","","0.0582","0.0611","","","","","","1.154","","","","has coordinates","179260","2020-10-21","18:00:00",""
"4318007","10.5874","0.0006","15.7134","0.0012","5.6282","0.0002","90","","90","","90","","936.33","0.1","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Mo4 O11 Tm4 -","- Mo4 O11 Tm4 -","- Mo16 O44 Tm16 -","4","0.5","","P. Gall; N. Barrier; R. Gautier; P. Gougeon","Synthesis, Structural Trends, and Physical and Electronic Properties of the Reduced Molybdenum Oxides R4Mo4O11 (R = Nd-Tm and Y) Containing Infinite Chains of Trans-Edge-Shared Octahedral Clusters","Inorganic Chemistry","2002","41","","2879","2885","10.1021/ic011000i","","","0.7107","MoKα","","0.037","0.0258","","","0.059","0.0613","","","","","","1.136","","","","has coordinates","179260","2020-10-21","18:00:00",""
"4318008","10.6619","0.0009","15.8167","0.0017","5.6517","0.0002","90","","90","","90","","953.08","0.13","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Mo4 O11 Y4 -","- Mo4 O11 Y4 -","- Mo16 O44 Y16 -","4","0.5","","P. Gall; N. Barrier; R. Gautier; P. Gougeon","Synthesis, Structural Trends, and Physical and Electronic Properties of the Reduced Molybdenum Oxides R4Mo4O11 (R = Nd-Tm and Y) Containing Infinite Chains of Trans-Edge-Shared Octahedral Clusters","Inorganic Chemistry","2002","41","","2879","2885","10.1021/ic011000i","","","0.7107","MoKα","","0.0996","0.0351","","","0.0523","0.0605","","","","","","1.004","","","","has coordinates","179260","2020-10-21","18:00:00",""
"4318213","8.136","0.002","13.784","0.004","7.428","0.002","90","","90","","90","","833","0.4","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- As K S5 Sn -","- As K S5 Sn -","- As4 K4 S20 Sn4 -","4","0.5","","Ratnasabapathy G. Iyer; Mercouri G. Kanatzidis","Controlling Lewis Basicity in Polythioarsenate Fluxes: Stabilization of KSnAsS5 and K2SnAs2S6. Extended Chains and Slabs Based on Pyramidal β-[AsS4]3- and [AsS3]3- Units","Inorganic Chemistry","2002","41","","3605","3607","10.1021/ic025523h","","","0.71073","MoKα","","0.0392","0.0314","","","0.078","0.0812","","","","","","1.026","","","","has coordinates","179262","2020-10-21","18:00:00",""
"4318733","10.0623","0.0008","23.024","0.002","7.9389","0.0006","90","","90","","90","","1839.2","0.3","193","2","193","2","","","","","","","","5","P b a m","-P 2 2ab","55","Thallium Uranyl Tellurite dihydrate","","","- H4 O18 Te4 Tl3 U2 -","- O18 Te4 Tl3 U2 -","- O72 Te16 Tl12 U8 -","4","0.5","","Philip M. Almond; Thomas E. Albrecht-Schmitt","Expanding the Remarkable Structural Diversity of Uranyl Tellurites: Hydrothermal Preparation and Structures of K[UO2Te2O5(OH)], Tl3{(UO2)2[Te2O5(OH)](Te2O6)}.2H2O, β-Tl2[UO2(TeO3)2], and Sr3[UO2(TeO3)2](TeO3)2","Inorganic Chemistry","2002","41","","5495","5501","10.1021/ic025820m","","","0.71073","MoKα","","0.051","0.0444","","","0.0918","0.0937","","","","","","1.216","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4320262","8.71","0.003","10.2103","0.0004","12.0284","0.0005","90","","90","","90","","1069.7","0.4","100","2","100","2","","","","","","","","5","P b a m","-P 2 2ab","55","compound_4_I","","","- C12 H27 Au Cl4 O7 -","- C12 H24 Au Cl4 O7 -","- C24 H48 Au2 Cl8 O14 -","2","0.25","","Maria Calleja; Karin Johnson; Warwick J. Belcher; Jonathan W. Steed","Oxonium Ions from Aqua Regia: Isolation by Hydrogen Bonding to Crown Ethers","Inorganic Chemistry","2001","40","","4978","4985","10.1021/ic010468i","","","0.7107","MoKα","","0.0245","0.022","","","0.0482","0.0492","","","","","","1.073","","","","has coordinates","179305","2020-10-21","18:00:00",""
"4320661","12.604","0.003","14.711","0.003","4.098","0.001","90","","90","","90","","759.8","0.3","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ce Ga8 Ru1.91 -","- Ce Ga8 Ru1.913 -","- Ce4 Ga32 Ru7.652 -","4","0.5","","Martin Schlüter; Wolfgang Jeitschko","Ternary Lanthanoid Ruthenium Gallides with a High Gallium Content: Ln2Ru3Ga10 (Ln = Yb, Lu) with a New Structure Type and LnRu2Ga8 (Ln = La-Nd) with CaCo2Al8-type Structure","Inorganic Chemistry","2001","40","","6362","6368","10.1021/ic010629i","","","0.71073","MoKα","","0.0489","0.0202","","","0.0446","0.0572","","","","","","1.062","","","","has coordinates","179309","2020-10-21","18:00:00",""
"4320662","12.591","0.003","14.708","0.003","4.072","0.001","90","","90","","90","","754.1","0.3","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ga8 Nd Ru1.86 -","- Ga8 Nd Ru1.858 -","- Ga32 Nd4 Ru7.432 -","4","0.5","","Martin Schlüter; Wolfgang Jeitschko","Ternary Lanthanoid Ruthenium Gallides with a High Gallium Content: Ln2Ru3Ga10 (Ln = Yb, Lu) with a New Structure Type and LnRu2Ga8 (Ln = La-Nd) with CaCo2Al8-type Structure","Inorganic Chemistry","2001","40","","6362","6368","10.1021/ic010629i","","","0.71073","MoKα","","0.06","0.0208","","","0.0428","0.0547","","","","","","1.068","","","","has coordinates","179309","2020-10-21","18:00:00",""
"4322125","14.275","0.003","19.721","0.004","10.416","0.002","90","","90","","90","","2932.3","1","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C12 H26 Hg2 I7 N8 -","- C12 H26 Hg2.01 I7 N8 -","- C48 H104 Hg8.04 I28 N32 -","4","0.5","","Per H. Svensson; Lars Kloo","Metal Iodides in Polyiodide Networks: Synthesis and Structure of Binary Metal Iodide-Iodine Compounds Stable under Ambient Conditions","Inorganic Chemistry","1999","38","","3390","3393","10.1021/ic981348m","","","0.71073","MoKα","","0.0463","0.0357","","0.0813","0.0775","","","","1.069","1.131","1.131","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4324859","21.073","0.004","13.061","0.003","11.123","0.002","90","","90","","90","","3061.4","1.1","296","2","296","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C18 H12 Cu N2 O5 -","- C18 H12 Cu N2 O5 -","- C72 H48 Cu4 N8 O20 -","4","0.5","","Zhenxia Chen; Shengchang Xiang; Hadi D. Arman; Jalal U. Mondal; Peng Li; Dongyuan Zhao; Banglin Chen","Three-Dimensional Pillar-Layered Copper(II) Metal-Organic Framework with Immobilized Functional OH Groups on Pore Surfaces for Highly Selective CO2/CH4 and C2H2/CH4 Gas Sorption at Room Temperature","Inorganic Chemistry","2011","50","","3442","3446","10.1021/ic102347b","","","1.54178","CuKα","","0.0995","0.0932","","","0.2691","0.282","","","","","","1.172","","","","has coordinates","179351","2020-10-21","18:00:00",""
"4325079","9.656","0.0006","14.0533","0.0009","4.3524","0.0003","90","","90","","90","","590.61","0.07","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ba2 Cu5.53 S Te4 -","- Ba2 Cu5.528 S Te4 -","- Ba4 Cu11.056 S2 Te8 -","2","0.25","","Oottil Mayasree; Cheriyedath Raj Sankar; Abdeljalil Assoud; Holger Kleinke","New Barium Copper Chalcogenides Synthesized Using Two Different Chalcogen Atoms: Ba2Cu6-xSTe4 and Ba2Cu6-xSeyTe5-y","Inorganic Chemistry","2011","50","","4580","4585","10.1021/ic2002628","","","0.71073","MoKα","","0.0263","0.0245","","","0.0583","0.0595","","","","","","1.112","","","","has coordinates","179353","2020-10-21","18:00:00",""
"4325080","9.638","0.0015","14.063","0.002","4.3714","0.0007","90","","90","","90","","592.5","0.16","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ba2 Cu5.43 Se1.92 Te3.08 -","- Ba2 Cu5.426 Se1.916 Te3.084 -","- Ba4 Cu10.852 Se3.832 Te6.168 -","2","0.25","","Oottil Mayasree; Cheriyedath Raj Sankar; Abdeljalil Assoud; Holger Kleinke","New Barium Copper Chalcogenides Synthesized Using Two Different Chalcogen Atoms: Ba2Cu6-xSTe4 and Ba2Cu6-xSeyTe5-y","Inorganic Chemistry","2011","50","","4580","4585","10.1021/ic2002628","","","0.71073","MoKα","","0.0335","0.0306","","","0.0653","0.0667","","","","","","1.632","","","","has coordinates","179353","2020-10-21","18:00:00",""
"4325081","9.7048","0.0006","14.1853","0.0009","4.384","0.0003","90","","90","","90","","603.53","0.07","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ba2 Cu5.64 Se1.1 Te3.9 -","- Ba2 Cu5.638 Se1.096 Te3.904 -","- Ba4 Cu11.276 Se2.192 Te7.808 -","2","0.25","","Oottil Mayasree; Cheriyedath Raj Sankar; Abdeljalil Assoud; Holger Kleinke","New Barium Copper Chalcogenides Synthesized Using Two Different Chalcogen Atoms: Ba2Cu6-xSTe4 and Ba2Cu6-xSeyTe5-y","Inorganic Chemistry","2011","50","","4580","4585","10.1021/ic2002628","","","0.71073","MoKα","","0.0212","0.0201","","","0.0429","0.044","","","","","","1.109","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4325082","9.7728","0.0009","14.3722","0.0013","4.4125","0.0004","90","","90","","90","","619.76","0.1","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ba2 Cu5.83 Se0.48 Te4.52 -","- Ba2 Cu5.826 Se0.479 Te4.521 -","- Ba4 Cu11.652 Se0.958 Te9.042 -","2","0.25","","Oottil Mayasree; Cheriyedath Raj Sankar; Abdeljalil Assoud; Holger Kleinke","New Barium Copper Chalcogenides Synthesized Using Two Different Chalcogen Atoms: Ba2Cu6-xSTe4 and Ba2Cu6-xSeyTe5-y","Inorganic Chemistry","2011","50","","4580","4585","10.1021/ic2002628","","","0.71073","MoKα","","0.0354","0.0323","","","0.0769","0.0785","","","","","","1.018","","","","has coordinates","179353","2020-10-21","18:00:00",""
"4325706","20.437","0.0008","24.8581","0.0019","11.143","0.0002","90","","90","","90","","5660.9","0.5","150","1","150","1","","","","","","","","7","P b a m","-P 2 2ab","55","","","","- C39 H67 Cl6 N6 O10 P2 Sb3 -","- C39 H67 Cl6 N6 O10 P2 Sb3 -","- C156 H268 Cl24 N24 O40 P8 Sb12 -","4","0.5","","Tomáš Svoboda; Libor Dostál; Roman Jambor; Aleš Růžička; Robert Jirásko; Antonín Lyčka","NCN-Chelated Organoantimony(III) and Organobismuth(III) Phosphates: Synthesis and Solid-State and Solution Structures","Inorganic Chemistry","2011","50","","6411","6413","10.1021/ic2009144","","","0.71073","MoKα","","0.0534","0.044","","","0.0973","0.1024","","","","","","1.005","","","","has coordinates","179360","2020-10-21","18:00:00",""
"4329210","12.482","0.003","14.137","0.003","4.244","0.001","90","","90","","90","","748.9","0.3","150","2","150","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- As6 Sn2 Sr5 -","- As6 Sn2 Sr5 -","- As12 Sn4 Sr10 -","2","0.25","","Jian Wang; Sheng-Qing Xia; Xu-Tang Tao","A5Sn2As6 (A = Sr, Eu). Synthesis, Crystal and Electronic Structure, and Thermoelectric Properties","Inorganic Chemistry","2012","51","","5771","5778","10.1021/ic300308w","","","0.71073","MoKα","","0.0598","0.0341","","","0.0628","0.071","","","","","","1.035","","","","has coordinates","179395","2020-10-21","18:00:00",""
"4329211","12.281","0.005","13.941","0.005","4.2029","0.0016","90","","90","","90","","719.6","0.5","150","2","150","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- As6 Eu5 Sn2 -","- As6 Eu5 Sn2 -","- As12 Eu10 Sn4 -","2","0.25","","Jian Wang; Sheng-Qing Xia; Xu-Tang Tao","A5Sn2As6 (A = Sr, Eu). Synthesis, Crystal and Electronic Structure, and Thermoelectric Properties","Inorganic Chemistry","2012","51","","5771","5778","10.1021/ic300308w","","","0.71073","MoKα","","0.0432","0.0324","","","0.0766","0.0818","","","","","","1.021","","","","has coordinates","179395","2020-10-21","18:00:00",""
"4330401","12.5503","0.0013","14.9494","0.0016","8.5403","0.0009","90","","90","","90","","1602.3","0.3","100","2","100","2","","","","","","","","8","P b a m","-P 2 2ab","55","","","","- C5 H32 I K2 N2 O24 P8 Pt2 -","- C5 H14 I K2 N2 O24 P8 Pt2 -","- C10 H28 I2 K4 N4 O48 P16 Pt4 -","2","0.25","","Hiroaki Iguchi; Shinya Takaishi; Brian K. Breedlove; Masahiro Yamashita; Hiroyuki Matsuzaki; Hiroshi Okamoto","Controlling the Electronic States and Physical Properties of MMX-Type Diplatinum-Iodide Chain Complexes via Binary Countercations","Inorganic Chemistry","2012","51","","9967","9977","10.1021/ic301469u","","","0.71073","MoKα","","0.0262","0.0198","","","0.0524","0.0537","","","","","","0.958","","","","has coordinates","179407","2020-10-21","18:00:00",""
"4330402","12.237","0.002","15.432","0.003","8.5382","0.0015","90","","90","","90","","1612.4","0.5","100","2","100","2","","","","","","","","8","P b a m","-P 2 2ab","55","","","","- C4 H30 I K2 N2 O25 P8 Pt2 -","- C4 H8 I K2 N2 O25 P8 Pt2 -","- C8 H16 I2 K4 N4 O50 P16 Pt4 -","2","0.25","","Hiroaki Iguchi; Shinya Takaishi; Brian K. Breedlove; Masahiro Yamashita; Hiroyuki Matsuzaki; Hiroshi Okamoto","Controlling the Electronic States and Physical Properties of MMX-Type Diplatinum-Iodide Chain Complexes via Binary Countercations","Inorganic Chemistry","2012","51","","9967","9977","10.1021/ic301469u","","","0.71073","MoKα","","0.0402","0.0308","","","0.0654","0.068","","","","","","1.136","","","","has coordinates","179407","2020-10-21","18:00:00",""
"4330408","12.63","0.003","15.101","0.004","8.655","0.002","90","","90","","90","","1650.7","0.7","100","2","100","2","","","","","","","","8","P b a m","-P 2 2ab","55","","","","- C5 H32 I N2 O24 P8 Pt2 Rb2 -","- C5 H8 I N2 O24 P8 Pt2 Rb2 -","- C10 H16 I2 N4 O48 P16 Pt4 Rb4 -","2","0.25","","Hiroaki Iguchi; Shinya Takaishi; Brian K. Breedlove; Masahiro Yamashita; Hiroyuki Matsuzaki; Hiroshi Okamoto","Controlling the Electronic States and Physical Properties of MMX-Type Diplatinum-Iodide Chain Complexes via Binary Countercations","Inorganic Chemistry","2012","51","","9967","9977","10.1021/ic301469u","","","0.71073","MoKα","","0.0478","0.0252","","","0.0495","0.0524","","","","","","0.808","","","","has coordinates","179407","2020-10-21","18:00:00",""
"4332413","23.0203","","5.4403","","20.4391","","90","","90","","90","","2559.74","","","","293","","","","","","","","","4","P b a m","-P 2 2ab","55","bismuth cadmium oxide phosphate","","","- Bi15.32 Cd10 O58 P10 -","- Bi15.3376 Cd10.062 O57.9982 P10 -","- Bi30.6752 Cd20.124 O115.996 P20 -","2","0.25","","Colmont, Marie; Huvé, Marielle; Mentré, Olivier","Bi3+/M2+Oxyphosphate: A Continuous Series of Polycationic Species from the 1D Single Chain to the 2D Planes. Part 2: Crystal Structure of Three Original Structural Types Showing a Combination of New Ribbonlike Polycations","Inorganic Chemistry","2006","45","17","6612","6621","10.1021/ic060343j","","","0.71073","MoKα","","0.0656","0.0502","","","0.0502","0.0514","","","","3.16","3.16","2.88","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4333941","5.5185","0.0001","5.5185","0.0001","19.5205","0.0006","90","","90","","90","","594.47","0.02","1.5","","1.5","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- Bi Cl Fe4 O11 Pb4 -","- Bi Cl Fe4 O11 Pb4 -","- Bi2 Cl2 Fe8 O22 Pb8 -","2","0.25","","Maria Batuk; Dmitry Batuk; Alexander A. Tsirlin; Marina G. Rozova; Evgeny V. Antipov; Joke Hadermann; Gustaaf Van Tendeloo","Homologous Series of Layered Perovskites An+1BnO3n-1Cl: Crystal and Magnetic Structure of a New Oxychloride Pb4BiFe4O11Cl","Inorganic Chemistry","2013","52","","2208","2218","10.1021/ic302667a","powder diffraction","neutron","1.8857","neutron","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4333942","5.53104","0.00011","5.53104","0.00011","19.5858","0.0007","90","","90","","90","","599.18","0.03","300","","300","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- Bi Cl Fe4 O11 Pb4 -","- Bi Cl Fe4 O11 Pb4 -","- Bi2 Cl2 Fe8 O22 Pb8 -","2","0.25","","Maria Batuk; Dmitry Batuk; Alexander A. Tsirlin; Marina G. Rozova; Evgeny V. Antipov; Joke Hadermann; Gustaaf Van Tendeloo","Homologous Series of Layered Perovskites An+1BnO3n-1Cl: Crystal and Magnetic Structure of a New Oxychloride Pb4BiFe4O11Cl","Inorganic Chemistry","2013","52","","2208","2218","10.1021/ic302667a","powder diffraction","neutron","1.8857","neutron","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4335227","7.583","0.001","15.35","0.002","6.135","0.001","90","","90","","90","","714.11","0.18","200","2","200","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- F12 N5 Na O Tc2 -","- F12 H20 N5 Na O Tc2 -","- F24 H40 N10 Na2 O2 Tc4 -","2","0.25","","Samundeeswari Mariappan Balasekaran; Matthias Molski; Johann Spandl; Adelheid Hagenbach; Roger Alberto; Ulrich Abram","Hexafluoridotechnetate(IV) Revisited","Inorganic Chemistry","2013","52","","7094","7099","10.1021/ic400775e","","","0.71073","MoKα","","0.0516","0.0379","","","0.0819","0.0865","","","","","","1.07","","","","has coordinates","189097","2020-10-21","18:00:00",""
"4336255","15.8354","0.0005","17.5204","0.0006","11.4998","0.0003","90","","90","","90","","3190.53","0.17","290","2","290","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C62 H50 Fe2 N22 O5 Zn3 -","- C62 H50 Fe2 N22 O5 Zn3 -","- C124 H100 Fe4 N44 O10 Zn6 -","2","0.25","","Arpan Hazra; Satyanarayana Bonakala; Sandeep K. Reddy; Sundaram Balasubramanian; Tapas Kumar Maji","Effect of Pillar Modules and Their Stoichiometry in 3D Porous Frameworks of Zn(II) with [Fe(CN)6]3-: High CO2/N2 and CO2/CH4 Selectivity","Inorganic Chemistry","2013","52","","11385","11397","10.1021/ic401657d","","","0.71073","MoKα","","0.0749","0.0415","","","0.0827","0.0967","","","","","","1.026","","","","has coordinates","179465","2020-10-21","18:00:00",""
"4336613","15.4457","0.0015","17.0904","0.0016","4.4723","0.0004","90","","90","","90","","1180.57","0.19","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ce7 Ge1.7 Zn21.3 -","- Ce7 Ge1.7 Zn21.3 -","- Ce14 Ge3.4 Zn42.6 -","2","0.25","","Nian-Tzu Suen; Svilen Bobev","Synthesis and Structural Characterization of RE7Zn21Tt2 (RE = La-Nd; Tt = Ge, Sn, and Pb): New Structure Type Among the Polar Intermetallic Phases","Inorganic Chemistry","2013","52","","12731","12740","10.1021/ic4019844","","","0.71073","MoKα","","0.0187","0.017","","","0.0368","0.0373","","","","","","1.188","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4336614","15.437","0.002","17.075","0.003","4.4537","0.0007","90","","90","","90","","1173.9","0.3","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ge1.7 Pr7 Zn21.3 -","- Ge1.7 Pr7 Zn21.3 -","- Ge3.4 Pr14 Zn42.6 -","2","0.25","","Nian-Tzu Suen; Svilen Bobev","Synthesis and Structural Characterization of RE7Zn21Tt2 (RE = La-Nd; Tt = Ge, Sn, and Pb): New Structure Type Among the Polar Intermetallic Phases","Inorganic Chemistry","2013","52","","12731","12740","10.1021/ic4019844","","","0.71073","MoKα","","0.0363","0.0236","","","0.037","0.041","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4336615","15.362","0.0009","17.0273","0.001","4.4367","0.0003","90","","90","","90","","1160.52","0.12","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ge1.7 Nd7 Zn21.3 -","- Ge1.7 Nd7 Zn21.3 -","- Ge3.4 Nd14 Zn42.6 -","2","0.25","","Nian-Tzu Suen; Svilen Bobev","Synthesis and Structural Characterization of RE7Zn21Tt2 (RE = La-Nd; Tt = Ge, Sn, and Pb): New Structure Type Among the Polar Intermetallic Phases","Inorganic Chemistry","2013","52","","12731","12740","10.1021/ic4019844","","","0.71073","MoKα","","0.0127","0.012","","","0.0239","0.0241","","","","","","1.175","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4336616","15.7688","0.0006","17.375","0.002","4.525","0.002","90","","90","","90","","1239.8","0.6","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- La7 Sn1.2 Zn21.8 -","- La7 Sn1.192 Zn21.808 -","- La14 Sn2.384 Zn43.616 -","2","0.25","","Nian-Tzu Suen; Svilen Bobev","Synthesis and Structural Characterization of RE7Zn21Tt2 (RE = La-Nd; Tt = Ge, Sn, and Pb): New Structure Type Among the Polar Intermetallic Phases","Inorganic Chemistry","2013","52","","12731","12740","10.1021/ic4019844","","","0.71073","MoKα","","0.0387","0.0312","","","0.0545","0.0569","","","","","","1.089","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336617","15.6455","0.0004","17.2713","0.0013","4.4982","0.0014","90","","90","","90","","1215.5","0.4","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ce7 Sn1.72 Zn21.28 -","- Ce7 Sn1.716 Zn21.284 -","- Ce14 Sn3.432 Zn42.568 -","2","0.25","","Nian-Tzu Suen; Svilen Bobev","Synthesis and Structural Characterization of RE7Zn21Tt2 (RE = La-Nd; Tt = Ge, Sn, and Pb): New Structure Type Among the Polar Intermetallic Phases","Inorganic Chemistry","2013","52","","12731","12740","10.1021/ic4019844","","","0.71073","MoKα","","0.0224","0.0204","","","0.038","0.0388","","","","","","1.158","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336618","15.5913","0.0008","17.266","0.003","4.481","0.003","90","","90","","90","","1206.3","0.8","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Pr7 Sn1.95 Zn21.05 -","- Pr7 Sn1.952 Zn21.048 -","- Pr14 Sn3.904 Zn42.096 -","2","0.25","","Nian-Tzu Suen; Svilen Bobev","Synthesis and Structural Characterization of RE7Zn21Tt2 (RE = La-Nd; Tt = Ge, Sn, and Pb): New Structure Type Among the Polar Intermetallic Phases","Inorganic Chemistry","2013","52","","12731","12740","10.1021/ic4019844","","","0.71073","MoKα","","0.0606","0.0374","","","0.0592","0.0663","","","","","","1.062","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336619","15.5177","0.0004","17.1961","0.0013","4.4503","0.0014","90","","90","","90","","1187.5","0.4","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Nd7 Sn1.46 Zn21.54 -","- Nd7 Sn1.464 Zn21.536 -","- Nd14 Sn2.928 Zn43.072 -","2","0.25","","Nian-Tzu Suen; Svilen Bobev","Synthesis and Structural Characterization of RE7Zn21Tt2 (RE = La-Nd; Tt = Ge, Sn, and Pb): New Structure Type Among the Polar Intermetallic Phases","Inorganic Chemistry","2013","52","","12731","12740","10.1021/ic4019844","","","0.71073","MoKα","","0.0175","0.0154","","","0.031","0.0317","","","","","","1.101","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336620","15.82","0.004","17.455","0.004","4.5333","0.0011","90","","90","","90","","1251.8","0.5","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- La7 Pb1.77 Zn21.23 -","- La7 Pb1.766 Zn21.234 -","- La14 Pb3.532 Zn42.468 -","2","0.25","","Nian-Tzu Suen; Svilen Bobev","Synthesis and Structural Characterization of RE7Zn21Tt2 (RE = La-Nd; Tt = Ge, Sn, and Pb): New Structure Type Among the Polar Intermetallic Phases","Inorganic Chemistry","2013","52","","12731","12740","10.1021/ic4019844","","","0.71073","MoKα","","0.0391","0.0268","","","0.0425","0.0458","","","","","","1.031","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336621","15.6927","0.0019","17.342","0.002","4.4985","0.0005","90","","90","","90","","1224.2","0.2","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ce7 Pb1.66 Zn21.34 -","- Ce7 Pb1.664 Zn21.336 -","- Ce14 Pb3.328 Zn42.672 -","2","0.25","","Nian-Tzu Suen; Svilen Bobev","Synthesis and Structural Characterization of RE7Zn21Tt2 (RE = La-Nd; Tt = Ge, Sn, and Pb): New Structure Type Among the Polar Intermetallic Phases","Inorganic Chemistry","2013","52","","12731","12740","10.1021/ic4019844","","","0.71073","MoKα","","0.0199","0.0174","","","0.0293","0.0299","","","","","","1.139","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336622","15.623","0.0014","17.3005","0.0015","4.4741","0.0004","90","","90","","90","","1209.29","0.19","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Pb1.74 Pr7 Zn21.26 -","- Pb1.742 Pr7 Zn21.258 -","- Pb3.484 Pr14 Zn42.516 -","2","0.25","","Nian-Tzu Suen; Svilen Bobev","Synthesis and Structural Characterization of RE7Zn21Tt2 (RE = La-Nd; Tt = Ge, Sn, and Pb): New Structure Type Among the Polar Intermetallic Phases","Inorganic Chemistry","2013","52","","12731","12740","10.1021/ic4019844","","","0.71073","MoKα","","0.0276","0.0231","","","0.0433","0.0446","","","","","","1.065","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336623","15.576","0.002","17.281","0.002","4.4564","0.0006","90","","90","","90","","1199.5","0.3","200","2","200","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Nd7 Pb1.92 Zn21.08 -","- Nd7 Pb1.926 Zn21.074 -","- Nd14 Pb3.852 Zn42.148 -","2","0.25","","Nian-Tzu Suen; Svilen Bobev","Synthesis and Structural Characterization of RE7Zn21Tt2 (RE = La-Nd; Tt = Ge, Sn, and Pb): New Structure Type Among the Polar Intermetallic Phases","Inorganic Chemistry","2013","52","","12731","12740","10.1021/ic4019844","","","0.71073","MoKα","","0.0335","0.0246","","","0.0472","0.0506","","","","","","1.059","","","","has coordinates","179469","2020-10-21","18:00:00",""
"4336889","7.2769","0.0002","22.9102","0.0005","4.3984","0.0001","90","","90","","90","","733.28","0.03","296","2","296","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ga2 Sb6 Yb5 -","- Ga2 Sb6 Yb5 -","- Ga4 Sb12 Yb10 -","2","0.25","","Udumula Subbarao; Sumanta Sarkar; Vijay Kumar Gudelli; V. Kanchana; G. Vaitheeswaran; Sebastian C. Peter","Yb5Ga2Sb6: A Mixed Valent and Narrow-Band Gap Material in the RE5M2X6 Family","Inorganic Chemistry","2013","52","","13631","13638","10.1021/ic402185s","","","0.71073","MoKα","","0.0384","0.0329","","","0.0796","0.0827","","","","","","1.062","","","","has coordinates","179471","2020-10-21","18:00:00",""
"4337207","15.0812","0.0017","18.109","0.002","5.5828","0.0006","90","","90","","90","","1524.7","0.3","100","2","100","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C14 H40 Br2 N12 O12 Pt2 -","- C14 Br2 N12 O12 Pt2 -","- C28 Br4 N24 O24 Pt4 -","2","0.25","","Otsubo, Kazuya; Kobayashi, Atsushi; Sugimoto, Kunihisa; Fujiwara, Akihiko; Kitagawa, Hiroshi","Variable-rung design for a mixed-valence two-legged ladder system situated in a dimensional crossover region.","Inorganic chemistry","2014","53","2","1229","1240","10.1021/ic402846v","","","0.71073","MoKα","","0.0289","0.0277","","","0.0777","0.079","","","","","","1.071","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4338308","13.3979","0.0008","49.867","0.003","6.9305","0.0004","90","","90","","90","","4630.4","0.5","100","2","100","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- B20 K26 O166 U40 -","- B20 K26 O166 U40 -","- B20 K26 O166 U40 -","1","0.125","","Stritzinger, Jared T.; Alekseev, Evgeny V.; Polinski, Matthew J.; Cross, Justin N.; Eaton, Teresa M.; Albrecht-Schmitt, Thomas E","Further Evidence for the Stabilization of U(V) within a Tetraoxo Core.","Inorganic chemistry","2014","53","10","5294","5299","10.1021/ic500523a","","","0.71073","MoKα","","0.0462","0.0393","","","0.099","0.1006","","","","","","1.885","","","","has coordinates","179486","2020-10-21","18:00:00",""
"4338546","8.6835","0.0003","13.6421","0.0004","10.2612","0.0003","90","","90","","90","","1215.55","0.07","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ag3.95 Ba4 Ge2 Te9 -","- Ag3.946 Ba4 Ge2 Te9 -","- Ag7.892 Ba8 Ge4 Te18 -","2","0.25","","Cui, Yanjie; Assoud, Abdeljalil; Kleinke, Holger","Synthesis and Structural and Physical Properties of New Semiconducting Quaternary Tellurides: Ba~4~Ag~3.95~Ge~2~Te~9~ and Ba~4~Cu~3.71~Ge~2~Te~9~","Inorganic chemistry","2009","48","12","5313","5319","10.1021/ic9002884","","","0.71073","MoKα","","0.016","0.0154","","","0.0327","0.0329","","","","","","1.207","","","","has coordinates","210067","2020-10-21","18:00:00",""
"4338547","8.6464","0.0002","13.5305","0.0004","10.081","0.0003","90","","90","","90","","1179.38","0.06","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ba4 Cu3.71 Ge2 Te9 -","- Ba4 Cu3.714 Ge2 Te9 -","- Ba8 Cu7.428 Ge4 Te18 -","2","0.25","","Cui, Yanjie; Assoud, Abdeljalil; Kleinke, Holger","Synthesis and Structural and Physical Properties of New Semiconducting Quaternary Tellurides: Ba~4~Ag~3.95~Ge~2~Te~9~ and Ba~4~Cu~3.71~Ge~2~Te~9~","Inorganic chemistry","2009","48","12","5313","5319","10.1021/ic9002884","","","0.71073","MoKα","","0.0236","0.0218","","","0.0466","0.0475","","","","","","1.055","","","","has coordinates","210067","2020-10-21","18:00:00",""
"4341021","9.0298","0.0004","24.189","0.0012","8.5013","0.0003","90","","90","","90","","1856.87","0.14","100","2","100","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Cl5 O2 P U -","- Cl5 O2 P U -","- Cl40 O16 P8 U8 -","8","1","","Ward, Matthew D.; Chan, Ian Y.; Lebègue, Sébastien; Ibers, James A.","The synthesis and characterization of four new uranium(IV) chlorophosphates: UCl₄(POCl₃), [U₂Cl₉][PCl₄], UCl₃(PO₂Cl₂), and U₂Cl₈(POCl₃).","Inorganic chemistry","2014","53","18","9969","9975","10.1021/ic501781h","","","0.71073","MoKα","","0.08","0.0489","","","0.1034","0.1142","","","","","","1.111","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341399","22.939","0.003","12.9429","0.0019","4.7455","0.0007","90","","90","","90","","1408.9","0.3","90","2","90","2","","","","","","","","4","P b a m","-P 2 2ab","55","Europium Cadmium/Gold Antimonide","","","- Au1.24 Cd3.79 Eu9 Sb9 -","- Au1.2326 Cd3.788 Eu9 Sb9 -","- Au2.4652 Cd7.576 Eu18 Sb18 -","2","0.25","","Kazem, Nasrin; Hurtado, Antonio; Klobes, Benedikt; Hermann, Raphaël P; Kauzlarich, Susan M.","Eu9Cd4-xCM2+x-y□ySb9: Ca9Mn4Bi9-Type Structure Stuffed with Coinage Metals (Cu, Ag, and Au) and the Challenges with Classical Valence Theory in Describing These Possible Zintl Phases.","Inorganic chemistry","2015","54","3","850","859","10.1021/ic502061w","","","0.71073","MoKα","","0.0199","0.0195","","","0.0399","0.0401","","","","","","1.3","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4341400","23.0077","0.0015","12.9074","0.0009","4.76","0.0003","90","","90","","90","","1413.58","0.16","90","2","90","2","","","","","","","","4","P b a m","-P 2 2ab","55","Europium Cadmium/Silver Antimonide","","","- Ag1.14 Cd3.97 Eu9 Sb9 -","- Ag1.1456 Cd3.974 Eu9 Sb9 -","- Ag2.2912 Cd7.948 Eu18 Sb18 -","2","0.25","","Kazem, Nasrin; Hurtado, Antonio; Klobes, Benedikt; Hermann, Raphaël P; Kauzlarich, Susan M.","Eu9Cd4-xCM2+x-y□ySb9: Ca9Mn4Bi9-Type Structure Stuffed with Coinage Metals (Cu, Ag, and Au) and the Challenges with Classical Valence Theory in Describing These Possible Zintl Phases.","Inorganic chemistry","2015","54","3","850","859","10.1021/ic502061w","","","0.71073","MoKα","","0.0157","0.0139","","","0.0257","0.0265","","","","","","1.14","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4341401","22.8479","0.001","12.9197","0.0006","4.7199","0.0002","90","","90","","90","","1393.26","0.11","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","Europium Cadmium/copper Antimonide","","","- Cd3.71 Cu1.47 Eu9 Sb9 -","- Cd3.698 Cu1.47 Eu9 Sb9 -","- Cd7.396 Cu2.94 Eu18 Sb18 -","2","0.25","","Kazem, Nasrin; Hurtado, Antonio; Klobes, Benedikt; Hermann, Raphaël P; Kauzlarich, Susan M.","Eu9Cd4-xCM2+x-y□ySb9: Ca9Mn4Bi9-Type Structure Stuffed with Coinage Metals (Cu, Ag, and Au) and the Challenges with Classical Valence Theory in Describing These Possible Zintl Phases.","Inorganic chemistry","2015","54","3","850","859","10.1021/ic502061w","","","0.71073","MoKα","","0.0206","0.0176","","","0.032","0.0329","","","","","","1.107","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4341656","12.4591","0.0005","14.3798","0.0006","4.0241","0.0001","90","","90","","90","","720.96","0.05","298","2","298","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al8 Ce Co Fe -","- Al8 Ce Co0.97 Fe1.02 -","- Al32 Ce4 Co3.88 Fe4.08 -","4","0.5","","Treadwell, LaRico J; Watkins-Curry, Pilanda; McAlpin, Jacob D.; Rebar, Drew J.; Hebert, Jessica K.; DiTusa, John F.; Chan, Julia Y.","Investigation of Mn, Fe, and Ni Incorporation in CeCo2Al8.","Inorganic chemistry","2015","54","3","963","968","10.1021/ic502356t","","","0.71073","MoKα","","0.0244","0.0211","","","0.0492","0.0512","","","","","","1.247","","","","has coordinates","179519","2020-10-21","18:00:00",""
"4341657","12.499","0.0005","14.41","0.0005","4.034","0.0005","90","","90","","90","","726.57","0.1","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al8 Ce Co1.3 Fe0.7 -","- Al8 Ce Co1.31 Mn0.69 -","- Al32 Ce4 Co5.24 Mn2.76 -","4","0.5","","Treadwell, LaRico J; Watkins-Curry, Pilanda; McAlpin, Jacob D.; Rebar, Drew J.; Hebert, Jessica K.; DiTusa, John F.; Chan, Julia Y.","Investigation of Mn, Fe, and Ni Incorporation in CeCo2Al8.","Inorganic chemistry","2015","54","3","963","968","10.1021/ic502356t","","","0.71073","MoKα","","0.0385","0.0263","","","0.0562","0.061","","","","","","1.091","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4341658","12.472","0.001","14.387","0.0015","4.022","0.003","90","","90","","90","","721.7","0.5","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al8 Ce Co2 -","- Al8 Ce Co2 -","- Al32 Ce4 Co8 -","4","0.5","","Treadwell, LaRico J; Watkins-Curry, Pilanda; McAlpin, Jacob D.; Rebar, Drew J.; Hebert, Jessica K.; DiTusa, John F.; Chan, Julia Y.","Investigation of Mn, Fe, and Ni Incorporation in CeCo2Al8.","Inorganic chemistry","2015","54","3","963","968","10.1021/ic502356t","","","0.71073","MoKα","","0.0314","0.0255","","","0.056","0.0592","","","","","","0.988","","","","has coordinates","179519","2020-10-21","18:00:00",""
"4341659","12.471","0.0005","14.386","0.002","4.022","0.003","90","","90","","90","","721.6","0.5","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al8 Ce Co1.4 Ni0.6 -","- Al8 Ce Co1.3758 Ni0.5958 -","- Al32 Ce4 Co5.5032 Ni2.3832 -","4","0.5","","Treadwell, LaRico J; Watkins-Curry, Pilanda; McAlpin, Jacob D.; Rebar, Drew J.; Hebert, Jessica K.; DiTusa, John F.; Chan, Julia Y.","Investigation of Mn, Fe, and Ni Incorporation in CeCo2Al8.","Inorganic chemistry","2015","54","3","963","968","10.1021/ic502356t","","","0.71073","MoKα","","0.0417","0.029","","","0.0659","0.0719","","","","","","1.015","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4341660","12.4654","0.0005","14.3872","0.0006","4.0219","0.0002","90","","90","","90","","721.3","0.06","298","2","298","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al8 Ce Co1.29 Ni0.71 -","- Al8 Ce Co1.27 Ni0.71 -","- Al32 Ce4 Co5.08 Ni2.84 -","4","0.5","","Treadwell, LaRico J; Watkins-Curry, Pilanda; McAlpin, Jacob D.; Rebar, Drew J.; Hebert, Jessica K.; DiTusa, John F.; Chan, Julia Y.","Investigation of Mn, Fe, and Ni Incorporation in CeCo2Al8.","Inorganic chemistry","2015","54","3","963","968","10.1021/ic502356t","","","0.71073","MoKα","","0.0264","0.0181","","","0.0309","0.0323","","","","","","1.097","","","","has coordinates","179519","2020-10-21","18:00:00",""
"4341661","12.495","0.0001","14.407","0.001","4.032","0.001","90","","90","","90","","725.82","0.19","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al8 Ce Co1.55 Mn0.45 -","- Al8 Ce Co1.55 Mn0.45 -","- Al32 Ce4 Co6.2 Mn1.8 -","4","0.5","","Treadwell, LaRico J; Watkins-Curry, Pilanda; McAlpin, Jacob D.; Rebar, Drew J.; Hebert, Jessica K.; DiTusa, John F.; Chan, Julia Y.","Investigation of Mn, Fe, and Ni Incorporation in CeCo2Al8.","Inorganic chemistry","2015","54","3","963","968","10.1021/ic502356t","","","0.71073","MoKα","","0.0445","0.0276","","","0.0532","0.0581","","","","","","1.04","","","","has coordinates","179519","2020-10-21","18:00:00",""
"4341662","12.477","0.001","14.393","0.004","4.023","0.004","90","","90","","90","","722.5","0.7","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al8 Ce Co1.71 Ni0.27 -","- Al8 Ce Co1.712 Ni0.27 -","- Al32 Ce4 Co6.848 Ni1.08 -","4","0.5","","Treadwell, LaRico J; Watkins-Curry, Pilanda; McAlpin, Jacob D.; Rebar, Drew J.; Hebert, Jessica K.; DiTusa, John F.; Chan, Julia Y.","Investigation of Mn, Fe, and Ni Incorporation in CeCo2Al8.","Inorganic chemistry","2015","54","3","963","968","10.1021/ic502356t","","","0.71073","MoKα","","0.0645","0.0367","","","0.0702","0.0805","","","","","","1.032","","","","has coordinates","179519","2020-10-21","18:00:00",""
"4341663","12.4844","0.001","14.392","0.004","4.026","0.003","90","","90","","90","","723.4","0.6","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al8 Ce Co Mn -","- Al8 Ce Co1.78 Mn0.22 -","- Al32 Ce4 Co7.12 Mn0.88 -","4","0.5","","Treadwell, LaRico J; Watkins-Curry, Pilanda; McAlpin, Jacob D.; Rebar, Drew J.; Hebert, Jessica K.; DiTusa, John F.; Chan, Julia Y.","Investigation of Mn, Fe, and Ni Incorporation in CeCo2Al8.","Inorganic chemistry","2015","54","3","963","968","10.1021/ic502356t","","","0.71073","MoKα","","0.0577","0.0349","","","0.0763","0.0865","","","","","","1.046","","","","has coordinates","179519","2020-10-21","18:00:00",""
"4341664","12.482","0.0005","14.401","0.003","4.029","0.003","90","","90","","90","","724.2","0.6","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al8 Ce Co1.33 Fe0.67 -","- Al8 Ce Co1.33 Fe0.65 -","- Al32 Ce4 Co5.32 Fe2.6 -","4","0.5","","Treadwell, LaRico J; Watkins-Curry, Pilanda; McAlpin, Jacob D.; Rebar, Drew J.; Hebert, Jessica K.; DiTusa, John F.; Chan, Julia Y.","Investigation of Mn, Fe, and Ni Incorporation in CeCo2Al8.","Inorganic chemistry","2015","54","3","963","968","10.1021/ic502356t","","","0.71073","MoKα","","0.0374","0.0288","","","0.0678","0.0725","","","","","","0.973","","","","has coordinates","179519","2020-10-21","18:00:00",""
"4341665","12.477","0.0005","14.391","0.002","4.027","0.002","90","","90","","90","","723.1","0.4","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al8 Ce Co1.77 Fe0.23 -","- Al8 Ce Co1.77 Fe0.23 -","- Al32 Ce4 Co7.08 Fe0.92 -","4","0.5","","Treadwell, LaRico J; Watkins-Curry, Pilanda; McAlpin, Jacob D.; Rebar, Drew J.; Hebert, Jessica K.; DiTusa, John F.; Chan, Julia Y.","Investigation of Mn, Fe, and Ni Incorporation in CeCo2Al8.","Inorganic chemistry","2015","54","3","963","968","10.1021/ic502356t","","","0.71073","MoKα","","0.0404","0.0266","","","0.0583","0.0638","","","","","","1.039","","","","has coordinates","179519","2020-10-21","18:00:00",""
"4341703","12.9178","0.0011","23.0254","0.0019","4.7767","0.0004","90","","90","","90","","1420.8","0.2","296","2","296","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Cd4.45 Eu9 Sb9 -","- Cd4.446 Eu9 Sb9 -","- Cd8.892 Eu18 Sb18 -","2","0.25","","Liu, Xiao-Cun; Wu, Zhen; Xia, Sheng-Qing; Tao, Xu-Tang; Bobev, Svilen","Structural Variability versus Structural Flexibility. A Case Study of Eu9Cd4+xSb9 and Ca9Mn4+xSb9 (x ≈ (1)/2).","Inorganic chemistry","2015","54","3","947","955","10.1021/ic5023505","","","0.71073","MoKα","","0.0294","0.0252","","","0.0567","0.0584","","","","","","1.092","","","","has coordinates","179520","2020-10-21","18:00:00",""
"4342598","7.724904","0.00007","8.115684","0.000068","5.698222","0.000056","90","","90","","90","","357.238","0.006","300","","300","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al4 Bi2 O9 -","- Al4 Bi2 O9 -","- Al8 Bi4 O18 -","2","0.25","","Liu, Chengyin; Xia, Zhiguo; Chen, Mingyue; Molokeev, Maxim S.; Liu, Quanlin","Near-Infrared Luminescence and Color Tunable Chromophores Based on Cr(3+)-Doped Mullite-Type Bi2(Ga,Al)4O9 Solid Solutions.","Inorganic chemistry","2015","54","4","1876","1882","10.1021/ic502779d","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","4.81","2.706","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"4342599","7.89343","0.00012","8.26181","0.00012","5.855092","0.000094","90","","90","","90","","381.834","0.01","300","","300","","","","","","","","","4","P b a m","-P 2 2ab","55","","","Bi2 Ga3 Al O9","- Al Bi2 Ga3 O9 -","- Al Bi2 Ga3 O9 -","- Al2 Bi4 Ga6 O18 -","2","0.25","","Liu, Chengyin; Xia, Zhiguo; Chen, Mingyue; Molokeev, Maxim S.; Liu, Quanlin","Near-Infrared Luminescence and Color Tunable Chromophores Based on Cr(3+)-Doped Mullite-Type Bi2(Ga,Al)4O9 Solid Solutions.","Inorganic chemistry","2015","54","4","1876","1882","10.1021/ic502779d","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.85","2.369","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4342600","7.83649","0.00018","8.20994","0.00018","5.79503","0.00014","90","","90","","90","","372.835","0.015","300","","300","","","","","","","","","4","P b a m","-P 2 2ab","55","","","Bi2 Ga2 Al2 O9","- Al2 Bi2 Ga2 O9 -","- Al2 Bi2 Ga2 O9 -","- Al4 Bi4 Ga4 O18 -","2","0.25","","Liu, Chengyin; Xia, Zhiguo; Chen, Mingyue; Molokeev, Maxim S.; Liu, Quanlin","Near-Infrared Luminescence and Color Tunable Chromophores Based on Cr(3+)-Doped Mullite-Type Bi2(Ga,Al)4O9 Solid Solutions.","Inorganic chemistry","2015","54","4","1876","1882","10.1021/ic502779d","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","2.17","2.672","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4342601","7.77916","0.00024","8.162","0.00023","5.74297","0.00017","90","","90","","90","","364.641","0.019","300","","300","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Al3 Bi2 Ga O9 -","- Al3 Bi2 Ga O9 -","- Al6 Bi4 Ga2 O18 -","2","0.25","","Liu, Chengyin; Xia, Zhiguo; Chen, Mingyue; Molokeev, Maxim S.; Liu, Quanlin","Near-Infrared Luminescence and Color Tunable Chromophores Based on Cr(3+)-Doped Mullite-Type Bi2(Ga,Al)4O9 Solid Solutions.","Inorganic chemistry","2015","54","4","1876","1882","10.1021/ic502779d","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","3.13","3.145","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"4342602","7.929738","0.000072","8.305088","0.000073","5.898189","0.00005","90","","90","","90","","388.438","0.006","300","","300","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi2 Ga4 O9 -","- Bi2 Ga4 O9 -","- Bi4 Ga8 O18 -","2","0.25","","Liu, Chengyin; Xia, Zhiguo; Chen, Mingyue; Molokeev, Maxim S.; Liu, Quanlin","Near-Infrared Luminescence and Color Tunable Chromophores Based on Cr(3+)-Doped Mullite-Type Bi2(Ga,Al)4O9 Solid Solutions.","Inorganic chemistry","2015","54","4","1876","1882","10.1021/ic502779d","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.07","2.331","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"4343242","16.9527","0.0014","12.8816","0.001","16.9068","0.0014","90","","90","","90","","3692.1","0.5","150","2","150","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C18 H54 O6 Si8 Sm -","- C18 H54 O6 Si8 Sm -","- C72 H216 O24 Si32 Sm4 -","4","0.5","","Thalangamaarachchige, Vidura D.; Unruh, Daniel K.; Cordes, David B.; Krempner, Clemens","Synthesis, structure, and reactivity of zwitterionic divalent rare-Earth metal silanides.","Inorganic chemistry","2015","54","9","4189","4191","10.1021/acs.inorgchem.5b00542","","","0.71073","MoKα","","0.0733","0.0604","","","0.1494","0.1585","","","","","","1.24","","","","has coordinates,has disorder","137963","2020-10-21","18:00:00",""
"4344195","8.005","","13.267","","8.059","","90","","90","","90","","855.885","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","K4 Mo2 Cl8 (H2 O)2","","- Cl8 H4 K4 Mo2 O2 -","- Cl8 K4 Mo2 O2 -","- Cl16 K8 Mo4 O4 -","2","0.25","","Brencic, J.V.; Cotton, F.A.","The Octachlorodimolybdate(II) Ion. A New Species with a Quadruple Metal-Metal Bond","Inorganic Chemistry","1969","8","","7","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344577","8.042","0.0002","15.1061","0.0004","4.4867","0.0001","90","","90","","90","","545.06","0.02","130","2","130","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ag Ge4 Li12 -","- Ag Ge4 Li12 -","- Ag2 Ge8 Li24 -","2","0.25","","Henze, Alexander; Fässler, Thomas F","Switching the Structure Type upon Ag Substitution: Synthesis and Crystal as well as Electronic Structures of Li12AgGe4.","Inorganic chemistry","2016","55","2","822","827","10.1021/acs.inorgchem.5b02299","","","0.71073","MoKα","","0.0355","0.0293","","","0.0692","0.0713","","","","","","1.133","","","","has coordinates","175509","2020-10-21","18:00:00",""
"4348985","15.9765","0.0017","15.088","0.0015","15.9616","0.0016","90","","90","","90","","3847.6","0.7","298","2","298.15","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C16 H14 Co2 N4 O8 -","- C16 H14 Co2 N4 O8 -","- C128 H112 Co16 N32 O64 -","8","1","","Yao, Ru-Xin; Qiao, Xiao-Hui; Cui, Xin; Jia, Xiao-Xia; Zhang, Xian-Ming","Hexagonal Co6 and zigzag Co4 cluster based magnetic MOFs with a pcu net for selective catalysis","Inorganic Chemistry Frontiers","2016","3","1","78","","10.1039/C5QI00159E","","","0.71073","MoKα","","0.0715","0.0568","","","0.1641","0.1769","","","","","","1.048","","","","has coordinates,has disorder","233527","2020-10-21","18:00:00",""
"4349600","8.1849","0.0007","10.3302","0.0006","4.7112","0.0003","90","","90","","90","","398.34","0.05","100","","100","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Cs2 Hg Se2 -","- Cs2 Hg Se2 -","- Cs4 Hg2 Se4 -","2","0.25","","Donsbach, C.; Dehnen, S.","Syntheses and properties of selenido mercurates with [HgSe2]2−anions in diverse chemical environments","Inorganic Chemistry Frontiers","2017","4","2","336","","10.1039/C6QI00481D","","","0.71073","MoKα","","0.0334","0.0296","","","0.0777","0.08","","","","","","1.122","","","","has coordinates","234910","2020-10-21","18:00:00",""
"4350462","25.522","0.004","20.962","0.01","22.967","0.01","90","","90","","90","","12287","8","293","2","293","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C61 H58 Cr La N17 O7 -","- C61 H40 Cr La N17 O7 -","- C488 H320 Cr8 La8 N136 O56 -","8","1","","Estrader, Marta; Ribas, Joan; Tangoulis, Vassilis; Solans, Xavier; Font-Bardía, Merce; Maestro, Miguel; Diaz, Carmen","Synthesis, crystal structure, and magnetic studies of one-dimensional cyano-bridged Ln3±Cr3+ complexes with bpy as a blocking ligand.","Inorganic chemistry","2006","45","20","8239","8250","10.1021/ic060942q","","","0.71073","MoKα","","0.0747","0.0684","","","0.1626","0.1663","","","","","","1.103","","","","has coordinates","239902","2020-10-21","18:00:00",""
"4350463","25.396","0.006","20.883","0.005","22.885","0.008","90","","90","","90","","12137","6","293","2","293","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C61 H58 Ce Cr N17 O7 -","- C61 H39 Ce Cr N17 O7 -","- C488 H312 Ce8 Cr8 N136 O56 -","8","1","","Estrader, Marta; Ribas, Joan; Tangoulis, Vassilis; Solans, Xavier; Font-Bardía, Merce; Maestro, Miguel; Diaz, Carmen","Synthesis, crystal structure, and magnetic studies of one-dimensional cyano-bridged Ln3±Cr3+ complexes with bpy as a blocking ligand.","Inorganic chemistry","2006","45","20","8239","8250","10.1021/ic060942q","","","0.71073","MoKα","","0.0491","0.0411","","","0.1018","0.1095","","","","","","1.254","","","","has coordinates","239902","2020-10-21","18:00:00",""
"4350464","25.419","0.008","20.927","0.006","22.805","0.009","90","","90","","90","","12131","7","293","2","293","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C61 H58 Cr N17 O7 Pr -","- C61 H40 Cr N17 O7 Pr -","- C488 H320 Cr8 N136 O56 Pr8 -","8","1","","Estrader, Marta; Ribas, Joan; Tangoulis, Vassilis; Solans, Xavier; Font-Bardía, Merce; Maestro, Miguel; Diaz, Carmen","Synthesis, crystal structure, and magnetic studies of one-dimensional cyano-bridged Ln3±Cr3+ complexes with bpy as a blocking ligand.","Inorganic chemistry","2006","45","20","8239","8250","10.1021/ic060942q","","","0.71073","MoKα","","0.1986","0.1153","","","0.2364","0.2731","","","","","","1.212","","","","has coordinates","239902","2020-10-21","18:00:00",""
"4350465","25.429","0.003","20.99","0.005","22.831","0.004","90","","90","","90","","12186","4","293","2","293","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C61 H58 Cr N17 Nd O7 -","- C61 H39 Cr N17 Nd O7 -","- C488 H312 Cr8 N136 Nd8 O56 -","8","1","","Estrader, Marta; Ribas, Joan; Tangoulis, Vassilis; Solans, Xavier; Font-Bardía, Merce; Maestro, Miguel; Diaz, Carmen","Synthesis, crystal structure, and magnetic studies of one-dimensional cyano-bridged Ln3±Cr3+ complexes with bpy as a blocking ligand.","Inorganic chemistry","2006","45","20","8239","8250","10.1021/ic060942q","","","0.71073","MoKα","","0.0822","0.0754","","","0.1686","0.1718","","","","","","1.16","","","","has coordinates","239902","2020-10-21","18:00:00",""
"4503080","10.4576","0.0003","17.0583","0.0005","20.9776","0.0005","90","","90","","90","","3742.17","0.18","90","1","90","1","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C98 H72 Cd2 N10 S8 -","- C98 H72 Cd2 N10 S8 -","- C196 H144 Cd4 N20 S16 -","2","0.25","","Konarev, Dmitri V.; Khasanov, Salavat S.; Kovalevsky, Andrey Yu.; Lopatin, Dmitri V.; Rodaev, Vyacheslav V.; Saito, Gunzi; Náfrádi, Bálint; Forró, László; Lyubovskaya, Rimma N.","Supramolecular Approach to the Synthesis of [60]Fullerene−Metal Dithiocarbamate Complexes, {(MII(R2dtc)2)x·L}·C60(M = Zn, Cd, Hg, Fe, and Mn;x= 1 and 2). The Study of Magnetic Properties and Photoconductivity","Crystal Growth & Design","2008","8","4","1161","","10.1021/cg0702481","","","0.71073","MoKα","","0.028","0.0237","","","0.0649","0.0681","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503082","10.349","0.0004","16.9698","0.0007","20.8387","0.0009","90","","90","","90","","3659.7","0.3","90","1","90","1","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C98 H72 Fe2 N10 S8 -","- C98 H72 Fe2 N10 S8 -","- C196 H144 Fe4 N20 S16 -","2","0.25","","Konarev, Dmitri V.; Khasanov, Salavat S.; Kovalevsky, Andrey Yu.; Lopatin, Dmitri V.; Rodaev, Vyacheslav V.; Saito, Gunzi; Náfrádi, Bálint; Forró, László; Lyubovskaya, Rimma N.","Supramolecular Approach to the Synthesis of [60]Fullerene−Metal Dithiocarbamate Complexes, {(MII(R2dtc)2)x·L}·C60(M = Zn, Cd, Hg, Fe, and Mn;x= 1 and 2). The Study of Magnetic Properties and Photoconductivity","Crystal Growth & Design","2008","8","4","1161","","10.1021/cg0702481","","","0.71073","MoKα","","0.0395","0.0342","","","0.1499","0.1565","","","","","","1.365","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503085","10.441","0.0004","17.0608","0.0006","20.9215","0.0007","90","","90","","90","","3726.8","0.2","100","2","100","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C98 H76 Mn2 N10 S8 -","- C98 H76 Mn2 N10 S8 -","- C196 H152 Mn4 N20 S16 -","2","0.25","","Konarev, Dmitri V.; Khasanov, Salavat S.; Kovalevsky, Andrey Yu.; Lopatin, Dmitri V.; Rodaev, Vyacheslav V.; Saito, Gunzi; Náfrádi, Bálint; Forró, László; Lyubovskaya, Rimma N.","Supramolecular Approach to the Synthesis of [60]Fullerene−Metal Dithiocarbamate Complexes, {(MII(R2dtc)2)x·L}·C60(M = Zn, Cd, Hg, Fe, and Mn;x= 1 and 2). The Study of Magnetic Properties and Photoconductivity","Crystal Growth & Design","2008","8","4","1161","","10.1021/cg0702481","","x-ray","0.71073","MoKα","","0.0388","0.0364","","","0.113","0.1146","","","","","","1.067","","","","has coordinates","179561","2020-10-21","18:00:00",""
"4503086","10.2365","0.0005","16.8848","0.0008","20.818","0.001","90","","90","","90","","3598.2","0.3","90","2","90","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C92 H57 Cl N6 S8 Zn2 -","- C91 H54 Cl N6 S8 Zn2 -","- C182 H108 Cl2 N12 S16 Zn4 -","2","0.25","","Konarev, Dmitri V.; Khasanov, Salavat S.; Kovalevsky, Andrey Yu.; Lopatin, Dmitri V.; Rodaev, Vyacheslav V.; Saito, Gunzi; Náfrádi, Bálint; Forró, László; Lyubovskaya, Rimma N.","Supramolecular Approach to the Synthesis of [60]Fullerene−Metal Dithiocarbamate Complexes, {(MII(R2dtc)2)x·L}·C60(M = Zn, Cd, Hg, Fe, and Mn;x= 1 and 2). The Study of Magnetic Properties and Photoconductivity","Crystal Growth & Design","2008","8","4","1161","","10.1021/cg0702481","","","0.71073","MoKα","","0.0702","0.0548","","","0.158","0.1806","","","","","","1.137","","","","has coordinates,has disorder","179561","2020-10-21","18:00:00",""
"4503884","14.322","0.001","22.811","0.002","7.923","0.0007","90","","90","","90","","2588.4","0.4","293","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C15 H12 Cl I6 Se4 -","- C15 H24 Cl I6 Se4 -","- C60 H96 Cl4 I24 Se16 -","4","0.5","","Yamamoto, Hiroshi M.; Kosaka, Yosuke; Maeda, Ryoko; Yamaura, Jun-ichi; Nakao, Akiko; Nakamura, Toshikazu; Kato, Reizo","Supramolecular insulating networks sheathing conducting nanowires based on organic radical cations.","ACS nano","2008","2","1","143","155","10.1021/nn700035t","","","0.7107","MoKα","","","0.0636","","","","0.158","","","","","","1.468","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504922","7.8217","0.0008","19.228","0.002","7.438","0.0008","90","","90","","90","","1118.6","0.2","123.2","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C14 H26 N3 O8 S2 -","- C15.4 H18 N6 O8 S2 -","- C30.8 H36 N12 O16 S4 -","2","0.25","","Voogt, Jason N.; Blanch, Harvey W.","Temperature-Dependent Solvent Disruption of Guanidinium-1,5-Naphthalenedisulfonate Networks Yields a One-Dimensional Pore Structure","Crystal Growth & Design","2005","5","3","1135","","10.1021/cg049636i","","","0.7107","MoKα","","","0.0698","","","","0.1067","","","","","","4.495","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4505415","14.7318","0.0009","20.7684","0.0013","7.5127","0.0003","90","","90","","90","","2298.6","0.2","123","2","123","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- C36 H30 Mn3 N28 -","- C36 H22 Mn3 N28 -","- C72 H44 Mn6 N56 -","2","0.25","","Kutasi, Anna M.; Harris, Alexander R.; Batten, Stuart R.; Moubaraki, Boujemaa; Murray, Keith S.","Coordination Polymers of Dicyanamide and Methylpyrazine: Syntheses, Structures, and Magnetic Properties","Crystal Growth & Design","2004","4","3","605","","10.1021/cg049952x","","","0.71073","MoKα","","0.1423","0.0848","","","0.1442","0.1626","","","","","","1.069","","","","has coordinates","179589","2020-10-21","18:00:00",""
"4506747","5.3699","0.0008","10.667","0.0017","10.8909","0.0017","90","","90","","90","","623.84","0.17","291","2","291","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C14 H10 N4 Ni O4 -","- C14 H10 N4 Ni O4 -","- C28 H20 N8 Ni2 O8 -","2","0.25","","Tao, Tao; Lei, Yan-Hua; Peng, Yu-Xin; Wang, Ying; Huang, Wei; Chen, Zhao-Xu; You, Xiao-Zeng","The First Observation of One-Dimensional Naphthalenediimidato-Based Transition-Metal Coordination Polymers: Syntheses, Crystal Structures and Properties","Crystal Growth & Design","2012","12","9","4580","","10.1021/cg300776y","","","0.71073","MoKα","","0.0499","0.0363","","","0.0806","0.0856","","","","","","0.969","","","","has coordinates","179603","2020-10-21","18:00:00",""
"4509535","11.115","0.002","20.78","0.004","9.91","0.002","90","","90","","90","","2288.9","0.8","296","2","298","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C21 H12 Co N2 O4 -","- C21 H12 Co N2 O4 -","- C84 H48 Co4 N8 O16 -","4","0.5","","Sun, Li-Xin; Qi, Yan; Che, Yun-Xia; Batten, Stuart R.; Zheng, Ji-Min","Three Unprecedented Entangled Metal−Organic Frameworks: Self-Penetration and Hydrothermal in Situ Ligand Formation","Crystal Growth & Design","2009","9","7","2995","","10.1021/cg9002719","","x-ray","0.71073","MoKα","","0.0989","0.0831","","","0.2632","0.2824","","","","","","1.019","","","","has coordinates","179631","2020-10-21","18:00:00",""
"4513193","12.5143","0.0004","14.4007","0.0005","4.0339","0.0001","90","","90","","90","","726.97","0.04","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al8 Co2 La -","- Al8 Co2 La -","- Al32 Co8 La4 -","4","0.5","","Watkins-Curry, Pilanda; Burnett, Joseph Vade; Samanta, Tapas; Young, David P.; Stadler, Shane; Chan, Julia Y.","Strategic Crystal Growth and Physical Properties of Single-Crystalline LnCo2Al8(Ln = La‒Nd, Sm, Yb)","Crystal Growth & Design","2015","15","7","3293","","10.1021/acs.cgd.5b00417","","","0.71073","MoKα","","0.0161","0.0157","","","0.0363","0.0365","","","","","","1.232","","","","has coordinates","152785","2020-10-21","18:00:00",""
"4513194","12.472","0.0001","14.387","0.00015","4.022","0.0003","90","","90","","90","","721.69","0.05","298","2","298","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al8 Ce Co2 -","- Al8 Ce Co2 -","- Al32 Ce4 Co8 -","4","0.5","","Watkins-Curry, Pilanda; Burnett, Joseph Vade; Samanta, Tapas; Young, David P.; Stadler, Shane; Chan, Julia Y.","Strategic Crystal Growth and Physical Properties of Single-Crystalline LnCo2Al8(Ln = La‒Nd, Sm, Yb)","Crystal Growth & Design","2015","15","7","3293","","10.1021/acs.cgd.5b00417","","","0.71073","MoKα","","0.0314","0.0255","","","0.056","0.0592","","","","","","0.989","","","","has coordinates","152785","2020-10-21","18:00:00",""
"4513195","12.4602","0.0004","14.3743","0.0005","4.0101","0.0001","90","","90","","90","","718.24","0.04","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al8 Co2 Pr -","- Al8 Co2 Pr -","- Al32 Co8 Pr4 -","4","0.5","","Watkins-Curry, Pilanda; Burnett, Joseph Vade; Samanta, Tapas; Young, David P.; Stadler, Shane; Chan, Julia Y.","Strategic Crystal Growth and Physical Properties of Single-Crystalline LnCo2Al8(Ln = La‒Nd, Sm, Yb)","Crystal Growth & Design","2015","15","7","3293","","10.1021/acs.cgd.5b00417","","","0.71073","MoKα","","0.017","0.0138","","","0.0331","0.035","","","","","","1.047","","","","has coordinates","152785","2020-10-21","18:00:00",""
"4513197","12.4159","0.0006","14.3366","0.0007","3.9831","0.0002","90","","90","","90","","709","0.06","300","2","300","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al8 Co2 Sm -","- Al8 Co2 Sm -","- Al32 Co8 Sm4 -","4","0.5","","Watkins-Curry, Pilanda; Burnett, Joseph Vade; Samanta, Tapas; Young, David P.; Stadler, Shane; Chan, Julia Y.","Strategic Crystal Growth and Physical Properties of Single-Crystalline LnCo2Al8(Ln = La‒Nd, Sm, Yb)","Crystal Growth & Design","2015","15","7","3293","","10.1021/acs.cgd.5b00417","","","0.71073","MoKα","","0.031","0.0298","","","0.0751","0.0766","","","","","","1.081","","","","has coordinates","152785","2020-10-21","18:00:00",""
"4513198","12.411","0.001","14.426","0.0005","3.962","0.0005","90","","90","","90","","709.36","0.11","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al8 Co2 Yb -","- Al8 Co2 Yb -","- Al32 Co8 Yb4 -","4","0.5","","Watkins-Curry, Pilanda; Burnett, Joseph Vade; Samanta, Tapas; Young, David P.; Stadler, Shane; Chan, Julia Y.","Strategic Crystal Growth and Physical Properties of Single-Crystalline LnCo2Al8(Ln = La‒Nd, Sm, Yb)","Crystal Growth & Design","2015","15","7","3293","","10.1021/acs.cgd.5b00417","","","0.71073","MoKα","","0.0397","0.0281","","","0.0606","0.0649","","","","","","1.089","","","","has coordinates","152785","2020-10-21","18:00:00",""
"4514108","17.7576","0.001","12.9229","0.0007","12.7518","0.0007","90","","90","","90","","2926.3","0.3","100","2","100","2","","","","","","","","6","P b a m","-P 2 2ab","55","","(6,6'-dihydroxy-2,2'-bipyridine)-bromo-tricarbonyl-manganese(I)","","- C13 H8 Br Mn N2 O5 -","- C13 H8 Br Mn N2 O5 -","- C104 H64 Br8 Mn8 N16 O40 -","8","1","","Dubey, Abhishek; Nencini, Luca; Fayzullin, Robert R.; Nervi, Carlo; Khusnutdinova, Julia R.","Bio-Inspired Mn(I) Complexes for the Hydrogenation of CO2 to Formate and Formamide","ACS Catalysis","2017","7","6","3864","","10.1021/acscatal.7b00943","","x-ray","0.71073","MoKα","","0.0535","0.0356","","","0.08","0.0852","","","","","","1.017","","","","has coordinates","197388","2020-10-21","18:00:00",""
"4515325","6.8859","0.00011","20.0624","0.0004","16.6453","0.0004","90","","90","","90","","2299.51","0.08","100","","100","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C25 H20 Ca N O6 -","- C22 H11 Ca O5 -","- C88 H44 Ca4 O20 -","4","0.5","","Gładysiak, Andrzej; Deeg, Kathryn S.; Dovgaliuk, Iurii; Chidambaram, Arunraj; Ordiz, Kaili; Boyd, Peter G.; Moosavi, Seyed Mohamad; Ongari, Daniele; Navarro, Jorge A. R.; Smit, Berend; Stylianou, Kyriakos C.","Biporous Metal-Organic Framework with Tunable CO<sub>2</sub>/CH<sub>4</sub> Separation Performance Facilitated by Intrinsic Flexibility.","ACS applied materials & interfaces","2018","10","42","36144","36156","10.1021/acsami.8b13362","","x-ray","0.7153","","","0.1053","0.1024","","","0.3739","0.3805","","","","","","1.916","","","","has coordinates,has disorder","225488","2020-10-21","18:00:00",""
"7001412","16.3148","0.0008","17.8861","0.0011","11.6284","0.0006","90","","90","","90","","3393.3","0.3","100","2","100","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C62 H54 Fe2 Mn3 N22 O7 -","- C62 H48 Fe2 Mn3 N22 O7 -","- C124 H96 Fe4 Mn6 N44 O14 -","2","0.25","","Maji, Tapas Kumar; Pal, Suchetan; Gurunatha, K. L; Govindaraj, A.; Rao, C. N. R.","A bimetallic pillared-layer metal‒organic coordination framework with a 3D biporous structure","Dalton Transactions","2009","","23","4426","4428","10.1039/b818498d","","","0.71073","MoKα","","0.0881","0.0471","","","0.0981","0.113","","","","","","1.021","","","","has coordinates","179712","2020-10-21","18:00:00",""
"7002693","27.022","0.005","28.597","0.005","11.116","0.002","90","","90","","90","","8590","3","298","2","298","2","","","","","","","","7","P b a m","-P 2 2ab","55","","","","- C100 H102 Cu6 N20 O93 Si2 W24 -","- C100 H82 Cu6 N20 O93 Si2 W24 -","- C200 H164 Cu12 N40 O186 Si4 W48 -","2","0.25","","Yu, Fan; Kong, Xiang-Jian; Zheng, Yun-Yun; Ren, Yan-Ping; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","pH-dependent assembly of 0D to 3D Keggin-based coordination polymers: Structures and catalytic properties","Dalton Transactions","2009","","43","9503","9509","10.1039/b911606k","","","0.71073","MoKα","","0.0882","0.0809","","","0.1775","0.1817","","","","","","1.192","","","","has coordinates","179730","2020-10-21","18:00:00",""
"7004273","10.2897","0.0016","23.812","0.004","7.0825","0.0011","90","","90","","90","","1735.3","0.5","293","2","273","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C2 H8 N11 O0.5 Zn -","- C2 H8 N11 O0.5 Zn -","- C16 H64 N88 O4 Zn8 -","8","1","","Liu, Na; Yue, Qi; Wang, Yan-Qin; Cheng, Ai-Ling; Gao, En-Qing","Coordination compounds of bis(5-tetrazolyl)amine with manganese(ii), zinc(ii) and cadmium(ii): synthesis, structure and magnetic properties","Dalton Transactions","2008","","34","4621","","10.1039/b804996c","","","0.71073","MoKα","","0.0774","0.0535","","","0.1318","0.1469","","","","","","1.018","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004773","13.7424","0.0013","18.4993","0.0017","6.957","0.0007","90","","90","","90","","1768.6","0.3","173","2","173","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C12 H17.5 I2 N4.5 Pd -","- C12 H17.5 I2 N4.5 Pd -","- C48 H70 I8 N18 Pd4 -","4","0.5","","Heckenroth, Marion; Kluser, Evelyne; Neels, Antonia; Albrecht, Martin","Palladation of diimidazolium salts at the C4 position: access to remarkably electron-rich palladium(ii) centers","Dalton Transactions","2008","","44","6242","6249","10.1039/b812405a","","","0.71073","MoKα","","0.0481","0.0421","","","0.1153","0.1178","","","","","","1.247","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7007140","15.428","0.004","6.1727","0.0016","5.9765","0.0015","90","","90","","90","","569.2","0.3","298","2","298","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- C2 H3 Cu2 N7 -","- C2 H3 Cu2 N7 -","- C8 H12 Cu8 N28 -","4","0.5","","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","","0.0529","0.0349","","","0.0804","0.087","","","","","","1.04","","","","has coordinates","179775","2020-10-21","18:00:00",""
"7007141","16.37","0.02","6.36","0.009","6.502","0.009","90","","90","","90","","676.9","1.6","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- C2 H3 Ag2 N7 -","- C2 H3 Ag2 N7 -","- C8 H12 Ag8 N28 -","4","0.5","","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","","0.0551","0.0398","","","0.101","0.1392","","","","","","1.356","","","","has coordinates","179775","2020-10-21","18:00:00",""
"7009421","16.5047","0.0004","17.1444","0.0004","20.3835","0.0002","90","","90","","90","","5767.8","0.2","180","2","180","2","","","","","","","","7","P b a m","-P 2 2ab","55","","","","- C54 H38 F12 N6 Ni O P2 -","- C62.25 H38 F12 N6 Ni O P2 -","- C249 H152 F48 N24 Ni4 O4 P8 -","4","0.5","","Alcock, Nathaniel W.; Barker, Philip R.; Haider, Johanna M.; Hannon, Michael J.; Painting, Claire L.; Pikramenou, Zoe; Plummer, Edward A.; Rissanen, Kari; Saarenketo, Pauli","Red and blue luminescent metallo-supramolecular coordination polymers assembled through π‒π interactions †","Journal of the Chemical Society, Dalton Transactions","2000","","9","1447","","10.1039/b000871k","","","0.71073","MoKα","","0.176","0.1243","","","0.2877","0.3072","","","","","","1.77","","","","has coordinates,has disorder","179798","2020-10-21","18:00:00",""
"7012580","10.067","0.0002","19.87","0.0001","9.991","0.0003","90","","90","","90","","1998.51","0.07","150","2","150","2","","","","","","","synthesized by the authors","5","P b a m","-P 2 2ab","55","","","","- C2 H8 As2 B7 I -","- C2 H8 As2 B7 I -","- C16 H64 As16 B56 I8 -","8","1","","Mikulášek, Libor; Grüner, Bohumír; Císařová, Ivana; Štíbr, Bohumil","Arsacarborane chemistry. The 7,8,9,11-, 7,9,8,10- and 7,8,9,10-isomers of nido-As2C2B7H9 and some of their halogenated derivativesElectronic supplementary information (ESI) available: selected bond lengths and angles for the crystallographically determined compound 3-I-2 have been also deposited, together with coordinates for the B3LYP/6-31G* calculated structures for all compounds reported. See http://www.rsc.org/suppdata/dt/b2/b212183b/","Dalton Transactions","2003","","7","1332","","10.1039/b212183b","","","0.7107","MoKα","","0.0244","0.0217","","","0.0533","0.0545","","","","","","1.072","","","","has coordinates","179829","2020-10-21","18:00:00",""
"7015494","7.7454","0.0002","7.74872","0.00017","11.7132","0.0002","90","","90","","90","","702.99","0.03","14","","14","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- Cl1.017 Cu La Nb2 O7 -","- Cl1.017 Cu La Nb2 O7 -","- Cl4.068 Cu4 La4 Nb8 O28 -","4","0.5","","Hernandez, Olivier J.; Tassel, Cédric; Nakano, Kunihiro; Paulus, Werner; Ritter, Clemens; Collet, Eric; Kitada, Atsushi; Yoshimura, Kazuyoshi; Kageyama, Hiroshi","First single-crystal synthesis and low-temperature structural determination of the quasi-2D quantum spin compound (CuCl)LaNb2O7.","Dalton transactions (Cambridge, England : 2003)","2011","40","17","4605","4613","10.1039/c0dt01665a","","","0.71069","MoKα","","0.0316","0.0316","","","0.0376","0.0376","","","","2.1","2.1","2.1","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7017647","14.296","0.004","17.317","0.005","11.714","0.006","90","","90","","90","","2900","1.9","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C22.1 H29.4 Cd N3 O8.1 -","- C18 H13 Cd N3 O4 -","- C72 H52 Cd4 N12 O16 -","4","0.5","","Wang, Hai-Ning; Meng, Xing; Qin, Chao; Wang, Xin-Long; Yang, Guang-Sheng; Su, Zhong-Min","A series of pillar-layer metal-organic frameworks based on 5-aminoisophthalic acid and 4,4'-bipyridine.","Dalton transactions (Cambridge, England : 2003)","2012","41","3","1047","1053","10.1039/c1dt11304f","","","0.71069","MoKα","","0.0635","0.058","","","0.1737","0.1785","","","","","","1.018","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7017648","14.304","0.0016","16.97","0.002","11.098","0.002","90","","90","","90","","2693.9","0.7","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C23.2 H24.7 Cu N4.3 O5.3 -","- C18 H13 Cu N3 O4 -","- C72 H52 Cu4 N12 O16 -","4","0.5","","Wang, Hai-Ning; Meng, Xing; Qin, Chao; Wang, Xin-Long; Yang, Guang-Sheng; Su, Zhong-Min","A series of pillar-layer metal-organic frameworks based on 5-aminoisophthalic acid and 4,4'-bipyridine.","Dalton transactions (Cambridge, England : 2003)","2012","41","3","1047","1053","10.1039/c1dt11304f","","","0.71069","MoKα","","0.0877","0.0774","","","0.2151","0.2243","","","","","","1.105","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7017649","14.324","0.003","16.713","0.003","11.371","0.002","90","","90","","90","","2722.2","0.9","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C24.4 H27.4 Co N4.6 O5.6 -","- C18 H13 Co N3 O4 -","- C72 H52 Co4 N12 O16 -","4","0.5","","Wang, Hai-Ning; Meng, Xing; Qin, Chao; Wang, Xin-Long; Yang, Guang-Sheng; Su, Zhong-Min","A series of pillar-layer metal-organic frameworks based on 5-aminoisophthalic acid and 4,4'-bipyridine.","Dalton transactions (Cambridge, England : 2003)","2012","41","3","1047","1053","10.1039/c1dt11304f","","","0.71069","MoKα","","0.1453","0.0817","","","0.1855","0.2044","","","","","","0.991","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7018192","7.60334","0.00007","8.21091","0.000073","8.53905","0.000074","90","","90","","90","","533.096","0.008","293","","293","","","","","","","","","4","P b a m","-P 2 2ab","55","Bi2MnAl6O14","Bi2MnAl6O14","","- Al11.82 Bi4 Mn2.18 O28 -","- Al12.1052 Bi4 Mn1.8948 O28 -","- Al12.1052 Bi4 Mn1.8948 O28 -","1","0.125","","Yang, Tao; Petricek, Vaclav; Wan, Wei; Wei, Zidong; Sun, Junliang","Mullite-derivative Bi(2)Mn(x)Al(7-x)O(14) (xσim 1): structure determination by powder X-ray diffraction from a multi-phase sample.","Dalton transactions (Cambridge, England : 2003)","2012","41","10","2884","2889","10.1039/c2dt11855f","powder diffraction","","1.5406","CuKα1","","","","","","","","","1.958","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7020218","7.1205","0.0007","14.1467","0.0013","13.5789","0.0012","90","","90","","90","","1367.8","0.2","100","2","100","2","","","","","","","","4","P b a m","-P 2 2ab","55","Glutarimidedioxime","","","- C5 H9 N3 O2 -","- C5 H9 N3 O2 -","- C40 H72 N24 O16 -","8","1","","Tian, Guoxin; Teat, Simon J.; Zhang, Zhiyong; Rao, Linfeng","Sequestering uranium from seawater: binding strength and modes of uranyl complexes with glutarimidedioxime.","Dalton transactions (Cambridge, England : 2003)","2012","41","38","11579","11586","10.1039/c2dt30978e","","","0.7749","synchrotron","","0.0508","0.0446","","","0.129","0.1336","","","","","","1.145","","","","has coordinates","179906","2020-10-21","18:00:00",""
"7021257","21.7006","0.0012","15.385","0.0009","20.0483","0.0011","90","","90","","90","","6693.4","0.7","150","2","150","2","","","","","","","","8","P b a m","-P 2 2ab","55","","","","- C127 H80 Cl2 Fe8 N4 O22 P8 S8 -","- C127 H80 Cl2 Fe8 N4 O22 P8 S8 -","- C254 H160 Cl4 Fe16 N8 O44 P16 S16 -","2","0.25","","Ghosh, Shishir; Hogarth, Graeme; Hollingsworth, Nathan; Holt, Katherine B.; Richards, Idris; Richmond, Michael G.; Sanchez, Ben E.; Unwin, David","Models of the iron-only hydrogenase: a comparison of chelate and bridge isomers of Fe2(CO)4{Ph2PN(R)PPh2}(μ-pdt) as proton-reduction catalysts.","Dalton transactions (Cambridge, England : 2003)","2013","42","19","6775","6792","10.1039/c3dt50147g","","","0.71073","MoKα","","0.0718","0.0572","","","0.1523","0.1621","","","","","","1.047","","","","has coordinates","179917","2020-10-21","18:00:00",""
"7026826","15.5722","0.0005","19.0829","0.0006","20.3472","0.0007","90","","90","","90","","6046.4","0.3","150","2","150","2","","","","","","","","7","P b a m","-P 2 2ab","55","","","","- C58 H44 F12 N6 O P2 Ru -","- C58 H42 F12 N6 O P2 Ru -","- C232 H168 F48 N24 O4 P8 Ru4 -","4","0.5","","Natrajan, Louise S.; Toulmin, Anita; Chew, Alex; Magennis, Steven W.","Two-photon luminescence from polar bis-terpyridyl-stilbene derivatives of Ir(III) and Ru(II).","Dalton transactions (Cambridge, England : 2003)","2010","39","45","10837","10846","10.1039/c0dt00750a","","","0.6813","Synchrotron","","0.0795","0.0652","","","0.1987","0.2091","","","","","","1.093","","","","has coordinates","179974","2020-10-21","18:00:00",""
"7028005","18.706","0.005","20.764","0.005","7.505","0.002","90","","90","","90","","2915","1.3","293","2","293","2","","","","","","","","7","P b a m","-P 2 2ab","55","","","","- C16 H30 B10 I2 N2 Pd S2 -","- C17.16 H30 B10 I2 N Pd S2 -","- C68.64 H120 B40 I8 N4 Pd4 S8 -","4","0.5","","McKinney, James D.; Chen, Hongli; Hamor, Thomas A.; Paxton, Keith; Jones, Christopher J.","Transition metal complexes containing the 1,2-dicarba-closo-dodecaborane-1,2-dithiolate ligand: crystal structures of [4-MeC5H4NMe]2[Pd(S2C2B10H10)I2], [NEt3H][Mo(η5-C5H5)(NO)(S2C2B10H10)I], [NBu4][Re(O)(S2C2B10H10)2] and [4-MeC5H4NMe]2[{Mo(O)(μ-O)(S2C2B10H10)}2]","Journal of the Chemical Society, Dalton Transactions","1998","","13","2163","","10.1039/a802446d","","","0.7107","MoKa","","0.058","0.0415","","0.1148","0.107","","","","1.116","1.113","1.113","","","","","has coordinates","179986","2020-10-21","18:00:00",""
"7028287","19.385","0.012","7.57","0.005","11.54","0.007","90","","90","","90","","1693.4","1.8","296","2","296","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C25 H18 Cl4 Co F8 N12 -","- C25 H18 Cl4 Co F8 N12 -","- C50 H36 Cl8 Co2 F16 N24 -","2","0.25","","Zhang, Zhi-Hui; Zhang, Qing-Qing; Feng, Sheng; Hu, Zhao-Jian; Chen, Sheng-Chun; Chen, Qun; He, Ming-Yang","Fluorinated metal-organic frameworks of 1,4-bis(1,2,4-triazol-1-ylmethyl)-2,3,5,6-tetrafluorobenzene: synergistic interactions of ligand isomerism and counteranions.","Dalton transactions (Cambridge, England : 2003)","2014","43","2","646","655","10.1039/c3dt52211c","","","0.71073","MoKα","","0.0911","0.0569","","","0.1498","0.1682","","","","","","1.002","","","","has coordinates","179988","2020-10-21","18:00:00",""
"7031701","9.277","0.003","17.304","0.006","4.793","0.0017","90","","90","","90","","769.4","0.5","173","2","173","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C0.25 H4.5 Cl0.5 Cu0.5 N1.5 O2.75 -","- C0.25 H5 Cl0.5 Cu0.5 N1.5 O2.75 -","- C2 H40 Cl4 Cu4 N12 O22 -","8","1","","Zhang, Xiao; Nishihara, Sadafumi; Nakano, Yuki; Yoshida, Erina; Kato, Chisato; Ren, Xiao-Ming; Maryunina, Kseniya Yu; Inoue, Katsuya","A magnetically isolated cuprate spin-ladder system: synthesis, structures, and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2014","43","34","12974","","10.1039/c4dt01746c","","","0.71073","MoKα","","0.0666","0.0617","","","0.1509","0.1539","","","","","","1.017","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7036637","13.884","0.004","27.64","0.008","7.651","0.003","90","","90","","90","","2936.1","1.7","100","2","100","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- C6 H10 I4 N4 -","- C6 H10 I4 N4 -","- C48 H80 I32 N32 -","8","1","","Węcławik, M; Szklarz, P.; Medycki, W.; Janicki, R.; Piecha-Bisiorek, A; Zieliński, P; Jakubas, R.","Unprecedented transformation of [I(-)·I3(-)] to [I4(2-)] polyiodides in the solid state: structures, phase transitions and characterization of dipyrazolium iodide triiodide.","Dalton transactions (Cambridge, England : 2003)","2015","44","42","18447","18458","10.1039/c5dt02265g","","","0.71073","MoKα","","0.0388","0.0267","","","0.0575","0.0604","","","","","","1.03","","","","has coordinates","212110","2020-10-21","18:00:00",""
"7037483","7.95579","0.00009","8.39146","0.00009","5.98242","0.00007","90","","90","","90","","399.391","0.008","293","","293","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Bi2 Cr Fe3 O9 -","- Bi2 Cr Fe3 O9 -","- Bi4 Cr2 Fe6 O18 -","2","0.25","","Rozova, M. G.; Grigoriev, V. V.; Bobrikov, I. A.; Filimonov, D. S.; Zakharov, K. V.; Volkova, O. S.; Vasiliev, A. N.; Antipov, E. V.; Tsirlin, A. A.; Abakumov, A. M.","Synthesis, structure and magnetic ordering of the mullite-type Bi2Fe4-xCrxO9 solid solutions with a frustrated pentagonal Cairo lattice.","Dalton transactions (Cambridge, England : 2003)","2016","45","3","1192","1200","10.1039/c5dt04296h","powder diffraction","neutron","","neutron","","0.0598","0.0564","","0.0415","0.0411","","","","1.41","","","","","","","has coordinates","288070","2023-12-06","12:58:00",""
"7038375","11.61353","0.00022","11.60313","0.00024","5.924881","0.000086","90","","90","","90","","798.4","0.03","273","","273","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- F7 Ge N3 -","- F7 Ge N3 -","- F28 Ge4 N12 -","4","0.5","","Mel'nikova, S. V.; Molokeev, M. S.; Laptash, N. M.; Misyul, S. V.","A non-typical sequence of phase transitions in (NH4)3GeF7: optical and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2016","45","12","5321","5327","10.1039/c5dt04907e","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","4.03","2.506","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7039846","12.1515","0.0006","12.9367","0.0007","4.1966","0.0002","90","","90","","90","","659.71","0.06","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","barium lanthanum indium selenide (1/2/2/7)","barium lanthanum indium selenide (1/2/2/7)","","- Ba In2 La2 Se7 -","- Ba In2 La2 Se7 -","- Ba2 In4 La4 Se14 -","2","0.25","","Yin, Wenlong; Iyer, Abishek K.; Lin, Xinsong; Li, Chao; Yao, Jiyong; Mar, Arthur","Quaternary chalcogenides BaRE2In2Ch7 (RE = La-Nd; Ch = S, Se) containing InCh5 trigonal bipyramids.","Dalton transactions (Cambridge, England : 2003)","2016","45","31","12329","12337","10.1039/c6dt02385a","","","0.71073","MoKα","","0.0354","0.0279","","","0.0569","0.0597","","","","","","1.144","","","","has coordinates","185456","2020-10-21","18:00:00",""
"7039847","11.5895","0.0007","12.3001","0.0008","4.0028","0.0002","90","","90","","90","","570.61","0.06","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","barium neodymium indium sulfide (1/2/2/7)","barium neodymium indium sulfide (1/2/2/7)","","- Ba In2 Nd2 S7 -","- Ba In2 Nd2 S7 -","- Ba2 In4 Nd4 S14 -","2","0.25","","Yin, Wenlong; Iyer, Abishek K.; Lin, Xinsong; Li, Chao; Yao, Jiyong; Mar, Arthur","Quaternary chalcogenides BaRE2In2Ch7 (RE = La-Nd; Ch = S, Se) containing InCh5 trigonal bipyramids.","Dalton transactions (Cambridge, England : 2003)","2016","45","31","12329","12337","10.1039/c6dt02385a","","","0.71073","MoKα","","0.0339","0.0276","","","0.0598","0.0621","","","","","","1.186","","","","has coordinates","185456","2020-10-21","18:00:00",""
"7039848","12.1364","0.0007","12.8927","0.0008","4.1741","0.0003","90","","90","","90","","653.13","0.07","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","barium cerium indium selenide (1/2/2/7)","barium cerium indium selenide (1/2/2/7)","","- Ba Ce2 In2 Se7 -","- Ba Ce2 In2 Se7 -","- Ba2 Ce4 In4 Se14 -","2","0.25","","Yin, Wenlong; Iyer, Abishek K.; Lin, Xinsong; Li, Chao; Yao, Jiyong; Mar, Arthur","Quaternary chalcogenides BaRE2In2Ch7 (RE = La-Nd; Ch = S, Se) containing InCh5 trigonal bipyramids.","Dalton transactions (Cambridge, England : 2003)","2016","45","31","12329","12337","10.1039/c6dt02385a","","","0.71073","MoKα","","0.0357","0.0274","","","0.0562","0.059","","","","","","1.148","","","","has coordinates","185456","2020-10-21","18:00:00",""
"7039849","12.1358","0.001","12.851","0.0011","4.1363","0.0004","90","","90","","90","","645.09","0.1","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","barium neodymium indium selenide (1/2/2/7)","barium neodymium indium selenide (1/2/2/7)","","- Ba In2 Nd2 Se7 -","- Ba In2 Nd2 Se7 -","- Ba2 In4 Nd4 Se14 -","2","0.25","","Yin, Wenlong; Iyer, Abishek K.; Lin, Xinsong; Li, Chao; Yao, Jiyong; Mar, Arthur","Quaternary chalcogenides BaRE2In2Ch7 (RE = La-Nd; Ch = S, Se) containing InCh5 trigonal bipyramids.","Dalton transactions (Cambridge, England : 2003)","2016","45","31","12329","12337","10.1039/c6dt02385a","","","0.71073","MoKα","","0.0604","0.0386","","","0.0767","0.0854","","","","","","1.119","","","","has coordinates","185456","2020-10-21","18:00:00",""
"7039850","11.5947","0.0007","12.3439","0.0008","4.0413","0.0003","90","","90","","90","","578.41","0.07","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","barium cerium indium sulfide (1/2/2/7)","barium cerium indium sulfide (1/2/2/7)","","- Ba Ce2 In2 S7 -","- Ba Ce2 In2 S7 -","- Ba2 Ce4 In4 S14 -","2","0.25","","Yin, Wenlong; Iyer, Abishek K.; Lin, Xinsong; Li, Chao; Yao, Jiyong; Mar, Arthur","Quaternary chalcogenides BaRE2In2Ch7 (RE = La-Nd; Ch = S, Se) containing InCh5 trigonal bipyramids.","Dalton transactions (Cambridge, England : 2003)","2016","45","31","12329","12337","10.1039/c6dt02385a","","","0.71073","MoKα","","0.0436","0.0331","","","0.0708","0.0748","","","","","","1.127","","","","has coordinates","185456","2020-10-21","18:00:00",""
"7039851","11.592","0.0006","12.3232","0.0007","4.021","0.0002","90","","90","","90","","574.4","0.05","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","barium praseodymium indium sulfide (1/2/2/7)","barium praseodymium indium sulfide (1/2/2/7)","","- Ba In2 Pr2 S7 -","- Ba In2 Pr2 S7 -","- Ba2 In4 Pr4 S14 -","2","0.25","","Yin, Wenlong; Iyer, Abishek K.; Lin, Xinsong; Li, Chao; Yao, Jiyong; Mar, Arthur","Quaternary chalcogenides BaRE2In2Ch7 (RE = La-Nd; Ch = S, Se) containing InCh5 trigonal bipyramids.","Dalton transactions (Cambridge, England : 2003)","2016","45","31","12329","12337","10.1039/c6dt02385a","","","0.71073","MoKα","","0.0403","0.03","","","0.0601","0.0634","","","","","","1.141","","","","has coordinates","185456","2020-10-21","18:00:00",""
"7039852","12.1433","0.0008","12.8798","0.0009","4.1547","0.0003","90","","90","","90","","649.81","0.08","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","barium praseodymium indium selenide (1/2/2/7)","barium praseodymium indium selenide (1/2/2/7)","","- Ba In2 Pr2 Se7 -","- Ba In2 Pr2 Se7 -","- Ba2 In4 Pr4 Se14 -","2","0.25","","Yin, Wenlong; Iyer, Abishek K.; Lin, Xinsong; Li, Chao; Yao, Jiyong; Mar, Arthur","Quaternary chalcogenides BaRE2In2Ch7 (RE = La-Nd; Ch = S, Se) containing InCh5 trigonal bipyramids.","Dalton transactions (Cambridge, England : 2003)","2016","45","31","12329","12337","10.1039/c6dt02385a","","","0.71073","MoKα","","0.0439","0.0337","","","0.0726","0.0774","","","","","","1.136","","","","has coordinates","185456","2020-10-21","18:00:00",""
"7039853","11.63","0.0008","12.4202","0.0009","4.0689","0.0003","90","","90","","90","","587.74","0.07","296","2","296","2","","","","","","","","4","P b a m","-P 2 2ab","55","barium lanthanum indium sulfide (1/2/2/7)","barium lanthanum indium sulfide (1/2/2/7)","","- Ba In2 La2 S7 -","- Ba In2 La2 S7 -","- Ba2 In4 La4 S14 -","2","0.25","","Yin, Wenlong; Iyer, Abishek K.; Lin, Xinsong; Li, Chao; Yao, Jiyong; Mar, Arthur","Quaternary chalcogenides BaRE2In2Ch7 (RE = La-Nd; Ch = S, Se) containing InCh5 trigonal bipyramids.","Dalton transactions (Cambridge, England : 2003)","2016","45","31","12329","12337","10.1039/c6dt02385a","","","0.71073","MoKα","","0.0341","0.0272","","","0.0563","0.0584","","","","","","1.104","","","","has coordinates","185456","2020-10-21","18:00:00",""
"7041749","11.39893","0.00048","11.37591","0.0004","5.8343","0.00021","90","","90","","90","","756.55","0.05","213","","213","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- F7 N3 Si -","- F7 N3 Si -","- F28 N12 Si4 -","4","0.5","","Mel'nikova, S. V.; Molokeev, M. S.; Laptash, N. M.; Pogoreltsev, E. I.; Misyul, S. V.; Flerov, I. N.","Sequence of phase transitions in (NH4)3SiF7.","Dalton transactions (Cambridge, England : 2003)","2017","46","8","2609","2617","10.1039/c6dt04874a","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","4.04","1.688","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7043377","6.9541","0.0005","13.8119","0.0012","4.903","0.0004","90","","90","","90","","470.93","0.07","298","2","298.15","","","","","","","","","5","P b a m","-P 2 2ab","55","","Cesium 5-oxotetrazolate","","- C H Cs N4 O -","- C H Cs N4 O -","- C4 H4 Cs4 N16 O4 -","4","0.5","","He, Piao; Wu, Le; Wu, Jin-Ting; Yin, Xin; Gozin, Michael; Zhang, Jian-Guo","Alkali and alkaline earth metal salts of tetrazolone: structurally interesting and excellently thermostable","Dalton Trans.","2017","","","","","10.1039/C7DT01179B","","","0.71073","MoKα","","0.0552","0.0499","","","0.119","0.1213","","","","","","1.248","","","","has coordinates","197905","2020-10-21","18:00:00",""
"7044742","9.6156","0.0003","10.0058","0.0004","15.1898","0.0005","90","","90","","90","","1461.44","0.09","296","2","296","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C6 H12 Mo2 N2 O11 P2 -","- C6 H12 Mo2 N2 O11 P2 -","- C24 H48 Mo8 N8 O44 P8 -","4","0.5","","Elias Jesu Packiam, D.; Vidyasagar, Kanamaluru","Syntheses and characterization of phosphonates and diphosphonates of molybdenum, A4[(MoO3)5(O3PR)2]·xH2O, A2[Mo2O5(O3PR)2] and A2[Mo2O5(O3P-R-PO3)] (A = K, Rb, Cs, Tl, NH4)","Dalton Transactions","2017","","","","","10.1039/C7DT03012F","","","0.71073","MoKα","","0.0286","0.0265","","","0.0655","0.067","","","","","","1.145","","","","has coordinates,has disorder","203098","2020-10-21","18:00:00",""
"7044745","9.7029","0.0017","9.9848","0.0015","15.2069","0.0018","90","","90","","90","","1473.3","0.4","296","2","296","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C6 H4 Mo2 O11 P2 Rb2 -","- C6 H4 Mo2 O11 P2 Rb2 -","- C24 H16 Mo8 O44 P8 Rb8 -","4","0.5","","Elias Jesu Packiam, D.; Vidyasagar, Kanamaluru","Syntheses and characterization of phosphonates and diphosphonates of molybdenum, A4[(MoO3)5(O3PR)2]·xH2O, A2[Mo2O5(O3PR)2] and A2[Mo2O5(O3P-R-PO3)] (A = K, Rb, Cs, Tl, NH4)","Dalton Transactions","2017","","","","","10.1039/C7DT03012F","","","0.71073","MoKα","","0.0914","0.0701","","","0.1799","0.1935","","","","","","1.001","","","","has coordinates,has disorder","203098","2020-10-21","18:00:00",""
"7045152","27.3734","0.0007","28.6387","0.0009","7.1961","0.0002","90","","90","","90","","5641.3","0.3","100","2","100","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C22.5 H10.25 Fe N11.5 O2.5 Pt -","- C22.5 H12.25 Fe N11 O2.5 Pt -","- C180 H98 Fe8 N88 O20 Pt8 -","8","1","","Liu, Fu-Ling; Li, Dong; Su, Li-Jie; Tao, Jun","Reversible three equal-step spin crossover in an iron(ii) Hofmann-type metal-organic framework.","Dalton transactions (Cambridge, England : 2003)","2018","47","5","1407","1411","10.1039/c7dt04205a","","","1.54184","CuKα","","0.0616","0.0532","","","0.1446","0.1524","","","","","","1.081","","","","has coordinates","229459","2020-10-21","18:00:00",""
"7045154","27.5743","0.0007","28.9781","0.0009","7.3466","0.0002","90","","90","","90","","5870.3","0.3","220","2","220","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C22.5 H15.5 Fe N11.5 O2.5 Pt -","- C22.5 H15.5 Fe N11.5 O2.5 Pt -","- C180 H124 Fe8 N92 O20 Pt8 -","8","1","","Liu, Fu-Ling; Li, Dong; Su, Li-Jie; Tao, Jun","Reversible three equal-step spin crossover in an iron(ii) Hofmann-type metal-organic framework.","Dalton transactions (Cambridge, England : 2003)","2018","47","5","1407","1411","10.1039/c7dt04205a","","","1.54184","CuKα","","0.1594","0.112","","","0.2763","0.3043","","","","","","1.113","","","","has coordinates","229459","2020-10-21","18:00:00",""
"7105575","7.588","0.002","7.688","0.002","2.8895","0.0006","90","","90","","90","","168.56","0.07","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Aluminium Silicon Oxide (4.8/1.2/9.6)","Mullite","- Al4.8 O9.6 Si1.2 -","- Al4.8 O9.6 Si1.2 -","- Al4.8 O9.6 Si1.2 -","1","0.125","","Zhang, Pengyu; Liu, Jiachen; Du, Haiyan; Li, Sha; Xu, Rui","A facile preparation of mullite [Al(2)(Al(2.8)Si(1.2))O(9.6)] nanowires by B(2)O(3)-doped molten salts synthesis.","Chemical communications (Cambridge, England)","2010","46","22","3988","3990","10.1039/b927556h","","","","","","0.037","","","","","","","","","","","","","","","has coordinates","180159","2020-10-21","18:00:00",""
"7105619","11.36","0.004","14.155","0.004","14.435","0.004","90","","90","","90","","2321.2","1.2","193","2","193","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C42 H48 N4 O12 Zn2 -","- C42 H50 N4 O12 Zn2 -","- C84 H100 N8 O24 Zn4 -","2","0.25","","Kole, Goutam Kumar; Koh, Lip Lin; Lee, So Young; Lee, Shim Sung; Vittal, Jagadese J.","A new ligand for metal-organic framework and co-crystal synthesis: mechanochemical route to rctt-1,2,3,4-tetrakis-(4'-carboxyphenyl)-cyclobutane.","Chemical communications (Cambridge, England)","2010","46","21","3660","3662","10.1039/c0cc00012d","","","0.71073","MoKα","","0.0996","0.0847","","","0.2526","0.264","","","","","","1.102","","","","has coordinates,has disorder","180160","2020-10-21","18:00:00",""
"7105790","16.7961","0.0004","18.1575","0.0004","11.6335","0.0002","90","","90","","90","","3547.93","0.13","296","2","296","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C62 H51 Cr2 Mn3 N22 O8 -","- C62 H51 Cr2 Mn3 N22 O8 -","- C124 H102 Cr4 Mn6 N44 O16 -","2","0.25","","Arpan Hazra; Prakash Kanoo; Tapas Kumar Maji","High heat of hydrogen adsorption and guest-responsive magnetic modulation in a 3D porous pillared-layer coordination framework","Chem.Commun.","2011","47","","538","","10.1039/c0cc02490b","","","0.71073","MoKα","","0.1018","0.0947","","","0.2252","0.2279","","","","","","1.353","","","","has coordinates","180161","2020-10-21","18:00:00",""
"7106446","12.147","0.002","18.712","0.004","23.253","0.005","90","","90","","90","","5285.3","1.8","180","2","180","2","","","","","","","","8","P b a m","-P 2 2ab","55","","","","- C114 H106 B2 Cu4 F8 N9 O7.5 P4 -","- C114 H103 B2 Cu4 F8 N9 O7.5 P4 -","- C228 H206 B4 Cu8 F16 N18 O15 P8 -","2","0.25","","Dry, Emily; Clegg, Jack; Breiner, Boris; Whitaker, Daniel; Stefak, Roman; Nitschke, Jonathan","Anion templation under pH control of self-assembled [2+2] and [3+3] metallomacrocycles containing a new dicopper(I) motif","Chem.Commun.","2011","47","","6021","","10.1039/c1cc11206f","","","0.71073","MoKα","","0.0425","0.0372","","","0.094","0.0967","","","","","","1.119","","","","has coordinates,has disorder","192777","2020-10-21","18:00:00",""
"7107124","20.914","0.002","14.3821","0.0015","7.4466","0.0008","90","","90","","90","","2239.8","0.4","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C24 H14 Cd2 N6 O12 -","- C24 H14 Cd2 N6 O12 -","- C48 H28 Cd4 N12 O24 -","2","0.25","","Xiao-Feng Wang; Yu Wang; Yue-Biao Zhang; Wei Xue; Jie-Peng Zhang; Xiao-Ming Chen","Layer-by-layer evolution and a hysteretic single-crystal to single-crystal transformation cycle of a flexible pillared-layer open framework","Chem.Commun.","2012","48","","133","","10.1039/c1cc15891k","","","0.71073","MoKα","","0.0713","0.0649","","","0.1762","0.1803","","","","","","1.074","","","","has coordinates","180175","2020-10-21","18:00:00",""
"7107127","20.993","0.004","14.236","0.003","7.4471","0.0015","90","","90","","90","","2225.6","0.8","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C24 H14 Cd2 N6 O12 -","- C24 H14 Cd2 N6 O12 -","- C48 H28 Cd4 N12 O24 -","2","0.25","","Xiao-Feng Wang; Yu Wang; Yue-Biao Zhang; Wei Xue; Jie-Peng Zhang; Xiao-Ming Chen","Layer-by-layer evolution and a hysteretic single-crystal to single-crystal transformation cycle of a flexible pillared-layer open framework","Chem.Commun.","2012","48","","133","","10.1039/c1cc15891k","","","0.71073","MoKα","","0.0983","0.0801","","","0.1951","0.2027","","","","","","1.041","","","","has coordinates","180175","2020-10-21","18:00:00",""
"7108792","23.388","0.003","28.553","0.005","10.7407","0.0016","90","","90","","90","","7172.6","1.9","153","2","153","2","","","","","","","","7","P b a m","-P 2 2ab","55","","","","- C57 H76 F18 N13 O P3 Pd3 -","- C57 H76 F18 N13 O P3 Pd3 -","- C228 H304 F72 N52 O4 P12 Pd12 -","4","0.5","","Ramananda Maity; Arnab Rit; Christian Schulte to Brinke; Constantin G. Daniliuc; F. Ekkehardt Hahn","Metal center dependent coordination modes of a tricarbene ligand","Chem.Commun.","2012","49","","1011","","10.1039/c2cc37446c","","","0.71073","MoKα","","0.1088","0.0642","","","0.1894","0.2193","","","","","","1.01","","","","has coordinates","180191","2020-10-21","18:00:00",""
"7111142","10.727","0.005","21.194","0.009","7.553","0.003","90","","90","","90","","1717.2","1.3","163","2","163","2","","","","","","","","7","P b a m","-P 2 2ab","55","","","","- C13 H13 Cu F6 N P S3 -","- C13 H13 Cu F N P S3 -","- C52 H52 Cu4 F4 N4 P4 S12 -","4","0.5","","Hanton, Lyall R.; Turnbull, Julia M.; Richardson, Christopher; Robinson, Ward T.","Thiophene S-binding of a conformationally constrained thiophenophane leading to the formation of a copper(i) coordination polymer","Chemical Communications","2000","","24","2465","","10.1039/b007579p","","","0.71073","MoKα","","0.09","0.0876","","","0.1809","0.1818","","","","","","1.314","","","","has coordinates,has disorder","180225","2020-10-21","18:00:00",""
"7112607","13.2606","0.0015","17.5002","0.0017","7.1051","0.0011","90","","90","","90","","1648.8","0.4","473","2","473","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C12 H7 Co N2 O4 -","- C12 H7 Co N2 O4 -","- C48 H28 Co4 N8 O16 -","4","0.5","","Rongming Wang; Qingguo Meng; Liangliang Zhang; Haifeng Wang; Fangna Dai; Wenyue Guo; Lianming Zhao; Daofeng Sun","Investigation of the effect of pore size on gas uptake in two fsc metal-organic frameworks","Chem.Commun.","2014","50","","4911","","10.1039/C4CC00477A","","","1.54184","CuKα","","0.0885","0.0768","","","0.2564","0.2708","","","","","","1.078","","","","has coordinates","180240","2020-10-21","18:00:00",""
"7119706","16.2079","0.0018","17.833","0.002","11.6508","0.0012","90","","90","","90","","3367.5","0.6","296","2","296","2","","","","","","","","5","P b a m","-P 2 2ab","55","","compound1","","- C62 H56 Mn5 N22 O8 -","- C62 H56 Mn5 N22 O8 -","- C124 H112 Mn10 N44 O16 -","2","0.25","","Hazra, Arpan; Jana, Saibal; Bonakala, Satyanarayana; Balasubramanian, Sundaram; Maji, Tapas Kumar","Separation/purification of ethylene from an acetylene/ethylene mixture in a pillared-layer porous metal-organic framework.","Chemical communications (Cambridge, England)","2017","53","36","4907","4910","10.1039/c7cc00726d","","","0.71073","MoKα","","0.0604","0.0433","","","0.1238","0.1353","","","","","","1.033","","","","has coordinates","196286","2020-10-21","18:00:00",""
"7119707","16.039","0.005","17.851","0.004","11.558","0.003","90","","90","","90","","3309.2","1.5","408","2","408","2","","","","","","","","5","P b a m","-P 2 2ab","55","","compound1b","","- C62 H48 Mn5 N22 O4 -","- C62 H48 Mn5 N22 O4 -","- C124 H96 Mn10 N44 O8 -","2","0.25","","Hazra, Arpan; Jana, Saibal; Bonakala, Satyanarayana; Balasubramanian, Sundaram; Maji, Tapas Kumar","Separation/purification of ethylene from an acetylene/ethylene mixture in a pillared-layer porous metal-organic framework.","Chemical communications (Cambridge, England)","2017","53","36","4907","4910","10.1039/c7cc00726d","","","0.71073","MoKα","","0.1379","0.1098","","","0.2647","0.2883","","","","","","0.935","","","","has coordinates","196286","2020-10-21","18:00:00",""
"7123274","11.673","0.003","12.166","0.003","8.78","0.002","90","","90","","90","","1246.9","0.5","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ba2 Li2 S6 Sb2 -","- Ba2 Li2 S6 Sb2 -","- Ba8 Li8 S24 Sb8 -","4","0.5","","Abudurusuli, Ailijiang; Wu, Kui; Tudi, Abudukadi; Yang, Zhihua; Pan, Shilie","ABaSbQ3 (A = Li, Na; Q = S, Se): diverse arrangement modes of isolated SbQ3 ligands regulating the magnitudes of birefringences","Chemical Communications","2019","","","","","10.1039/C9CC00560A","","","0.71073","MoKα","","0.024","0.0192","","","0.0373","0.0392","","","","","","1.032","","","","has coordinates","214539","2020-10-21","18:00:00",""
"7123276","12.117","0.004","12.644","0.005","9.102","0.003","90","","90","","90","","1394.5","0.9","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ba Li Sb Se3 -","- Ba Li Sb Se3 -","- Ba8 Li8 Sb8 Se24 -","8","1","","Abudurusuli, Ailijiang; Wu, Kui; Tudi, Abudukadi; Yang, Zhihua; Pan, Shilie","ABaSbQ3 (A = Li, Na; Q = S, Se): diverse arrangement modes of isolated SbQ3 ligands regulating the magnitudes of birefringences","Chemical Communications","2019","","","","","10.1039/C9CC00560A","","","0.71073","MoKα","","0.026","0.0198","","","0.039","0.0415","","","","","","1.045","","","","has coordinates","214539","2020-10-21","18:00:00",""
"7127998","6.5013","0.0008","14.177","0.0015","3.671","0.0004","90","","90","","90","","338.35","0.07","298","2","298.15","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Hf2 O4 S3 Y2 -","- Hf2 O4 S3 Y2 -","- Hf4 O8 S6 Y4 -","2","0.25","","Lu, Zhen-Tao; Yang, Si-Han; Liu, Wenlong; Guo, Sheng-Ping","A series of oxysulfides RE<sub>2</sub>M<sub>2</sub>S<sub>3</sub>O<sub>4</sub> (RE = Y, Tm; M = Zr, Hf) featuring a unique MS<sub>3</sub>O<sub>4</sub> motif and {[M<sub>2</sub>S<sub>3</sub>O<sub>4</sub>]<sup>8-</sup>}<sub>\ιnfty </sub> wrinkle layer.","Chemical communications (Cambridge, England)","2021","57","28","3500","3503","10.1039/d1cc00351h","","","0.71073","MoKα","","0.0281","0.0276","","","0.0737","0.0743","","","","","","1.046","","","","has coordinates","264861","2021-05-05","08:01:46",""
"7127999","6.4784","0.0007","14.1361","0.0016","3.6618","0.0005","90","","90","","90","","335.35","0.07","298","2","298.15","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- O4 S3 Tm2 Zr2 -","- O4 S3 Tm2 Zr2 -","- O8 S6 Tm4 Zr4 -","2","0.25","","Lu, Zhen-Tao; Yang, Si-Han; Liu, Wenlong; Guo, Sheng-Ping","A series of oxysulfides RE<sub>2</sub>M<sub>2</sub>S<sub>3</sub>O<sub>4</sub> (RE = Y, Tm; M = Zr, Hf) featuring a unique MS<sub>3</sub>O<sub>4</sub> motif and {[M<sub>2</sub>S<sub>3</sub>O<sub>4</sub>]<sup>8-</sup>}<sub>\ιnfty </sub> wrinkle layer.","Chemical communications (Cambridge, England)","2021","57","28","3500","3503","10.1039/d1cc00351h","","","0.71073","MoKα","","0.0353","0.0306","","","0.0723","0.0742","","","","","","1.048","","","","has coordinates","264861","2021-05-05","08:01:46",""
"7130019","10.694","0.004","15.017","0.006","3.5633","0.0015","90","","90","","90","","572.2","0.4","273","2","273","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Nb0.67 Pt Se2.67 -","- Nb0.666667 Pt Se2.66667 -","- Nb4 Pt6 Se16 -","6","0.75","","Luo, Mengjia; Wu, Tong; Xu, Shumao; Wang, Ruiqi; Huang, Fu Qiang","Pt modulation NbSe2 with enhanced activity and stability: A new Pt3Nb2Se8 compound for highly-efficient alkaline hydrogen evolution","Chemical Communications","2022","","","","","10.1039/D2CC01765B","","","0.71073","MoKα","","0.0421","0.0273","","","0.0372","0.039","","","","","","1.066","","","","has coordinates","274698","2022-04-26","21:53:45",""
"7150005","20.362","0.002","7.2285","0.0013","10.2891","0.0014","90","","90","","90","","1514.4","0.4","175","2","175","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C20 H10 Ag Cl O4 -","- C20 H10 Ag Cl O4 -","- C80 H40 Ag4 Cl4 O16 -","4","0.5","","Elliott, Eric L.; Hernández, Gerardo A; Linden, Anthony; Siegel, Jay S.","Anion mediated structural motifs in silver(I) complexes with corannulene.","Organic & biomolecular chemistry","2005","3","3","407","413","10.1039/b411987h","","","0.71073","MoKα","","0.0818","0.0597","","","0.1483","0.1632","","","","","","1.067","","","","has coordinates","180286","2020-10-21","18:00:00",""
"7204225","12.51","0.003","14.584","0.003","4.6243","0.0009","90","","90","","90","","843.7","0.3","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Eu5 In2 Sb6 -","- Eu5 In2 Sb6 -","- Eu10 In4 Sb12 -","2","0.25","","Park, Seon-Mi; Choi, Eun Sang; Kang, Woun; Kim, Sung-Jin","Eu5In2Sb6, Eu5In2‒xZnxSb6: rare earth zintl phases with narrow band gaps","Journal of Materials Chemistry","2002","12","6","1839","","10.1039/b106812a","","","0.71073","MoKα","","0.0544","0.035","","","0.1291","0.1439","","","","","","0.877","","","","has coordinates","180373","2020-10-21","18:00:00",""
"7208742","33.8229","0.0008","7.4038","0.0002","9.1147","0.0002","90","","90","","90","","2282.48","0.1","173","2","173","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C19 H26 Ag2 N4 O7 S2 -","- C19 H26 Ag2 N4 O7 S2 -","- C76 H104 Ag8 N16 O28 S8 -","4","0.5","","Park, Sunhong; Lee, Seul-Gi; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sun","Macrocycles incorporating isomeric arms: synthesis and crystal structures of ligands and their mono-, di- and polynuclear supramolecular complexes","CrystEngComm","2012","14","20","6515","","10.1039/c2ce25708d","","","0.71073","MoKα","","0.09","0.0871","","","0.2165","0.218","","","","","","1.208","","","","has coordinates,has disorder","180418","2020-10-21","18:00:00",""
"7208869","17.812","0.0018","15.4281","0.0016","16.3819","0.0017","90","","90","","90","","4501.8","0.8","298","2","298","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C16 H16 Cd2 N4 O9 -","- C16 H16 Cd2 N4 O9 -","- C128 H128 Cd16 N32 O72 -","8","1","","Zhai, Quan-Guo; Zeng, Rong-Rong; Li, Shu-Ni; Jiang, Yu-Cheng; Hu, Man-Cheng","Alkyl substituents introduced into novel d10-metalimidazole-4,5-dicarboxylate frameworks: synthesis, structure diversities and photoluminescence properties","CrystEngComm","2013","15","5","965","","10.1039/c2ce26063h","","","0.71073","MoKα","","0.1093","0.0775","","","0.2072","0.2389","","","","","","1.073","","","","has coordinates,has disorder","180419","2020-10-21","18:00:00",""
"7209175","8.3499","0.0002","12.4558","0.0003","13.7987","0.0004","90","","90","","90","","1435.13","0.06","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- C15 H12 Co O6.5 -","- C15 H11 Co O6.5 -","- C60 H44 Co4 O26 -","4","0.5","","Sun, Hao-Ling; Jiang, Rui; Li, Zongsheng; Dong, Yong Qiang; Du, Miao","Novel (4,8)-connected scu coordination framework constructed by tetrakis(4-benzoic acid)ethylene","CrystEngComm","2013","15","9","1669","","10.1039/c2ce26761f","","","0.71073","MoKα","","0.0433","0.0364","","","0.1022","0.1061","","","","","","1.109","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7209308","8.7251","","9.6207","","6.2432","","90","","90","","90","","524.064","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Ag Hg2 (As O4)","","- Ag As Hg2 O4 -","- Ag As Hg2 O4 -","- Ag4 As4 Hg8 O16 -","4","0.5","","Weil, M.","Investigations in the systems Ag - Hg - X - O (X = As(V), Se(IV), Se(VI)): hydrothermal single crystal growth of Ag3 As O4, Ag Hg(I)2 As O4, Ag Hg(II) As O4, Ag2 Se O4 and the crystal structure of Ag2 Hg(II) (Se O3)2","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2003","58","","1091","1096","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209346","7.158","","13.931","","5.394","","90","","90","","90","","537.879","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","K5 Ag O2 (N O2)2","","- Ag K5 N2 O4 -","- Ag K5 N2 O4 -","- Ag2 K10 N4 O8 -","2","0.25","","Jansen, M.; Bremm, T.","Synthese und Einkristall-Strukturanalyse des Oxidnitrits K5AgO2(NO2)2","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1993","48","","230","232","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209431","9.2507","","12.4167","","3.0524","","90","","90","","90","","350.608","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Co5 Mn (B O3)2 O4","","- B2 Co5 Mn O10 -","- B2 Co5 Mn O10 -","- B4 Co10 Mn2 O20 -","2","0.25","","Bluhm, K.; Utzolino, A.","Synthese und roentgenographische Charakterisierung von zwei neuen Verbindungen des Ludwigit-Strukturtyps: Co5 Sn (B O3)2 O4 und Co5 Mn (B O3)2 O4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1996","51","","305","308","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209432","9.444","","12.338","","3.1054","","90","","90","","90","","361.841","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Co5 Sn (B O3)2 O4","","- B2 Co5 O10 Sn -","- B2 Co5 O10 Sn -","- B4 Co10 O20 Sn2 -","2","0.25","","Bluhm, K.; Utzolino, A.","Synthese und roengenographische Charakterisierung von zwei neuen Verbindungen des Ludwigit-Strukturtyps: Co5 Sn (B O3)2 O4 und Co5 Mn (B O3)2 O4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1996","51","","305","308","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209438","9.2641","","12.366","","3.0455","","90","","90","","90","","348.892","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Zn5 Mn (B O3)2 O4","","- B2 Mn O10 Zn5 -","- B2 Mn O10 Zn5 -","- B4 Mn2 O20 Zn10 -","2","0.25","","Busche, S.; Bluhm, K.","Zur Synthese und Kristallstruktur von Zinkboratoxiden mit isolierten, trigonal planaren BO3-Baugruppen: Zn5Mn(BO3)2O4 und ZnFe(BO3)O","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1995","50","","1450","1454","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209469","9.26","","12.415","","3.0496","","90","","90","","90","","350.591","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Mn2 Mn (B O3) O2","","- B Mn3 O5 -","- B Mn3 O5 -","- B4 Mn12 O20 -","4","0.5","","Utzolino, A.; Bluhm, K.","Neue Einsichten zur Stabilisierung des Hulsit-Strukturtyps am Beispiel von Mn(II)2 Mn(III) (B O3) O2 und Mn(II) Sr Mn(III) (B O3) O2","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1996","51","","1433","1438","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209476","5.624","","11.228","","4.185","","90","","90","","90","","264.267","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Th2 Co B10","","- B10 Co Th2 -","- B10 Co Th2 -","- B20 Co2 Th4 -","2","0.25","","Konrad, T.; Jeitschko, W.","The thorium transition metal borides Th2 T B10 (T = Fe, Co, Ni) with a structure very silmilar to that of Ca B6","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1995","50","","1195","1199","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209477","5.627","","11.261","","4.183","","90","","90","","90","","265.059","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Th2 Fe B10","","- B10 Fe Th2 -","- B10 Fe Th2 -","- B20 Fe2 Th4 -","2","0.25","","Konrad, T.; Jeitschko, W.","The thorium transition metal borides Th2 T B10 (T= Fe, Co, Ni) with a structure very silmilar to that of Ca B6","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1995","50","","1195","1199","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209478","5.646","","11.204","","4.173","","90","","90","","90","","263.975","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Th2 Ni B10","","- B10 Ni Th2 -","- B10 Ni Th2 -","- B20 Ni2 Th4 -","2","0.25","","Jeitschko, W.; Konrad, T.","The thorium transition metal borides Th2 T B10 (T = Fe, Co, Ni) with a structure very silmilar to that of Ca B6","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1995","50","","1195","1199","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209496","8.407","","6.166","","10.22","","90","","90","","90","","529.78","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Cu Ho2 (B8 O16)","","- B8 Cu Ho2 O16 -","- B8 Cu Ho2 O16 -","- B16 Cu2 Ho4 O32 -","2","0.25","","Bluhm, K.; Wiesch, A.; Timm, H.","Ueber Cu Dy2 (B8 O16) und Cu Ho2 (B8 O16): Zwei neue ""Metaborate"" mit einem infinite(B8 O16)8- -Anion","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1998","53","","1","4","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7211218","29.541","0.006","18.148","0.004","27.02","0.005","90","","90","","90","","14486","5","173","2","173","2","","","","","","","","7","P b a m","-P 2 2ab","55","","","","- C118 H103 F24 N31 O33 S8 Zn4 -","- C118 H80 F24 N31 O33 S8 Zn4 -","- C472 H320 F96 N124 O132 S32 Zn16 -","4","0.5","","Stefankiewicz, Artur R.; Harrowfield, Jack; Madalan, Augustin M.; Lehn, Jean-Marie","Tuning the planarity of [2 ×2] grids","CrystEngComm","2013","15","44","9128","","10.1039/c3ce41510d","","","0.71073","MoKα","","0.1333","0.0771","","","0.2242","0.2606","","","","","","1.052","","","","has coordinates,has disorder","180443","2020-10-21","18:00:00",""
"7214257","14.857","0.005","23.615","0.009","3.7317","0.0013","90","","90","","90","","1309.3","0.8","296","2","296","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C10 H8 Cd4 Cl7 N10 -","- C10 H8 Cd4 Cl7 N10 -","- C20 H16 Cd8 Cl14 N20 -","2","0.25","","Song, Yuna; Yin, Xinbo; Tu, Binbin; Pang, Qingqing; Li, Haiwei; Ren, Xiaoqian; Wang, Bo; Li, Qiaowei","Metal‒organic frameworks constructed from mixed infinite inorganic units and adenine","CrystEngComm","2014","16","15","3082","","10.1039/c3ce42556h","","","0.71073","MoKα","","0.1518","0.0918","","","0.2457","0.2693","","","","","","0.854","","","","has coordinates","180473","2020-10-21","18:00:00",""
"7217017","11.6427","0.0006","12.3716","0.0005","8.4326","0.0004","90","","90","","90","","1214.62","0.1","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ba Cu S3 Sb -","- Ba Cu S3 Sb -","- Ba8 Cu8 S24 Sb8 -","8","1","","Ma, Zhimin; Weng, Fan; Wang, Qiuran; Tang, Qun; Zhang, Ganghua; Chong, Zheng; Han, Ray P.S.; Huang, Fu Qiang","Low Temperature Synthesis and Structures of the Alkaline Earth Metal Chalcogenides Ba3Cu4SbS6OH, BaCuSbS3 and BaCu2S2","RSC Advances","2014","","","","","10.1039/c3ra46878j","","","0.71073","MoKα","","0.0694","0.0405","","","0.0584","0.0643","","","","","","0.946","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7218349","23.6028","0.0006","25.1893","0.0008","7.6207","0.0002","90","","90","","90","","4530.8","0.2","298","","298","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- C18 H36 I6 N4 -","- C18 H36 I6 N4 -","- C108 H216 I36 N24 -","6","0.75","","Peuronen, Anssi; Rinta, Heikki; Lahtinen, Manu","N⋯I halogen bonding supported stabilization of a discrete pseudo-linear [I12]2−polyiodide","CrystEngComm","2015","17","8","1736","","10.1039/C4CE01866D","","","0.71073","MoKα","","0.0886","0.0543","","","0.0878","0.1011","","","","","","1.119","","","","has coordinates,has disorder","180514","2020-10-21","18:00:00",""
"7220586","20.353","0.018","7.416","0.006","11.123","0.01","90","","90","","90","","1679","3","296","2","296","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- B3 Ba7 Cl Ge O13 -","- B3 Ba7 Cl Ge O13 -","- B12 Ba28 Cl4 Ge4 O52 -","4","0.5","","Wen, Ming; Lian, Zhipeng; Wu, Hongping; Su, Xin; Yan, Qingfeng; Lu, Juanjuan; Yang, Zhihua; Pan, ShiLie","Ba7(BO3)3GeO4X (X=Cl, Br): the borogermanate halides with rigid GeO4 tetrahedra and flexible XBa6 octahedra","RSC Adv.","2015","","","","","10.1039/C5RA07450A","","","0.71073","MoKα","","0.0545","0.0351","","","0.0612","0.0675","","","","","","1.037","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7220587","20.381","0.008","7.477","0.003","11.175","0.004","90","","90","","90","","1702.9","1.1","296","2","296","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- B3 Ba7 Br Ge O13 -","- B3 Ba7 Br Ge O13 -","- B12 Ba28 Br4 Ge4 O52 -","4","0.5","","Wen, Ming; Lian, Zhipeng; Wu, Hongping; Su, Xin; Yan, Qingfeng; Lu, Juanjuan; Yang, Zhihua; Pan, ShiLie","Ba7(BO3)3GeO4X (X=Cl, Br): the borogermanate halides with rigid GeO4 tetrahedra and flexible XBa6 octahedra","RSC Adv.","2015","","","","","10.1039/C5RA07450A","","","0.71073","MoKα","","0.0426","0.0315","","","0.0585","0.063","","","","","","1.043","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7221194","14.624","","7.163","","3.771","","90","","90","","90","","395.019","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Na3 Cu4 S4","","- Cu4 Na3 S4 -","- Cu4 Na3 S4 -","- Cu8 Na6 S8 -","2","0.25","","Burschka, C.","Na3 Cu4 S4 - ein Thiocuprat mit unverknuepften (Cu4 S4)-Ketten","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1979","34","","396","397","","","","","","","","","","","","","","","","","","","","","","has coordinates","144805","2020-10-21","18:00:00",""
"7221245","19.117","","9.877","","4.586","","90","","90","","90","","865.922","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Tl4 Pb I6","","- I6 Pb Tl4 -","- I6 Pb Tl4 -","- I12 Pb2 Tl8 -","2","0.25","","Stoeger, W.","Die Kristallstrukturen von Tl Pb I3 und Tl4 Pb I6","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1977","32","","975","981","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222509","17.321","","7.575","","3.3336","","90","","90","","90","","437.39","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Hf5 Rh2 In4","","- Hf5 In4 Rh2 -","- Hf5 In4 Rh2 -","- Hf10 In8 Rh4 -","2","0.25","","Lukachuk, M.; Poettgen, R.","Synthesis and crystal structure of Zr5 Rh2 In4 and Hf5 Rh2 In4 - New ternary indides with Lu5Ni2In4-type structure","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2002","57","","1353","1358","","","","","","","","","","","","","","","","","","","","","","has coordinates","161771","2020-10-21","18:00:00",""
"7222510","17.398","","7.583","","3.3742","","90","","90","","90","","445.155","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Zr5 Rh2 In4","","- In4 Rh2 Zr5 -","- In4 Rh2 Zr5 -","- In8 Rh4 Zr10 -","2","0.25","","Lukachuk, M.; Poettgen, R.","Synthesis and Crystal Structure of Zr5Rh2In4 and Hf5Rh2In4 - New Ternary Indides with Lu5Ni2In4 Type Structure","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2002","57","","1353","1358","","","","","","","","","","","","","","","","","","","","","","has coordinates","161775","2020-10-21","18:00:00",""
"7222578","7.4337","","26.251","","7.396","","90","","90","","90","","1443.27","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Cs3 (Sb5 O14)","","- Cs3 O14 Sb5 -","- Cs3 O14 Sb5 -","- Cs12 O56 Sb20 -","4","0.5","","Hirschle, C.; Rosstauscher, J.; Emmerling, F.; Roehr, C.","Rb- und Cs-Oxoantimonate(V) mit Kanalstrukturen: Synthesen, Kristallstrukturen und Schwingungsspektren","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2001","56","","169","178","","","","","","","","","","","","","","","","","","","","","","has coordinates","162631","2020-10-21","18:00:00",""
"7222579","7.1881","","24.4775","","7.3305","","90","","90","","90","","1289.78","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Rb3 (Sb5 O14)","","- O14 Rb3 Sb5 -","- O14 Rb3 Sb5 -","- O56 Rb12 Sb20 -","4","0.5","","Hirschle, C.; Rosstauscher, J.; Emmerling, F.; Roehr, C.","Rb- und Cs-Oxoantimonate(V) mit Kanalstrukturen: Synthesen, Kristallstrukturen und Schwingungsspektren","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2001","56","","169","178","","","","","","","","","","","","","","","","","","","","","","has coordinates","162635","2020-10-21","18:00:00",""
"7222829","11.228","","16.471","","3.333","","90","","90","","90","","616.393","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Sr0.2 Ca2.8 (Tl2 O6)","","- Ca2.8 O6 Sr0.2 Tl2 -","- Ca2.8 O6 Sr0.2 Tl2 -","- Ca11.2 O24 Sr0.8 Tl8 -","4","0.5","","Ruck, K.; Simon, A.; Borrmann, H.","Crystal structure of Sr0.2Ca2.8Tl2O6","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1994","49","","635","636","","","","","","","","","","","","","","","","","","","","","","has coordinates","165298","2020-10-21","18:00:00",""
"7222952","7.99","","15.21","","4.43","","90","","90","","90","","538.369","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- Li13 Si4 -","- Li13 Si4 -","- Li26 Si8 -","2","0.25","","Frank, U.; Schaefer, H.; Mueller, W.","Zur Kenntnis der Phase Li13 Si4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1975","30","","10","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7229400","17.038","0.002","20.632","0.003","29.069","0.004","90","","90","","90","","10219","2","296","2","296.15","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C42 H38 Cd3 N2 O21 -","- C42 H20 Cd3 N2 O17 -","- C336 H160 Cd24 N16 O136 -","8","1","","Du, Jian-Long; Gao, Ju-Ping; Li, Chao-Ping; Zhang, Xiao-Ying; Hou, Jin-Xin; Jing, Xu; Mu, Ya-Juan; Li, Li-Jun","A stable 3D Cd(ii) metal‒organic framework for highly sensitive detection of Cu2+ ions and nitroaromatic explosives","RSC Adv.","2017","7","78","49618","","10.1039/C7RA08977E","","","0.71073","MoKα","","0.0901","0.0611","","","0.1678","0.1917","","","","","","1.025","","","","has coordinates,has disorder","202349","2020-10-21","18:00:00",""
"7233635","11.157","0.004","11.733","0.004","22.906","0.008","90","","90","","90","","2998.5","1.8","293","2","293","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C6 H32 Fe Mo6 N3 O25 -","- C6 H19 Fe Mo6 N3 O25 -","- C24 H76 Fe4 Mo24 N12 O100 -","4","0.5","","Khadija Hakouk; Olivier Oms; Anne Dolbecq; Jerome Marrot; Ali Saad; Pierre Mialane; Houda El Bekkachi; Stephane Jobic; Philippe Deniard; Remi Dessapt","New photoresponsive charge-transfer spiropyran/polyoxometalate assemblies with highly tunable optical properties","Journal of Materials Chemistry C","2014","2","","1628","1641","10.1039/C3TC31992J","","","0.71073","MoKα","","0.1494","0.0752","","","0.1581","0.1915","","","","","","1.025","","","","has coordinates","217964","2020-10-21","18:00:00",""
"7234466","8.4034","0.0015","27.567","0.005","4.6422","0.0008","90","","90","","90","","1075.4","0.3","90","2","90","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ba2 Sb2 Se5 -","- Ba2 Sb2 Se5 -","- Ba8 Sb8 Se20 -","4","0.5","","Jian Wang; Kathleen Lee; Kirill Kovnir","Synthesis, crystal structure, and thermoelectric properties of two new barium antimony selenides: Ba2Sb2Se5 and Ba6Sb7Se16.11","Journal of Materials Chemistry C","2015","3","","9811","9818","10.1039/C5TC01721A","","","0.71073","MoKα","","0.0423","0.0313","","","0.0607","0.0655","","","","","","1.062","","","","has coordinates","219159","2020-10-21","18:00:00",""
"7235085","13.7405","0.0007","10.3343","0.0006","12.1024","0.0007","90","","90","","90","","1718.52","0.17","293","2","293","2","","","","","","","","6","P b a m","-P 2 2ab","55","","[Tetrakis(mu-adenine-kN3:kN9)bis(chlorido)dicopper(II)]chloride- water (1/8)]","","- C20 H36 Cl4 Cu2 N20 O8 -","- C20 H20 Cl4 Cu2 N20 O7.9998 -","- C40 H40 Cl8 Cu4 N40 O15.9996 -","2","0.25","","Thomas-Gipson, Jintha; Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; Pascual-Colino, Jon; Pérez-Yáñez, Sonia; Román, Pascual","Providing evidence for the requirements to achieve supramolecular materials based on metal‒nucleobase entities","CrystEngComm","2018","20","18","2528","","10.1039/C8CE00141C","","","0.71073","MoKα","","0.1138","0.0521","","","0.1039","0.1118","","","","","","0.915","","","","has coordinates,has disorder","227793","2020-10-21","18:00:00",""
"7236216","16.3005","0.0007","6.3588","0.0002","6.4725","0.0003","90","","90","","90","","670.89","0.05","153","2","153","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- C H2 Ag2 N8 -","- C H4 Ag2 N8 -","- C4 H16 Ag8 N32 -","4","0.5","","Qu, Xiaoni; Yang, Qi; Han, Jing; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Shengli","High performance 5-aminotetrazole-based energetic MOF and its catalytic effect on decomposition of RDX","RSC Advances","2016","6","52","46212","","10.1039/C6RA07301H","","","0.71073","MoKα","","0.0444","0.0426","","","0.211","0.2145","","","","","","1.833","","","","has coordinates","235280","2020-10-21","18:00:00",""
"7239864","17.876","0.002","27.491","0.002","11.3809","0.001","90","","90","","90","","5592.9","0.9","293","2","293","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C4.17 H2.67 Co0.17 N0.33 O1.17 S0.17 -","- C4.16667 H2 Co0.166667 N0.333333 O1.16667 S0.166667 -","- C100 H48 Co4 N8 O28 S4 -","24","3","","Tu, Qian-Qian; Ren, Ling-Ling; Cui, Ying-Ying; Cheng, Ai-Ling; Gao, En-Qing","Assembly of four new cobalt coordination polymers modulated by N-coligands: sensitive and selective sensing of nitroaromatics, Fe3+ and Cr2O72− in water","CrystEngComm","2020","22","10","1789","1801","10.1039/C9CE01757G","","","1.54184","CuKα","","0.186","0.0848","","","0.2211","0.2735","","","","","","0.931","","","","has coordinates","257430","2020-10-21","18:00:00",""
"7242658","25.411","0.012","16.573","0.008","16.573","","90","","90","","90","","6979","5","296","2","296","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C16.25 H15.75 N1.25 O6 Zn -","- C13 H6 O5 Zn -","- C104 H48 O40 Zn8 -","8","1","","Zhang, Hao; Geng, Wu-Yue; Luo, Yu-Hui; Ding, Zi-Jun; Wang, Zhi-Xuan; Xie, A.-Di; Zhang, Dong-En","Reticular synthesis of two anionic Zn(ii)-MOFs for organic dye adsorption/separation and lanthanide ion sensitization","CrystEngComm","2021","23","18","3319","3325","10.1039/D1CE00112D","","","0.71073","MoKα","","0.1067","0.0727","","","0.1934","0.2033","","","","","","1.035","","","","has coordinates","265987","2021-06-05","18:19:27",""
"7242659","17.693","0.003","33.688","0.007","16.248","0.003","90","","90","","90","","9684","3","296","2","296","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C26 H36 N3.5 O9.5 Zn -","- C16 H8 O5 Zn -","- C128 H64 O40 Zn8 -","8","1","","Zhang, Hao; Geng, Wu-Yue; Luo, Yu-Hui; Ding, Zi-Jun; Wang, Zhi-Xuan; Xie, A.-Di; Zhang, Dong-En","Reticular synthesis of two anionic Zn(ii)-MOFs for organic dye adsorption/separation and lanthanide ion sensitization","CrystEngComm","2021","23","18","3319","3325","10.1039/D1CE00112D","","","0.71073","MoKα","","0.1534","0.1094","","","0.2837","0.3234","","","","","","1.018","","","","has coordinates,has disorder","265987","2021-06-05","18:19:29",""
"7243341","9.19375","0.00021","12.33041","0.00024","3.016669","0.000051","90","","90","","90","","341.978","0.012","300","","300","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- B4 Cu Mn4 Ni7 O20 -","- B4 Cu Mn4 Ni7 O20 -","- B4 Cu Mn4 Ni7 O20 -","1","0.125","","Moshkina, Evgeniya; Bovina, Asya; Molokeev, Maxim; Krylov, Alexander; Shabanov, Alexander; Chernyshov, Artem; Sofronova, Svetlana","Study of flux crystal growth peculiarities, structure and Raman spectra of double (Mn,Ni)3BO5 and triple (Mn,Ni,Cu)3BO5 oxyborates with ludwigite structure","CrystEngComm","2021","23","33","5624","5635","10.1039/D1CE00750E","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.379","1.228","","","","","","","has coordinates","268656","2021-09-06","10:25:52",""
"7243342","9.1828","0.0003","12.2766","0.0003","3.0091","0.0001","90","","90","","90","","339.227","0.018","296","2","296","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- B4 Cu Mn4 Ni7 O20 -","- B4 Cu Mn4 Ni7 O20 -","- B4 Cu Mn4 Ni7 O20 -","1","0.125","","Moshkina, Evgeniya; Bovina, Asya; Molokeev, Maxim; Krylov, Alexander; Shabanov, Alexander; Chernyshov, Artem; Sofronova, Svetlana","Study of flux crystal growth peculiarities, structure and Raman spectra of double (Mn,Ni)3BO5 and triple (Mn,Ni,Cu)3BO5 oxyborates with ludwigite structure","CrystEngComm","2021","23","33","5624","5635","10.1039/D1CE00750E","","","0.71073","MoKα","","0.043","0.0425","","","0.1203","0.1206","","","","","","1.968","","","","has coordinates","268656","2021-09-06","10:25:52",""
"7243343","9.1735","0.0002","12.2939","0.0003","3.0018","0.0001","90","","90","","90","","338.537","0.016","296","2","296","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- B2 Cu Mn2 Ni3 O10 -","- B2 Cu Mn2 Ni3 O10 -","- B4 Cu2 Mn4 Ni6 O20 -","2","0.25","","Moshkina, Evgeniya; Bovina, Asya; Molokeev, Maxim; Krylov, Alexander; Shabanov, Alexander; Chernyshov, Artem; Sofronova, Svetlana","Study of flux crystal growth peculiarities, structure and Raman spectra of double (Mn,Ni)3BO5 and triple (Mn,Ni,Cu)3BO5 oxyborates with ludwigite structure","CrystEngComm","2021","23","33","5624","5635","10.1039/D1CE00750E","","","0.71073","MoKα","","0.0418","0.0413","","","0.1266","0.127","","","","","","2.021","","","","has coordinates","268656","2021-09-06","10:25:52",""
"7243825","13.9401","0.0002","13.8771","0.0002","7.6055","0.0001","90","","90","","90","","1471.27","0.04","293","2","293","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C20 H30 Br4 I2 N4 O2 -","- C20 H32 Br4 I2 N4 O2 -","- C40 H64 Br8 I4 N8 O4 -","2","0.25","","Milašinović, Valentina; Molčanov, Krešimir","Novel co-crystals with π-hole interactions between iodide anions and quinoid rings involving charge transfer","CrystEngComm","2021","23","46","8209","8214","10.1039/D1CE01156A","","","1.54179","CuKα","","0.0509","0.0504","","","","0.166","","","","","","1.163","","","","has coordinates","271173","2021-12-07","03:07:42",""
"7703625","49.6","0.05","13.026","0.016","18.521","0.018","90","","90","","90","","11966","2","298","2","298.03","","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C54 H36 Co2 N8 O8 -","- C54 H36 Co2 N8 O8 -","- C432 H288 Co16 N64 O64 -","8","1","","Zhang, Xiao; Wang, Lu-Jie; Han, Zhen; Meng, Xing; Wang, Hai-Ning; Zhou, Zi-Yan; Su, Zhong-Min","Degradation of azo dyes under visible light with stable MOF based on tetrastyrene imidazole ligand.","Dalton transactions (Cambridge, England : 2003)","2020","49","14","4352","4357","10.1039/d0dt00415d","","","0.71073","MoKα","","0.2405","0.0986","","","0.2278","0.2871","","","","","","0.988","","","","has coordinates,has disorder","251640","2020-10-21","18:00:00",""
"7706646","22.234","0.004","28.096","0.006","28.408","0.006","90","","90","","90","","17746","6","100","","100","","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C57 H73 Fe3 N8 O31 P3 -","- C42 H30 Fe3 N3 O22 P3 -","- C336 H240 Fe24 N24 O176 P24 -","8","1","","Wang, Xiao-Ning; Zhao, Yumeng; Li, Jia-Luo; Pang, Jian-Dong; Wang, Qiang; Li, Bao; Zhou, Hong-Cai","Biomimetic catalysts of iron-based metal-organic frameworks with high peroxidase-mimicking activity for colorimetric biosensing.","Dalton transactions (Cambridge, England : 2003)","2021","50","11","3854","3861","10.1039/d0dt02504f","","","0.71073","MoKα","","0.0684","0.0648","","","0.1903","0.1961","","","","","","1.0554","","","","has coordinates","263776","2021-04-05","14:54:13",""
"7710371","13.469","0.0006","8.7223","0.0004","10.0032","0.0004","90","","90","","90","","1175.18","0.09","298","2","298","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Ba4 Mn2 Si2 Te9 -","- Ba4 Mn2 Si2 Te9 -","- Ba8 Mn4 Si4 Te18 -","2","0.25","","Yadav, Sweta; Jana, Subhendu; Panigrahi, Gopabandhu; Malladi, Sairam K.; Niranjan, Manish K.; Prakash, Jai","Five coordinated Mn in Ba<sub>4</sub>Mn<sub>2</sub>Si<sub>2</sub>Te<sub>9</sub>: synthesis, crystal structure, physical properties, and electronic structure.","Dalton transactions (Cambridge, England : 2003)","2022","51","24","9265","9277","10.1039/d2dt01167k","","","0.71073","MoKα","","0.0286","0.0239","","","0.0529","0.054","","","","","","1.133","","","","has coordinates","276610","2022-07-06","08:07:21",""
"7712123","30.9478","0.0005","8.7794","0.0002","12.2189","0.0003","90","","90","","90","","3319.91","0.12","199.99","0.1","200","","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C56 H32 Cu2 I2 N8 O8 -","- C56 H32 Cu2 I2 N8 O8 -","- C112 H64 Cu4 I4 N16 O16 -","2","0.25","","Dong, Pan-Pan; Liu, Yuan-Yuan; Peng, Qiu-Chen; Li, Hai-Yang; Li, Kai; Zang, Shuang-Quan; Tang, Ben Zhong","Luminescent MOFs constructed by using butterfly-like AIE ligands.","Dalton transactions (Cambridge, England : 2003)","2023","52","7","1913","1918","10.1039/d2dt03382h","","","1.54184","CuKα","","0.0602","0.0512","","","0.1486","0.1565","","","","","","1.057","","","","has coordinates,has disorder","283316","2023-05-05","02:22:45",""
"7712899","8.042","","15.1061","","4.4867","","90","","90","","90","","545.059","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Lithium Silver Germanide (12/1/4)","","- Ag Ge4 Li12 -","- Ag Ge4 Li14 -","- Ag2 Ge8 Li28 -","2","0.25","","Zhang, Hong-Ying; Qiu, Shu-Juan; Yang, Huan-Huan; Wang, Meng-Ting; Yang, Jie; Wang, Han-Bin; Liu, Nai-Hao; Chen, Xu-Dong","Cubane-type Tungsten-Iron-Sulfur Clusters with Nitrogen Atom in the Core: Terminal Ligand Substitutions and Redox Behaviors","Dalton Transactions","2023","","","","","10.1039/D3DT00865G","","","","","","0.0293","","","","","","","","","","","","","","","has coordinates","282934","2023-05-01","22:51:47",""
"7714080","12.1863","0.0006","12.4072","0.0007","5.8203","0.0003","90","","90","","90","","880.02","0.08","273.15","","273.15","","","","","","","","","5","P b a m","-P 2 2ab","55","","1","","- Cl K N2 O6 Rb2 -","- Cl K N2 O6 Rb2 -","- Cl4 K4 N8 O24 Rb8 -","4","0.5","","Zhang, Zhiyuan; Xu, Die; Wu, Zhencheng; Hu, Mei; Su, Xin; Huang, Yi-Neng","KRb2(NO3)2Cl: a New Birefringent Crystal Exhibiting Perovskite-Related Framework and Short Cutoff Edge","Dalton Transactions","2023","","","","","10.1039/D3DT02952B","","","0.71073","MoKα","","0.0323","0.0277","","","0.0691","0.0719","","","","","","1.111","","","","has coordinates","286609","2023-09-30","22:56:36",""
"8100310","8.473","0.003","11.929","0.003","9.197","0.003","90","","90","","90","","929.6","0.5","299","2","299","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- Cl4 H10 Hg N2 O -","- Cl4 H10 Hg N2 O -","- Cl16 H40 Hg4 N8 O4 -","4","0.5","","Loukil, Mohamed; Kabadou, Ahlem; Svoboda, Ingrid; Ehrenberg, Helmut; Ben Salah, Abd Elhamid; Fuess, Hartmut","Crystal structure of ammonium tetrachloromercurate(II) monohydrate, (NH~4~)~2~HgCl~4~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2003","218","1","29","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8100320","6.573","0.0013","12.533","0.003","19.934","0.004","90","","90","","90","","1642.2","0.6","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- C18 H52 Co2 O20 -","- C18 H52 Co2 O20 -","- C36 H104 Co4 O40 -","2","0.25","","Zheng, Yue-Qing; Sun, Jie; Fang, Ye-Wen","Crystal structure of diazelaatobis(tetraaquacobalt(II)) tetrahydrate, [Co(H~2~O)~4~]~2~(C~9~H~14~O~4~)~2~ · 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2003","218","2","221","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8100360","11.28","0.002","8.94","0.002","3.39","0.001","90","","90","","90","","341.9","0.2","293","","295.15","","","","","","","","","4","P b a m","-P 2 2ab","55","Er Ta0.23 V1.77 B6","","","- B24 Er4 Ta0.93 V7.07 -","- B6 Er Ta0.232 V1.768 -","- B24 Er4 Ta0.928 V7.072 -","4","0.5","","Kuz'ma, Yurii; Prots, Yurii; Grin, Yuri","Crystal structure of erbium vanadium tantal boride, Er(V~0.77~Ta~0.23~) VB~6~","Zeitschrift für Kristallographie - New Crystal Structures","2003","218","2","159","160","","","","","","","","0.0336","","","0.0336","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8100410","13.0607","0.0013","13.8589","0.0019","4.0407","0.0004","90","","90","","90","","731.39","0.14","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","Tetraterbium-hexabromide-monosilicide","","","- Br6 Si Tb4 -","- Br6 Si Tb4 -","- Br12 Si2 Tb8 -","2","0.25","","Mattausch, Hansjürgen; Oeckler, Oliver; Simon, Arndt","Crystal structure of tetraterbium hexabromide monosilicide, Tb~4~Br~6~Si","Zeitschrift für Kristallographie - New Crystal Structures","2003","218","3","282","282","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8100733","5.979","0.001","11.573","0.002","3.434","0.0006","90","","90","","90","","237.62","0.07","293","2","295.15","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- B4 Er V -","- B4 Er V -","- B16 Er4 V4 -","4","0.5","","Chaban, Nadiya; Prots, Yurii; Kuz'ma, Yurii; Grin, Yuri","Refinement of the crystal structure of erbium vanadium tetraboride, ErVB~4~","Zeitschrift für Kristallographie - New Crystal Structures","2002","217","3","315","316","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8100938","9.2602","0.0018","10.9914","0.0017","4.0657","0.0006","90","","90","","90","","413.82","0.12","293","2","293","2","","","","","","","","6","P b a m","-P 2 2ab","55","","","","- C4 H14 F4 N2 O Ti -","- C4 H14 F4 N2 O Ti -","- C8 H28 F8 N4 O2 Ti2 -","2","0.25","","Tang, L.Q.; Dadachov, M.S.; Zou, X.D.","Crystal structure of 1,4-diaminobutane tetrafluorooxotitanate, (C~4~N~2~H~14~)[TiF~4~O]","Zeitschrift für Kristallographie - New Crystal Structures","2001","216","2","257","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101540","7.7485","0.0015","7.79","0.002","20.859","0.003","90","","90","","90","","1259","0.4","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C22 H24 Cl4 N2 Pb -","- C22 H24 Cl4 N2 Pb -","- C44 H48 Cl8 N4 Pb2 -","2","0.25","","Braun, Markus; Frey, Wolfgang","Crystal structure of bis(2-naphthylmethylammonium) lead tetrachloride, (C~11~H~9~NH~3~)~2~PbCl~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","333","334","","","","","","","","0.0479","","","0.1113","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"8102895","5.8645","0.0002","11.368","0.0005","3.385","0.0002","90","","90","","90","","225.67","0.018","","","295.15","","","","","","","","","3","P b a m","-P 2 2ab","55","","ytterbium nickel tetraboride","","- B4 Ni Yb -","- B4 Ni Yb -","- B16 Ni4 Yb4 -","4","0.5","","I. Veremchuk; Yu. Prots; A. Leithe-Jasper; Yu. Kuz'ma","Refinement of the crystal structure of ytterbium nickel tetraboride, YbNiB~4~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","2","125","126","","","","0.7107","MoKα","","","0.025","","","","0.026","","","","","","1.03","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102909","13.172","0.002","13.982","0.001","4.083","0.001","90","","90","","90","","752","0.2","293","2","293","2","","","","","","","","3","P b a m","-P 2 2ab","55","tetragadolinium-hexabromide-monosilicide","tetragadolinium hexabromide monosilicide","","- Br6 Gd4 Si -","- Br6 Gd4 Si -","- Br12 Gd8 Si2 -","2","0.25","","Hj. Mattausch; A. Simon","Crystal structure of tetragadolinium monosilicide hexabromide, Gd~4~SiBr~6~","Zeitschrift für Kristallographie - New Crystal Structures","2005","220","3","313","313","","","","0.71073","MoKα","","0.0334","0.0262","","","0.0587","0.0606","","","","","","0.969","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8103011","8.7783","0.0007","11.0643","0.0009","3.5681","0.0002","90","","90","","90","","346.55","0.04","295.15","","295.15","","","","","","","","","3","P b a m","-P 2 2ab","55","","Magnesium Iridium Boride","","- B6.6 Ir0.7 Mg2 -","- B6.608 Ir0.678 Mg2 -","- B26.432 Ir2.712 Mg8 -","4","0.5","","Anastasia M. Alekseeva; Yurii Prots; Andreas Leithe-Jasper; Evgeny V. Antipov; Yuri Grin","Crystal structure of magnesium iridium boride, Mg2Ir1-xB6+2x (x = 0.3)","Zeitschrift für Kristallographie - New Crystal Structures","2009","224","1","19","","","","","0.7107","Molybdenum","","0.021","0.019","","","0.019","0.021","","","","1.03","1.03","1.03","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8103017","7.321","0.002","22.878","0.004","4.4061","0.0004","90","","90","","90","","738","0.2","294","2","294","2","","","","","","","","3","P b a m","-P 2 2ab","55","ytterbium aluminium antimonide","","","- Al2 Sb6 Yb5 -","- Al2 Sb6 Yb5 -","- Al4 Sb12 Yb10 -","2","0.25","","Maria L. Fornasini; Pietro Manfrinetti","Crystal structure of ytterbium aluminium antimonide, Yb5Al2Sb6","Zeitschrift für Kristallographie - New Crystal Structures","2009","224","3","345","","","","","0.7107","MoKα","","0.042","0.0291","","","0.0685","0.0713","","","","","","1.01","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8103039","7.79697","0.00007","8.16575","0.00007","5.75442","0.00005","90","","90","","90","","366.373","0.006","293","2","","","","","","","","","synthetic","4","P b a m","-P 2 2ab","55","","Bismuth gallium aluminium oxide (2/1.6/2.4/9) (mullite type)","","- Al2.4 Bi2 Ga1.6 O9 -","- Al2.376 Bi2 Ga1.624 O9 -","- Al4.752 Bi4 Ga3.248 O18 -","2","0.25","","Tapas Debnath; Claus H. Rüscher","Crystal structure of bismuth gallium aluminium oxide, Bi2(GaxAl1‒x)4O9, x = 0.4, 0.6, 0.8","Zeitschrift für Kristallographie - New Crystal Structures","2010","225","1","1","","","powder diffraction","x-ray","1.78896","CoKα","","","","","","","","","","3.35","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103040","7.83752","0.00008","8.20096","0.00008","5.79475","0.00006","90","","90","","90","","372.459","0.007","293","2","","","","","","","","","synthetic","4","P b a m","-P 2 2ab","55","","Bismuth gallium aluminium oxide (2/2.4/1.6/9) (mullite type)","","- Al1.6 Bi2 Ga2.4 O9 -","- Al1.654 Bi2 Ga2.346 O9 -","- Al3.308 Bi4 Ga4.692 O18 -","2","0.25","","Tapas Debnath; Claus H. Rüscher","Crystal structure of bismuth gallium aluminium oxide, Bi2(GaxAl1‒x)4O9, x = 0.4, 0.6, 0.8","Zeitschrift für Kristallographie - New Crystal Structures","2010","225","1","1","","","powder diffraction","x-ray","1.78896","CoKα","","","","","","","","","","4.48","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103041","7.88345","0.00006","8.24579","0.00006","5.84335","0.00004","90","","90","","90","","379.849","0.005","293","2","","","","","","","","","synthetic","4","P b a m","-P 2 2ab","55","","Bismuth gallium aluminium oxide (2/3.2/0.8/9) (mullite type)","","- Al0.8 Bi2 Ga3.2 O9 -","- Al0.852 Bi2 Ga3.148 O9 -","- Al1.704 Bi4 Ga6.296 O18 -","2","0.25","","Tapas Debnath; Claus H. Rüscher","Crystal structure of bismuth gallium aluminium oxide, Bi2(GaxAl1‒x)4O9, x = 0.4, 0.6, 0.8","Zeitschrift für Kristallographie - New Crystal Structures","2010","225","1","1","","","powder diffraction","x-ray","1.78896","CoKα","","","","","","","","","","3.8","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103454","9.275","","12.146","","3.0265","","90","","90","","90","","340.948","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Co3 B O5","","- B Co3 O5 -","- B Co3 O5 -","- B4 Co12 O20 -","4","0.5","","Sotofte, I.; Norrestam, R.; Thorup, N.; Nielsen, K.","Structural investigations of two synthetic oxyborates: The mixed magnesium-manganese and the pure cobalt ludwigites, Mg1.93(2) Mn1.07(2) O2 B O3 and Co3 O2 B O3","Zeitschrift fuer Kristallographie (149,1979-)","1989","189","","33","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103466","9.202","","12.532","","2.993","","90","","90","","90","","345.151","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Mg1.93 Mn1.07 B O5","","- B Mg1.93 Mn1.07 O5 -","- B Mg1.933 Mn1.067 O5 -","- B4 Mg7.732 Mn4.268 O20 -","4","0.5","","Nielsen, K.; Norrestam, R.; Thorup, N.; Sotofte, I.","Structural investigations of two synthetic oxyborates: The mixed magnesium-manganese and the pure cobalt ludwigites, Mg1.93(2) Mn1.07(2) O2 B O3 and Co3 O2 B O3","Zeitschrift fuer Kristallographie (149,1979-)","1989","189","","33","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103526","7.95","","32.01","","15.46","","90","","90","","90","","3934.25","","","","","","","","","","","","","6","P b a m","-P 2 2ab","55","","K8 Zn4 (C N)16 (H2 O)9","","- C16 H18 K8 N16 O9 Zn4 -","- C16 K8 N16 O9 Zn4 -","- C64 K32 N64 O36 Zn16 -","4","0.5","","Ahsbahs, H.","Strukturbestimmung der wasserhaltigen Phase von K2 Zn (C N)4 bei hohem Druck","Zeitschrift fuer Kristallographie (149,1979-)","1981","154","","243","244","","","","","","","","","","","","","","","","","","","","","","has coordinates","144596","2020-10-21","18:00:00",""
"8103891","12.383","","14.4","","3.9608","","90","","90","","90","","706.271","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Yb Co2 Al8","","- Al8 Co2 Yb -","- Al8 Co2 Yb -","- Al32 Co8 Yb4 -","4","0.5","","Manyako, M.B.; Bodak, O.I.; Yanson, T.I.; Cerny, R.; Yvon, K.","Crystal structure of ytterbium cobalt aluminium, Yb Co2 Al8","Zeitschrift fuer Kristallographie (149,1979-)","1996","211","","216","216","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103902","12.775","","12.185","","10.958","","90","","90","","90","","1705.76","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","Sr4 As3","","- As3 Sr4 -","- As3 Sr4 -","- As24 Sr32 -","8","1","","Somer, M.; Carrillo-Cabrera, W.; Peters, K.; von Schnering, H.G.","Crystal structure of tetrastrontium triarsenide, Sr4 As3","Zeitschrift für Kristallographie - Crystalline Materials","1995","210","11","876","876","10.1524/zkri.1995.210.11.876","","","","","","","","","","","","","","","","","","","","","has coordinates","218017","2020-10-21","18:00:00",""
"8103968","9.227","","12.218","","2.984","","90","","90","","90","","336.403","","","","","","","","","","","","","6","P b a m","-P 2 2ab","55","","(Mg1.92 Fe0.0825) (Fe0.566 Al0.41 Ti0.02) O2 (B O3)","","- Al0.41 B Fe0.6485 Mg1.92 O5 Ti0.02 -","- Al0.414 B Fe0.6485 Mg1.9175 O5 Ti0.02 -","- Al1.656 B4 Fe2.594 Mg7.67 O20 Ti0.08 -","4","0.5","","Takeuchi, Y.; Kogure, T.","The structure type of ludwigite","Zeitschrift fuer Kristallographie (149,1979-)","1992","200","","161","167","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104170","9.186","","10.102","","7.958","","90","","90","","90","","738.478","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sc Co Ge2","","- Co Ge2 Sc -","- Co Ge2 Sc -","- Co12 Ge24 Sc12 -","12","1.5","","Kotur, B.Ya.; Stepen'-Damm, Yu.; Bodak, O.I.","Crystal structure of scandium cobalt digermanide, Sc Co Ge2","Zeitschrift fuer Kristallographie (149,1979-)","1996","211","","117","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104201","14.756","","18.149","","3.636","","90","","90","","90","","973.745","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","La2 Fe25 P12","","- Fe25 La2 P12 -","- Fe25 La2 P12 -","- Fe50 La4 P24 -","2","0.25","","Zimmer, B.I.; Jeitschko, W.","The crystal structure of La2 Fe25 P12","Zeitschrift fuer Kristallographie (149,1979-)","1994","209","","950","953","","","","","","","","","","","","","","","","","","","","","","has coordinates","165151","2020-10-21","18:00:00",""
"8104338","9.2324","","12.2247","","2.9972","","90","","90","","90","","338.274","","","","","","","","","","","","","6","P b a m","-P 2 2ab","55","","Mg2.11 Al.31 Fe.53 Ti.05 B O5","","- Al0.31 B Fe0.53 Mg2.11 O5 Ti0.05 -","- Al0.308 B Fe0.5385 Mg2.103 O5 Ti0.05 -","- Al1.232 B4 Fe2.154 Mg8.412 O20 Ti0.2 -","4","0.5","","Norrestam, R.; Dahl, S.; Bovin, J.O.","The crystal structure of magnesium-aluminium Ludwigite, Mg2.11 Al.31 Fe.53 Ti.05 Sb.01 B O5, a combined single X-ray and HREM study","Zeitschrift fuer Kristallographie (149,1979-)","1989","187","","201","211","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104477","15.988","","12.619","","3.843","","90","","90","","90","","775.335","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ca0.76 In2.84 S5 -","- Ca0.76 In2.84 S5 -","- Ca3.04 In11.36 S20 -","4","0.5","","Eisenmann, B.; Hofmann, A.","Crystal structure of calcium thioindate","Zeitschrift fuer Kristallographie (149,1979-)","1991","197","","165","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8105664","16.0836","0.0017","8.0165","0.0007","14.7754","0.0015","90","","90","","90","","1905.1","0.3","173","","173","","","","","","","","","4","P b a m","-P 2 2ab","55","","1,4-dinitro-2,3,5,6-tetraacetoxy-piperazine","","- C12 H16 N4 O12 -","- C12 H16 N4 O12 -","- C48 H64 N16 O48 -","4","0.5","","Yunlu, Li; Mei, Xue; Jianlong, Wang; Luyao, Zhang; Jie, Ning","The crystal structure of 1,4-dinitro-2,3,5,6-tetraacetoxy-piperazine, C12H16N4O12","Zeitschrift für Kristallographie - New Crystal Structures","2019","234","3","417","418","10.1515/ncrs-2018-0423","","","0.71073","MoKα","","0.1018","0.0499","","","0.1207","0.1606","","","","","","1.059","","","","has coordinates","276735","2022-07-08","07:07:38",""
"9000262","5.262","","9.274","","2.954","","90","","90","","90","","144.155","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","Mn2GeO4-delta","","","- Ge Mn2 O4 -","- Ge Mn2 O4 -","- Ge2 Mn4 O8 -","2","0.25","","Morimoto, N.; Tokonami, M.; Koto, K.; Nakajima, S.","Crystal structures of the high pressure polymorphs of Mn2GeO4","American Mineralogist","1972","57","","62","75","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000274","4.98","","8.85","","2.75","","90","","90","","90","","121.201","","","","","","","","","","","","hypothetical","3","P b a m","-P 2 2ab","55","","","","- Mg2 O4 Si -","- Mg2 O4 Si -","- Mg4 O8 Si2 -","2","0.25","","Baur, W. H.","Computer-simulated crystal structures of observed and hypothetical Mg2SiO4 polymorphs of low and high density Sr2PbO4 structure","American Mineralogist","1972","57","","709","731","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000384","9.057","","13.357","","8.289","","90","","90","","90","","1002.76","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","","Roweite","- B4 Ca2 H6 Mn2 O13 -","- B4 Ca2 H6 Mn2 O13 -","- B16 Ca8 H24 Mn8 O52 -","4","0.5","","Moore, P. B.; Araki, T.","Roweite, Ca2Mn2(OH)4[B4O7(OH)2]: Its atomic arrangement","American Mineralogist","1974","59","","60","65","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:30",""
"9000544","9.542","","10.834","","6.374","","90","","90","","90","","658.932","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","","Melonjosephite","- Ca Fe2 H O9 P2 -","- Ca Fe2 H O9 P2 -","- Ca4 Fe8 H4 O36 P8 -","4","0.5","","Kampf, A. R.; Moore, P. B.","Melonjosephite, calcium iron hydroxy phosphate: its crystal structure","American Mineralogist","1977","62","","60","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:00",""
"9000591","6.092","","14.407","","7.811","","90","","90","","90","","685.552","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Reinerite","- As2 O6 Zn3 -","- As2 O6 Zn3 -","- As8 O24 Zn12 -","4","0.5","","Ghose, S.; Boving, P.; LaChapelle, W. A.; Wan, C.","Reinerite, Zn3(AsO3)2: an arsenite with a novel type of Zn-tetrahedral double chain","American Mineralogist","1977","62","","1129","1134","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:00",""
"9000737","8.492","","8.326","","11.938","","90","","90","","90","","844.069","","","","","","","","","","","","","6","P b a m","-P 2 2ab","55","","","Versiliaite","- As0.6 Fe5 O16 S0.8 Sb5.9 Zn0.5 -","- As0.6 Fe5 O16 S0.8 Sb5.9 Zn0.5 -","- As1.2 Fe10 O32 S1.6 Sb11.8 Zn -","2","0.25","","Mellini, M.; Merlino, S.","Versiliaite and apuanite: Derivative structures related to schafarzikite","American Mineralogist","1979","64","","1235","1242","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:39",""
"9000890","9.463","","12.305","","3.0727","","90","","90","","90","","357.792","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Vonsenite","- B Fe3 O5 -","- B Fe3 O5 -","- B4 Fe12 O20 -","4","0.5","","Swinnea, J. S.; Steinfink, H.","Crystal structure and Mossbauer spectrum of vonsenite, 2FeO*FeBO3","American Mineralogist","1983","68","","827","832","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:40",""
"9001037","7.5785","","7.6817","","2.8864","","90","","90","","90","","168.034","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al2.38 O4.77 Si0.62 -","- Al2.38 O4.77 Si0.62 -","- Al4.76 O9.54 Si1.24 -","2","0.25","","Angel, R. J.; Prewitt, C. T.","Crystal structure of mullite: A re-examination of the average structure","American Mineralogist","1986","71","","1476","1482","","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9001321","7.588","","7.688","","2.8895","","90","","90","","90","","168.563","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al2.4 O4.8 Si0.6 -","- Al2.4 O4.8 Si0.6 -","- Al4.8 O9.6 Si1.2 -","2","0.25","","Angel, R. J.; McMullan, R. K.; Prewitt, C. T.","Substructure and superstructure of mullite by neutron diffraction Model 1 Neutron","American Mineralogist","1991","76","","332","342","","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9001322","7.5785","","7.6817","","2.8864","","90","","90","","90","","168.034","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al2.4 O4.8 Si0.6 -","- Al2.4 O4.8 Si0.6 -","- Al4.8 O9.6 Si1.2 -","2","0.25","","Angel, R. J.; McMullan, R. K.; Prewitt, C. T.","Substructure and superstructure of mullite by neutron diffraction Model 2 X-ray","American Mineralogist","1991","76","","332","342","","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9001567","7.54336","","7.69176","","2.88402","","90","","90","","90","","167.336","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al2.25 O4.871 Si0.75 -","- Al2.25 O4.871 Si0.75 -","- Al4.5 O9.742 Si1.5 -","2","0.25","","Balzar, D.; Ledbetter, H.","Crystal structure and compressibility of 3:2 mullite","American Mineralogist","1993","78","","1192","1196","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001621","7.7391","","7.6108","","2.918","","90","","90","","90","","171.872","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al2.826 O4.588 Si0.174 -","- Al2.826 O4.588 Si0.174 -","- Al5.652 O9.176 Si0.348 -","2","0.25","","Fischer, R. X.; Schneider, H.; Schmucker, M.","Crystal structure of Al-rich mullite","American Mineralogist","1994","79","","983","990","","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9002407","7.56712","","7.70909","","2.90211","","90","","90","","90","","169.296","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","Mullite","- Al1.97 Cr0.25 O5.22 Si0.78 -","- Al1.97 Cr0.25 O5.22 Si0.78 -","- Al3.94 Cr0.5 O10.44 Si1.56 -","2","0.25","","Fischer, R. X.; Schneider, H.","Crystal structure of Cr-mullite Sample: fixed slit, monochromatic","American Mineralogist","2000","85","","1175","1179","","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9002660","7.6819","","7.681","","2.91842","","90","","90","","90","","172.2","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al3 Na0.335 O4.665 -","- Al3 Na0.335 O4.665 -","- Al6 Na0.67 O9.33 -","2","0.25","","Fischer, R. X.; Schmucker, M.; Angerer, P.; Schneider, H.","Crystal structures of Na and K aluminate mullites Sample: Na","American Mineralogist","2001","86","","1513","1518","","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9002661","7.6934","","7.6727","","2.93231","","90","","90","","90","","173.092","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al3 K0.335 O4.665 -","- Al3 K0.335 O4.665 -","- Al6 K0.67 O9.33 -","2","0.25","","Fischer, R. X.; Schmucker, M.; Angerer, P.; Schneider, H.","Crystal structures of Na and K aluminate mullites Sample: K","American Mineralogist","2001","86","","1513","1518","","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9003043","9.3812","","6.461","","3.3168","","90","","90","","90","","201.038","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","Minium","- O4 Pb3 -","- O4 Pb3 -","- O8 Pb6 -","2","0.25","","Dinnebier, R. E.; Carlson, S.; Hanfland, M.; Jansen, M.","Bulk modulus and high-pressure crystal structures of minium, Pb3O4, determined by X-ray powder diffraction Sample: Phase III of Pb3O4 at 13.3 GPa","American Mineralogist","2003","88","","996","1002","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:31",""
"9004295","9.198","","12.528","","2.965","","90","","90","","90","","341.664","","","","","","","","","","","","","6","P b a m","-P 2 2ab","55","","","Fredrikssonite","- Al0.04 B2 Fe0.48 Mg3.92 Mn1.56 O10 -","- Al0.04 B2 Fe0.48 Mg3.92 Mn1.56 O10 -","- Al0.08 B4 Fe0.96 Mg7.84 Mn3.12 O20 -","2","0.25","","Burns, P. C.; Cooper, M. A.; Hawthorne, F. C.","Jahn-Teller-distorted MnO6 octahedra in fredrikssonite, the fourth polymorph of Mg2Mn(BO3)O2","The Canadian Mineralogist","1994","32","","397","403","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004536","9.2411","","12.2948","","3.0213","","90","","90","","90","","343.272","","","","","","","","","","","","Crestmore quarry, California, USA","5","P b a m","-P 2 2ab","55","","","Ludwigite","- Al0.08 B Fe1.214 Mg1.707 O5 -","- Al0.08 B Fe1.2135 Mg1.7065 O5 -","- Al0.32 B4 Fe4.854 Mg6.826 O20 -","4","0.5","","Irwin, M. B.; Peterson, R. C.","The crystal structure of ludwigite","The Canadian Mineralogist","1999","37","","939","943","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9005321","15.04","","15.51","","4.09","","90","","90","","90","","954.076","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Cl2.3 Pb4.32 S8.7 Sb3.68 -","- Cl2.3 Pb4.32 S8.7 Sb3.68 -","- Cl4.6 Pb8.64 S17.4 Sb7.36 -","2","0.25","","Kostov-Kytin V V; Petrova, R.; Macicek, J.","Crystal structure of synthetic Pb4.32Sb3.68S8.68Cl2.32 A chlorine-bearing alternative to Pb4Sb4S11","European Journal of Mineralogy","1997","9","","1191","1197","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005501","7.5817","","7.6813","","2.8865","","90","","90","","90","","168.102","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al2.41 O4.793 Si0.59 -","- Al2.41 O4.793 Si0.59 -","- Al4.82 O9.586 Si1.18 -","2","0.25","","Voll, D.; Lengauer, C.; Beran, A.; Schneider, H.","Infrared band assignment and structural refinement of Al-Si, Al-Ge, and Ga-Ge mullites Sample: Al-Si single-crystal","European Journal of Mineralogy","2001","13","","591","604","10.1127/0935-1221/2001/0013-0591","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9005502","7.5655","","7.6883","","2.8851","","90","","90","","90","","167.814","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al2.34 O4.83 Si0.66 -","- Al2.34 O4.83 Si0.66 -","- Al4.68 O9.66 Si1.32 -","2","0.25","","Voll, D.; Lengauer, C.; Beran, A.; Schneider, H.","Infrared band assignment and structural refinement of Al-Si, Al-Ge, and Ga-Ge mullites Sample: Al-Si powder data","European Journal of Mineralogy","2001","13","","591","604","10.1127/0935-1221/2001/0013-0591","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9005503","7.653","","7.7779","","2.9252","","90","","90","","90","","174.12","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al2.36 Ge0.64 O4.82 -","- Al2.36 Ge0.64 O4.82 -","- Al4.72 Ge1.28 O9.64 -","2","0.25","","Voll, D.; Lengauer, C.; Beran, A.; Schneider, H.","Infrared band assignment and structural refinement of Al-Si, Al-Ge, and Ga-Ge mullites Sample: Al-Ge powder data","European Journal of Mineralogy","2001","13","","591","604","10.1127/0935-1221/2001/0013-0591","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9005504","7.8674","","8.0305","","3.0148","","90","","90","","90","","190.473","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Ga2.31 Ge0.69 O4.84 -","- Ga2.31 Ge0.69 O4.84 -","- Ga4.62 Ge1.38 O9.68 -","2","0.25","","Voll, D.; Lengauer, C.; Beran, A.; Schneider, H.","Infrared band assignment and structural refinement of Al-Si, Al-Ge, and Ga-Ge mullites Sample: Ga-Ge powder data","European Journal of Mineralogy","2001","13","","591","604","10.1127/0935-1221/2001/0013-0591","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9008146","7.54","","8.534","","5.766","","90","","90","","90","","371.021","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi Mn2 O5 -","- Bi Mn2 O5 -","- Bi4 Mn8 O20 -","4","0.5","","Niizeki, N.; Wachi, M.","The crystal structures of Bi2Mn4O10, Bi2Al4O9 and Bi2Fe4O9","Zeitschrift fur Kristallographie","1968","127","","173","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008147","7.712","","8.112","","5.708","","90","","90","","90","","357.091","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al4 Bi2 O9 -","- Al4 Bi2 O9 -","- Al8 Bi4 O18 -","2","0.25","","Niizeki, N.; Wachi, M.","The crystal structures of Bi2Mn4O10, Bi2Al4O9 and Bi2Fe4O9","Zeitschrift fur Kristallographie","1968","127","","173","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008148","7.905","","8.428","","6.005","","90","","90","","90","","400.073","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi2 Fe4 O9 -","- Bi2 Fe4 O9 -","- Bi4 Fe8 O18 -","2","0.25","","Niizeki, N.; Wachi, M.","The crystal structures of Bi2Mn4O10, Bi2Al4O9 and Bi2Fe4O9","Zeitschrift fur Kristallographie","1968","127","","173","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008405","7.644","","7.76","","2.923","","90","","90","","90","","173.385","","","","","","","","","","","","Synthetic","3","P b a m","-P 2 2ab","55","","","Mullite-Ge","- Al2.383 Ge0.617 O4.809 -","- Al2.3828 Ge0.6172 O4.8088 -","- Al4.7656 Ge1.2344 O9.6176 -","2","0.25","","Saalfeld, H.; Gerlach, H.","Solid solution and optical properties of (Al,Ge)-mullites","Zeitschrift fur Kristallographie","1991","195","","65","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:55:59",""
"9009415","9.24","","12.362","","2.9869","","90","","90","","90","","341.178","","","","","","","","","","","","Jakobsberg Fe-Mn oxide deposit, Filipstad, Varmland, Sweden","6","P b a m","-P 2 2ab","55","","","Ludwigite","- Al0.44 B2 Fe1.11 Mg3.91 Mn0.54 O10 -","- Al0.44 B2 Fe1.11 Mg3.91 Mn0.54 O10 -","- Al0.88 B4 Fe2.22 Mg7.82 Mn1.08 O20 -","2","0.25","","Holtstam, D.","Crystal chemistry of a manganian ludwigite Note: z-coordinate has been altered through personal communication with the author Locality: Jakobsberg Fe-Mn oxide deposit, Filipstad, Varmland, Sweden","Neues Jahrbuch fur Mineralogie, Monatshefte","2001","2001","","520","528","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9010159","7.552","","7.6872","","2.8843","","90","","90","","90","","167.444","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al2.28 O4.86 Si0.72 -","- Al2.28 O4.86 Si0.72 -","- Al4.56 O9.72 Si1.44 -","2","0.25","","Popović, J.; Tkalčec, E.; Gržeta, B.; Kurajica, S.; Schmauch, J.","Cobalt incorporation in mullite Sample: MU0","American Mineralogist","2007","92","","408","411","10.2138/am.2007.2114","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9010160","7.5618","","7.6882","","2.886","","90","","90","","90","","167.782","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","Mullite","- Al2.25 Co0.015 O4.86 Si0.735 -","- Al2.25 Co0.015 O4.86 Si0.735 -","- Al4.5 Co0.03 O9.72 Si1.47 -","2","0.25","","Popovic, J.; Tkalcec, E.; Grzeta, B.; Kurajica, S.; Schmauch, J.","Cobalt incorporation in mullite Sample: MU1","American Mineralogist","2007","92","","408","411","10.2138/am.2007.2114","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9010162","7.306","","8.268","","5.714","","90","","90","","90","","345.16","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ca Ge2 O5 -","- Ca Ge2 O5 -","- Ca4 Ge8 O20 -","4","0.5","","Nemeth, P.; Leinenweber, K.; Groy, T. L.; Buseck, P. R.","A new high-pressure CaGe2O5 polymorph with 5- and 6-coordinated germanium","American Mineralogist","2007","92","","441","443","10.2138/am.2007.2411","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9010487","14.52","","10.231","","5.947","","90","","90","","90","","883.451","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ge5 Mg14 O24 -","- Ge5 Mg14 O24 -","- Ge10 Mg28 O48 -","2","0.25","","Thomas, S. M.; Muller, M. K.; Kahlenberg, V.; Thomas, R.; Rhede, D.; Wirth, R.; Wunder, B.","Protonation in germanium equivalents of ringwoodite, anhydrous phase B, and superhydrous phase B Note: Ge-anhydrous phase B","American Mineralogist","2008","93","","1282","1294","10.2138/am.2008.2739","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9010502","7.1236","","8.1912","","5.6468","","90","","90","","90","","329.495","","","","","","","","","","","","Synthetic","3","P b a m","-P 2 2ab","55","","","","- Ca Ge2 O5 -","- Ca Ge2 O5 -","- Ca4 Ge8 O20 -","4","0.5","","Nestola, F.; Nemeth, P.; Angel, R. J.; Buseck, P. R.","Equation of state and crystal structure of a new germanate post-titanite phase Locality: synthetic Note: pressure = 8.6 GPa","American Mineralogist","2008","93","","1424","1428","10.2138/am.2008.2772","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9011936","7.35","","14.153","","7.124","","90","","90","","90","","741.071","","","","","","","","","","","","","6","P b a m","-P 2 2ab","55","","","Nenadkevichite","- H4 Na1.09 Nb0.3 O8.85 Si2 Ti0.7 -","- H4 Na1.09 Nb0.3 O8.85 Si2 Ti0.7 -","- H16 Na4.36 Nb1.2 O35.4 Si8 Ti2.8 -","4","0.5","","Rastsvetaeva, R. K.; Chukanov, N. V.; Pekov, I. V.","Crystal structure of a new mineral - titanium analog of orthorhombic nenadkevichite","Doklady Akademii Nauk SSSR","1997","357","","364","367","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9012586","18.525","","12.272","","3.0218","","90","","90","","90","","686.972","","","","","","","","","","","","","7","P b a m","-P 2 2ab","55","","","Chestermanite","- Al0.66 B4 Fe1.475 Mg9.314 O20 Sb0.482 Ti0.069 -","- Al1.32 B8 Fe2.95 Mg18.628 O40 Sb0.964 Ti0.138 -","- Al1.32 B8 Fe2.95 Mg18.628 O40 Sb0.964 Ti0.138 -","","","","Alfredsson, V.; Bovin, J. O.; Norrestam, R.; Terasaki, O.","The structure of the mineral chestermanite, Mg2.25Al0.16Fe0.43Ti0.02Sb0.13O2BO3. A combined single-crystal X-ray and HREM study","Acta Chemica Scandinavica","1991","45","","797","804","10.3891/acta.chem.scand.45-0797","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:30:05",""
"9012845","9.21048","","12.23794","","3.0062","","90","","90","","90","","338.851","","","","","","","","","","","","Synthetic","4","P b a m","-P 2 2ab","55","","","Bonaccordite","- B Fe Ni2 O5 -","- B4 Fe3.998 Ni8.002 O20 -","- B4 Fe3.998 Ni8.002 O20 -","","","","Perkins, D. A.; Attfield, J. P.","Resonant powder X-ray determination of the cation distribution in FeNi2BO5","Journal of the Chemical Society, Chemical Communications","1991","1991","4","229","231","10.1039/C39910000229","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:30:34",""
"9013442","8.8189","","8.8068","","6.5636","","90","","90","","90","","509.77","","","","240","","","","","","","","Synthetic","2","P b a m","-P 2 2ab","55","","","Minium","- O4 Pb3 -","- O16 Pb12 -","- O16 Pb12 -","","","","Gavarri, J. R.; Weigel, D.; Hewat, A. W.","Oxydes de plomb. IV. Evolution structurale de l'oxyde Pb3O4 entre 240 et 5 K et mecanisme de la transition Locality: synthetic Sample: T = 240 K","Journal of Solid State Chemistry","1978","23","","327","339","10.1016/0022-4596(78)90081-6","","","","","","","","","","","","","","","","","","","","","has coordinates","282067","2023-03-26","07:49:22",""
"9013443","8.8179","","8.8032","","6.562","","90","","90","","90","","509.38","","","","200","","","","","","","","Synthetic","2","P b a m","-P 2 2ab","55","","","Minium","- O4 Pb3 -","- O16 Pb12 -","- O16 Pb12 -","","","","Gavarri, J. R.; Weigel, D.; Hewat, A. W.","Oxydes de plomb. IV. Evolution structurale de l'oxyde Pb3O4 entre 240 et 5 K et mecanisme de la transition Locality: synthetic Sample: T = 200 K","Journal of Solid State Chemistry","1978","23","","327","339","10.1016/0022-4596(78)90081-6","","","","","","","","","","","","","","","","","","","","","has coordinates","282067","2023-03-26","07:49:22",""
"9013444","8.8193","","8.8008","","6.5618","","90","","90","","90","","509.307","","","","180","","","","","","","","Synthetic","2","P b a m","-P 2 2ab","55","","","Minium","- O4 Pb3 -","- O16 Pb12 -","- O16 Pb12 -","","","","Gavarri, J. R.; Weigel, D.; Hewat, A. W.","Oxydes de plomb. IV. Evolution structurale de l'oxyde Pb3O4 entre 240 et 5 K et mecanisme de la transition Locality: synthetic Sample: T = 180 K","Journal of Solid State Chemistry","1978","23","","327","339","10.1016/0022-4596(78)90081-6","","","","","","","","","","","","","","","","","","","","","has coordinates","282067","2023-03-26","07:49:22",""
"9013445","8.9496","","8.6638","","6.5616","","90","","90","","90","","508.77","","","","140","","","","","","","","Synthetic","2","P b a m","-P 2 2ab","55","","","Minium","- O4 Pb3 -","- O16 Pb12 -","- O16 Pb12 -","","","","Gavarri, J. R.; Weigel, D.; Hewat, A. W.","Oxydes de plomb. IV. Evolution structurale de l'oxyde Pb3O4 entre 240 et 5 K et mecanisme de la transition Locality: synthetic Sample: T = 140 K","Journal of Solid State Chemistry","1978","23","","327","339","10.1016/0022-4596(78)90081-6","","","","","","","","","","","","","","","","","","","","","has coordinates","282067","2023-03-26","07:49:22",""
"9013446","9.1305","","8.4629","","6.5677","","90","","90","","90","","507.49","","","","5","","","","","","","","Synthetic","2","P b a m","-P 2 2ab","55","","","Minium","- O4 Pb3 -","- O16 Pb12 -","- O16 Pb12 -","","","","Gavarri, J. R.; Weigel, D.; Hewat, A. W.","Oxydes de plomb. IV. Evolution structurale de l'oxyde Pb3O4 entre 240 et 5 K et mecanisme de la transition Locality: synthetic Sample: T = 5 K","Journal of Solid State Chemistry","1978","23","","327","339","10.1016/0022-4596(78)90081-6","","","","","","","","","","","","","","","","","","","","","has coordinates","282067","2023-03-26","07:49:22",""
"9013807","8.6053","","9.5211","","7.6436","","90","","90","","90","","626.255","","","","","","","","","","","","Luobusha, Tibet, China","3","P b a m","-P 2 2ab","55","","","Zangboite","- Fe Si2 Ti -","- Fe12 Si24 Ti12 -","- Fe12 Si24 Ti12 -","","","","Li, G.; Fang, Q.; Shi, N.; Bai, W.; Yang, J.; Xiong, M.; Ma, Z.; Rong, H.","Zangboite, TiFeSi2, a new mineral species from Luobusha, Tibet, China, and its crystal structure","The Canadian Mineralogist","2009","47","","1265","1274","10.3749/canmin.47.5.1265","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9014098","9.26","","12.294","","3.0236","","90","","90","","90","","344.214","","","","","","","","","","","","Tazheran massif","6","P b a m","-P 2 2ab","55","","","Ludwigite","- Al0.2 B2 Fe1.404 Mg3.976 O10 Ti0.42 -","- Al0.4 B4 Fe2.808 Mg7.952 O20 Ti0.84 -","- Al0.4 B4 Fe2.808 Mg7.952 O20 Ti0.84 -","","","","Brovkin, A. A.; Rozhdestvenskaya, I. V.; Rykova, E. A.","Cation distribution in the structure of titanium-containing ludwigite Note: to be the mineral azoproite, Ti+Mg must be greater than Fe3+ in M4 site Note: Uiso values have been divided by 100","Crystallography Reports","2002","47","","412","414","10.1134/1.1481926","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016003","15.194","","23.035","","4.0591","","90","","90","","90","","1420.66","","","","","","","","","","","","Synthetic","4","P b a m","-P 2 2ab","55","","","","- Cl1.45 Pb3.45 S6.55 Sb2.55 -","- Cl5.8 Pb13.8 S26.2 Sb10.2 -","- Cl5.8 Pb13.8 S26.2 Sb10.2 -","","","","Doussier, C.; Moelo, Y.; Meerschaut, A.; Leone, P.; Guillot-Deudon C","Crystal structure of the new compound Pb3+xSb3 xS7 xCl1+x(x~0.45): The homologous series Pb(2+2N)(Sb,Pb)(2+2N)S(2+2N)(S,Cl)(4+2N)ClN and its polychalcogenide derivatives (N = 1-3)","Journal of Solid State Chemistry","2008","181","","920","934","10.1016/j.jssc.2008.01.041","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9017078","9.6642","","12.5","","2.9023","","90","","90","","90","","350.605","","","","","","","","","","","","Synthetic","3","P b a m","-P 2 2ab","55","","","","- Cr2 Fe2 O5 -","- Cr8 Fe8 O20 -","- Cr8 Fe8 O20 -","","","","Ishii, T.; Kojitani, H.; Tsukamoto, S.; Fujino, K.; Mori, D.; Inaguma, Y.; Tsujino, N.; Yoshino, T.; Yamazaki, D.; Higo, Y.; Funakoshi, K.; Akaogi, M.","High-pressure phase transitions in FeCr2O4 and structure analysis of new post- spinel FeCr2O4 and Fe2Cr2O5 phases with meteoritical and petrological implications","American Mineralogist","2014","99","","1788","1797","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:19",""
"9017340","21.344","","26.494","","4.002","","90","","90","","90","","2263.08","","","","","","","","","","","","Synthetic","4","P b a m","-P 2 2ab","55","","","Znamenskyite","- Bi4 In2 Pb4 S13 -","- Bi16 In8 Pb16 S52 -","- Bi16 In8 Pb16 S52 -","","","","Kramer, V.","Lead indium bismuth chalcogenides. III. Structure of Pb4In2Bi4S13","Acta Crystallographica, Section C","1986","42","","1089","1091","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:55",""