# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-21T12:58:48+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'P m n b' 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
"1001089","7.83","0.01","39.06","0.05","6.57","0.01","90","","90","","90","","2009.4","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Tetrarubidium 17-oxohexaniobate trihydrate","","- H6 Nb6 O20 Rb4 -","- H6 Nb6 O20 Rb4 -","- H24 Nb24 O80 Rb16 -","4","0.5","","Gasperin, M; le Bihan, M T","Un niobate de rubidium d'un type structural nouveau: Rb~4~ Nb~6~ O~17~*(H~2~ O)~3~","Journal of Solid State Chemistry","1980","33","","83","89","10.1016/0022-4596(80)90550-2","","","","","","0.124","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001355","7.713","0.003","10.329","0.004","13.947","0.005","90","","90","","90","","1111.1","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Thallium niobium uranium oxide (1/2/2/11.5)","","- Nb2 O11.5 Tl U2 -","- Nb2 O11.5 Tl U2 -","- Nb8 O46 Tl4 U8 -","4","0.5","","Gasperin, M","Synthese et structure de trois niobouranates d'ions monovalents: Tl Nb~2~ U~2~ O~11.5~, K Nb U O~6~, et Rb Nb U O~6~","Journal of Solid State Chemistry","1987","67","","219","224","10.1016/0022-4596(87)90357-4","","","","","","0.067","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100023","5.647","0.001","7.037","0.001","9.644","0.002","90","","90","","90","","383.2","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Calcium strontium silicate (1.5/.5/1)","","- Ca1.5 O4 Si Sr0.5 -","- Ca1.5 O4 Si Sr0.5 -","- Ca6 O16 Si4 Sr2 -","4","0.5","","Catti, M.; Gazzoni, G.; Ivaldi, G.","Order-disorder in the α'-(Ca,Sr)~2~SiO~4~ solid solution: a structural and statistical-thermodynamic analysis","Acta Crystallographica, Section B: Structural Science","1984","40","6","537","544","10.1107/s0108768184002652","","","","","","0.049","","","","","","","","","","","","","","","has coordinates","199948","2020-10-21","18:00:00",""
"1100024","5.647","0.001","7.037","0.001","9.644","0.002","90","","90","","90","","383.2","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Calcium strontium silicate (1.8/.2/1)","","- Ca1.8 O4 Si Sr0.2 -","- Ca1.8 O4 Si Sr0.2 -","- Ca7.2 O16 Si4 Sr0.8 -","4","0.5","","Catti, M.; Gazzoni, G.; Ivaldi, G.","Order-disorder in the α'-(Ca,Sr)~2~SiO~4~ solid solution: a structural and statistical-thermodynamic analysis","Acta Crystallographica, Section B: Structural Science","1984","40","6","537","544","10.1107/s0108768184002652","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","199948","2020-10-21","18:00:00",""
"1511469","10.994","","9.017","","4.3073","","90","","90","","90","","426.995","","","","","","","","","","","","","3","P m n b","-P 2bc 2a","62","","Ba (B4 O7)","","- B4 Ba O7 -","- B4 Ba O7 -","- B16 Ba4 O28 -","4","0.5","","Schnick, W.; Knyrim, J.S.; Roemer, S.R.; Huppertz, H.","High pressure synthesis and characterization of the alkaline earth borate beta-Ba B4 O7","Solid State Sciences","2009","11","","336","342","10.1016/j.solidstatesciences.2008.07.015","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1524824","3.91","","6.51","","7.59","","90","","90","","90","","193.197","","","","","","","","","","","","","3","P m n b","-P 2bc 2a","62","","Tl (Bi F4)","","- Bi F4 Tl -","- Bi F4 Tl -","- Bi2 F8 Tl2 -","2","0.25","","Lucat, C.; Portier, J.; Sorbe, P.; Reau, J.M.; Hagenmuller, P.","Synthese et etude de la conductivite anionique de nouveaux electrolytes M Bi F4 (M= K, Rb, Tl)","Materials Research Bulletin","1977","12","","145","150","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525094","6.29","","10.74","","5.17","","90","","90","","90","","349.257","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Li3 Zn0.5 Ge O4","","- Ge Li3 O4 Zn0.5 -","- Ge Li3 O4 Zn0.5 -","- Ge4 Li12 O16 Zn2 -","4","0.5","","Plattner, E.; Voellenkle, H.","Die Kristallstruktur der Verbindung Li3 Zn0.5 Ge O4","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","1979","110","","693","698","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527549","5.362","","5.4079","","16.742","","90","","90","","90","","485.47","","","","","","","","","","","","","3","P m n b","-P 2bc 2a","62","","","","- Gd P S -","- Gd P S -","- Gd8 P8 S8 -","8","1","","Hulliger, F.; Schmelczer, R.; Schwarzenbach, D.","The GdPS structure, a new PbFCl-type derivative","Journal of Solid State Chemistry","1977","21","","371","374","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1530124","4.0644","","12.098","","21.098","","90","","90","","90","","1037.41","","","","","","","","","","","","","3","P m n b","-P 2bc 2a","62","","Cs Bi3 S5","","- Bi3 Cs S5 -","- Bi3 Cs S5 -","- Bi12 Cs4 S20 -","4","0.5","","Kanishcheva, A.S.; Lazarev, B.V.; Mikhailov, Yu.N.; Trippel, A.F.","A new cesium sulfobismuthite Cs Bi3 S5. Synthesis and structure containing extensive channels","Doklady Akademii Nauk SSSR","1980","252","","96","99","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530291","6.861","","8.987","","5.045","","90","","90","","90","","311.074","","","","","","","","","","","","","5","P m n b","-P 2bc 2a","62","","Na (Fe0.9 Mn0.1) (P O4)","","- Fe0.9 Mn0.1 Na O4 P -","- Fe0.9 Mn0.1 Na O4 P -","- Fe3.6 Mn0.4 Na4 O16 P4 -","4","0.5","","le Page, Y.; Donnay, G.","The crystal structure of the new mineral maricite Na Fe P O4","Canadian Mineralogist","1977","15","","518","521","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530437","6.9041","","9.0882","","5.1134","","90","","90","","90","","320.845","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Na Mn (P O4)","","- Mn Na O4 P -","- Mn Na O4 P -","- Mn4 Na4 O16 P4 -","4","0.5","","Moring, J.; Kostiner, E.","The crystal structure of Na Mn P O4","Journal of Solid State Chemistry","1986","61","","379","383","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536224","7.26","","10.534","","7.658","","90","","90","","90","","585.66","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Na2 Cu (Sc F7)","","- Cu F7 Na2 Sc -","- Cu F7 Na2 Sc -","- Cu4 F28 Na8 Sc4 -","4","0.5","","Dahlke, P.; Babel, D.","Die Kristallstrukturen der Weberite Na2CuScF7 und Na2ZnAlF7","Zeitschrift fuer Anorganische und Allgemeine Chemie","1994","620","","1692","1697","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540012","3.35","","5.84","","11.37","","90","","90","","90","","222.443","","","","","","","","","","","","","3","P m n b","-P 2bc 2a","62","","Sr Zn O2","","- O2 Sr Zn -","- O2 Sr Zn -","- O8 Sr4 Zn4 -","4","0.5","","von Schnering, H.G.; Hoppe, R.","Die Kristallstruktur des Sr Zn O2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1961","312","","87","98","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540013","3.66","","6.168","","11.95","","90","","90","","90","","269.77","","","","","","","","","","","","","3","P m n b","-P 2bc 2a","62","","","","- Ba Cd O2 -","- Ba Cd O2 -","- Ba4 Cd4 O8 -","4","0.5","","von Schnering, H.G.","Die Kristallstruktur des Ba Cd O2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1962","314","","144","155","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1540392","5.674","0.001","7.086","0.002","9.745","0.002","90","","90","","90","","391.81","0.15","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Strontium Barium Silicate (1.9/0.1/1) - Alpha","","- Ba0.1 O4 Si Sr1.9 -","- Ba0.1 O4 Si Sr1.9 -","- Ba0.4 O16 Si4 Sr7.6 -","4","0.5","","Li, Xiaojun; Hua, Youjie; Ma, Hongping; Deng, Degang; Xu, Shiqing","Modification of the crystal structure of Sr2−xBaxSi(O,N)4: Eu2+phosphors to improve their luminescence properties","CrystEngComm","2015","17","47","9123","","10.1039/C5CE01605C","","","","","","0.052","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540393","5.6796","0.0004","7.1386","0.0006","9.7639","0.0001","90","","90","","90","","395.87","0.04","300","2","295","1","","","","","","","","5","P m n b","-P 2bc 2a","62","","Strontium Barium Silicate Oxynitride","","- Ba0.15 N O4 Si Sr2.85 -","- Ba0.15 N O4 Si Sr2.85 -","- Ba0.6 N4 O16 Si4 Sr11.4 -","4","0.5","","Li, Xiaojun; Hua, Youjie; Ma, Hongping; Deng, Degang; Xu, Shiqing","Modification of the crystal structure of Sr2−xBaxSi(O,N)4: Eu2+phosphors to improve their luminescence properties","CrystEngComm","2015","17","47","9123","","10.1039/C5CE01605C","","","0.71073","","","0.047","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1541970","7.629","","16.886","","6.76","","90","","90","","90","","870.845","","","","","","","","","","","","","6","P m n b","-P 2bc 2a","62","","(Co (N H3)4 C O3) Br","","- C H12 Br Co N4 O3 -","- C H12 Br Co N4 O3 -","- C4 H48 Br4 Co4 N16 O12 -","4","0.5","","Haagensen, C.O.; Rasmussen, S.E.","Accuracy of a Crystal Structure Determination. The Structure of Carbonato-Tetraammine-Cobalt(III) Bromide","Acta Chemica Scandinavica (1-27,1973-42,1988)","1963","17","","1630","1634","","","","","","","","","","","","","","","","","","","","","","has coordinates","186580","2020-10-21","18:00:00",""
"1542005","13.536","","13.17","","5.867","","90","","90","","90","","1045.91","","","","","","","","","","","","","5","P m n b","-P 2bc 2a","62","","K3 Y Si3 O8 (O H)2","","- H2 K3 O10 Si3 Y -","- K3 O10 Si3 Y -","- K12 O40 Si12 Y4 -","4","0.5","","Maksimov, B.A.; Ilyukhin, V.V.; Belov, N.V.","Crystal Structure of Potassium Yttrium Triorthosilicate","Doklady Akademii Nauk SSSR","1968","181","","591","594","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2002531","5.8894","0.0012","7.889","0.0042","10.3969","0.0025","90","","90","","90","","483.1","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Barium thallium vanadate","","- Ba O4 Tl V -","- Ba O4 Tl V -","- Ba4 O16 Tl4 V4 -","4","0.5","","Boje, J; Mueller-Buschbaum, H","Zur Kenntnis von Ba Tl V O4 und Sr Tl V O4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1992","611","","137","140","10.1002/zaac.19926110523","","","","","","0.071","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2003598","16.881","0.009","12.659","0.009","9.201","0.006","90","","90","","90","","1966.5","","298","","","","","","","","","","from hexane","4","P m n b","","","","","","- C19 H26 Cl2 Ti -","- C9.5 H13 Cl Ti0.5 -","- C38 H52 Cl4 Ti2 -","4","0.5","","Urazowski, I.; Mkoyan, S.; Atovmyan, L.; Gautheron, B.; Broussier, R.; Perron, P.","syn-[2,2-Bis(3-isopropyl-η^5^-cyclopentadienyl)propane]dichlorotitanium","Acta Crystallographica Section C","1995","51","6","1063","1064","10.1107/S0108270194014083","","","0.71069","MoKα","","","0.049","","","0.055","","","","","1.4","1.4","","","","","has coordinates","175029","2020-10-21","18:00:00",""
"2005101","10.5672","0.002","15.9577","0.0012","14.5196","0.0012","90","","90","","90","","2448.4","0.5","294","","294","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Di(μ-hydrido)hexadecacarbonylpentaosmium","","- C16 H2 O16 Os5 -","- C18 O16 Os5 -","- C72 O64 Os20 -","4","0.5","BR1134","Leong, W. K.; Einstein, F. W. B.; Pomeroy, R. K.","[Os~5~(μ-H)~2~(CO)~16~]: a Second Crystal Form","Acta Crystallographica Section C","1996","52","7","1607","1609","10.1107/S0108270196000339","","","0.7107","MolybdenumKα","","0.051","0.051","","0.058","0.058","","","","","1.2","1.2","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2018698","5.581","0.0002","9.202","0.0002","13.561","0.0002","90","","90","","90","","696.44","0.03","293","2","293","2","","","","","","","","4","P m n b","-P 2bc 2a","62","Barium strontium phosphate","Barium strontium diphosphate","","- Ba1.01 O7 P2 Sr0.99 -","- Ba1.0133 O7 P2 Sr0.9867 -","- Ba4.0532 O28 P8 Sr3.9468 -","4","0.5","BI3047","Edhokkar, Fadhila; Hadrich, Ahmed; Graia, Mohsen; Mhiri, Tahar","Ba~1.01~Sr~0.99~P~2~O~7~: un nouveau site Ba^2+^ révélé par diffraction des rayons X","Acta Crystallographica Section C","2012","68","12","i86","i88","10.1107/S0108270112047002","","","0.71073","MoKα","","0.0185","0.017","","","0.0396","0.04","","","","","","1.143","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2021702","6.241","0.004","13.726","0.003","10.095","0.005","90","","90","","90","","864.8","0.7","285","","285","","","","","","","","","4","P m n b","-P 2bc 2a","62","Hypoxanthinium nitrate monohydrate","6-Oxo-1<i>H</i>,7<i>H</i>-purin-9-ium nitrate monohydrate","","- C5 H7 N5 O5 -","- C5 H7 N5 O5 -","- C20 H28 N20 O20 -","4","0.5","QP3027","Cabaj, Małgorzata Katarzyna; Gajda, Roman; Hoser, Anna; Makal, Anna; Dominiak, Paulina Maria","Differences and similarities among hypoxanthinium nitrate hydrate structures","Acta Crystallographica Section C","2019","75","8","","","10.1107/S2053229619008702","","","0.71073","MoKα","","0.0621","0.0418","","","0.116","0.1292","","","","","","1.107","","","","has coordinates,has Fobs","216789","2020-10-21","18:00:00",""
"2100278","6.177","0.0018","12.785","0.004","8.898","0.003","90","","90","","90","","702.7","0.4","217","2","217","2","","","","","","","","4","P m n b","-P 2bc 2a","62","","","","- C4 H8 N2 O5 -","- C4 H8 N2 O5 -","- C16 H32 N8 O20 -","4","0.5","WS5026","Nichol, Gary S.; Clegg, William","A variable-temperature study of a phase transition in barbituric acid dihydrate","Acta Crystallographica Section B","2005","61","4","464","472","10.1107/S0108768105017258","","","0.71073","MoKα","","0.0677","0.0611","","","0.1504","0.1537","","","","","","1.251","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2100279","6.1626","0.0019","12.757","0.004","8.876","0.003","90","","90","","90","","697.8","0.4","218","2","218","2","","","","","","","","4","P m n b","-P 2bc 2a","62","","","","- C4 H8 N2 O5 -","- C4 H8 N2 O5 -","- C16 H32 N8 O20 -","4","0.5","WS5026","Nichol, Gary S.; Clegg, William","A variable-temperature study of a phase transition in barbituric acid dihydrate","Acta Crystallographica Section B","2005","61","4","464","472","10.1107/S0108768105017258","","","0.71073","MoKα","","0.0586","0.0539","","","0.1337","0.1368","","","","","","1.17","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2100280","6.1624","0.0015","12.757","0.003","8.878","0.002","90","","90","","90","","697.9","0.3","219","2","219","2","","","","","","","","4","P m n b","-P 2bc 2a","62","","","","- C4 H8 N2 O5 -","- C4 H8 N2 O5 -","- C16 H32 N8 O20 -","4","0.5","WS5026","Nichol, Gary S.; Clegg, William","A variable-temperature study of a phase transition in barbituric acid dihydrate","Acta Crystallographica Section B","2005","61","4","464","472","10.1107/S0108768105017258","","","0.71073","MoKα","","0.0693","0.0664","","","0.1566","0.1579","","","","","","1.321","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2100281","6.1665","0.0012","12.763","0.002","8.8814","0.0017","90","","90","","90","","699","0.2","220","2","220","2","","","","","","","","4","P m n b","-P 2bc 2a","62","","","","- C4 H8 N2 O5 -","- C4 H8 N2 O5 -","- C16 H32 N8 O20 -","4","0.5","WS5026","Nichol, Gary S.; Clegg, William","A variable-temperature study of a phase transition in barbituric acid dihydrate","Acta Crystallographica Section B","2005","61","4","464","472","10.1107/S0108768105017258","","","0.71073","MoKα","","0.0495","0.0453","","","0.1198","0.1237","","","","","","1.093","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2100282","6.1739","0.0004","12.7594","0.0009","8.8831","0.0006","90","","90","","90","","699.77","0.08","230","2","230","2","","","","","","","","4","P m n b","-P 2bc 2a","62","","","","- C4 H8 N2 O5 -","- C4 H8 N2 O5 -","- C16 H32 N8 O20 -","4","0.5","WS5026","Nichol, Gary S.; Clegg, William","A variable-temperature study of a phase transition in barbituric acid dihydrate","Acta Crystallographica Section B","2005","61","4","464","472","10.1107/S0108768105017258","","","0.71073","MoKα","","0.0455","0.0429","","","0.1095","0.1116","","","","","","1.143","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2100283","6.2144","0.0007","12.7512","0.0014","8.8841","0.001","90","","90","","90","","703.99","0.14","270","2","270","2","","","","","","","","4","P m n b","-P 2bc 2a","62","","","","- C4 H8 N2 O5 -","- C4 H8 N2 O5 -","- C16 H32 N8 O20 -","4","0.5","WS5026","Nichol, Gary S.; Clegg, William","A variable-temperature study of a phase transition in barbituric acid dihydrate","Acta Crystallographica Section B","2005","61","4","464","472","10.1107/S0108768105017258","","","0.71073","MoKα","","0.0463","0.041","","","0.11","0.1164","","","","","","1.109","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2103118","10.471","0.003","26.24","0.009","6.434","0.002","90","","90","","90","","1767.8","1","130","2","130","2","","","","","","","","3","P m n b","-P 2bc 2a","62","","4,4'-dimethyl-2-hydroxy-6-oxo-cyclohexene-1-carboxylic acid","","- C9 H12 O4 -","- C9 H12 O4 -","- C72 H96 O32 -","8","1","BR0109","Duncan, Laura L.; Patrick, Brian O.; Brock, Carolyn Pratt","Two phases of C~9~H~12~O~4~: why is the structure at 295K so complicated?","Acta Crystallographica, Section B: Structural Science","2002","58","3","502","511","10.1107/S0108768102000630","","","0.71073","MoKα","","0.137","0.081","","","0.199","0.214","","","","","","1.43","","","","has coordinates","203217","2020-10-21","18:00:00",""
"2106424","6.479","","10.715","","5.119","","90","","90","","90","","355.374","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Cd Li2 Si O4","","- Cd Li2 O4 Si -","- Cd Li2 O4 Si -","- Cd4 Li8 O16 Si4 -","4","0.5","","Riekel, C.","Dilithium cadmium orthosilicate","Acta Crystallographica B (24,1968-38,1982)","1977","33","","2656","2657","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107415","8.817","","9.033","","13.305","","90","","90","","90","","1059.66","","","","","","","","","","","","","3","P m n b","-P 2bc 2a","62","","Cl2 Te S7","","- Cl2 S7 Te -","- Cl2 S7 Te -","- Cl8 S28 Te4 -","4","0.5","","Weiss, J.; Pupp, M.","Mitteilungen ueber Interchalkogen-Verbindungen. II. Die Kristall- und Molekuelstrukturen von 8,8-Dichlor-1,2,3,4,5,6,7,8-heptathiatellur(IV)-otcan, Cl2 Te S7 und von 8,8-Dibrom-1,2,3,4,5,6,7,8-heptathiatellur(VI)-octan, Br2 Te S7","Acta Crystallographica B (24,1968-38,1982)","1972","28","","3653","3655","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107416","8.858","","9.479","","13.344","","90","","90","","90","","1120.43","","","","","","","","","","","","","3","P m n b","-P 2bc 2a","62","","Br2 Te S7","","- Br2 S7 Te -","- Br2 S7 Te -","- Br8 S28 Te4 -","4","0.5","","Weiss, J.; Pupp, M.","Mitteilungen ueber Interchalkogen-Verbindungen. II. Die Kristall- und Molekuelstrukturen von 8,8-Dichlor-1,2,3,4,5,6,7,8-heptathiatellur(IV)-octan, Cl2 Te S7 und von 8,8-Dibrom-1,2,3,4,5,6,7,8-heptathiatellur(IV)-octan, Br2 Te S7","Acta Crystallographica B (24,1968-38,1982)","1972","28","","3653","3655","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310877","8.06","","16.42","","8.93","","90","","90","","90","","1181.84","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","(Sb Cl5) (P O Cl3)","","- Cl8 O P Sb -","- Cl8 O P Sb -","- Cl32 O4 P4 Sb4 -","4","0.5","","Lindqvist, I.; Braenden, C.I.","The crystal structure of (Sb Cl5) (P O Cl3)","Acta Crystallographica (1,1948-23,1967)","1959","12","","642","645","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2311015","9.739","","11.797","","26.27","","90","","90","","90","","3018.19","","","","","","","","","","","","","2","P m n b","-P 2bc 2a","62","","","","- P4 Se3 -","- P4 Se3 -","- P64 Se48 -","16","2","","Vos, A.; Keulen, E.","The crystal structure of P4 Se3","Acta Crystallographica (1,1948-23,1967)","1959","12","","323","329","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4031422","11.667","","14.319","","15.374","","90","","90","","90","","2568.38","","","","","","","","","","","","","6","P m n b","-P 2bc 2a","62","","(Pt (N H3)4)2 I2 (H S O4)3 (O H) (H2 O)","","- H30 I2 N8 O14 Pt2 S3 -","- I2 N8 O14 Pt2 S3 -","- I8 N32 O56 Pt8 S12 -","4","0.5","","Clark, R.J.H.; Galas, A.M.R.; Kurmoo, M.; Hursthouse, M.B.","The crystal structures of (Pt (N H3)4) (Pt (N H3)4 Br2) (H S O4)4 and (Pt (N H3)4) (Pt (N H3)4 I2) (H S O4)3 (O H) (H2 O) (O H) (H2 O)","Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-)","1982","1982","","2505","2513","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4076135","9.3702","0.0002","12.7059","0.0003","23.7617","0.0006","90","","90","","90","","2828.99","0.11","150","2","150","2","","","","","","","","7","P m n b","-P 2bc 2a","62","sa0426","","","- C23 H33 Br3 Fe Ga N O2 -","- C23 H33 Br3 Fe Ga N O2 -","- C92 H132 Br12 Fe4 Ga4 N4 O8 -","4","0.5","","Bunn, Natalie R.; Aldridge, Simon; Kays, Deborah L.; Coombs, Natalie D.; Day, Joanna K.; Ooi, Li-ling; Coles, Simon J.; Hursthouse, Michael B.","Toward Cationic Gallane- and Indanediyl Complexes: Synthetic Approaches to Three-Coordinate Halogallyl and -indyl Precursors","Organometallics","2005","24","24","5879","","10.1021/om050630f","","","0.71073","MoKα","","0.1155","0.1044","","","0.2837","0.2922","","","","","","1.183","","","","has coordinates","178650","2020-10-21","18:00:00",""
"4115332","10.8517","0.0017","20.919","0.003","11.6959","0.0013","89.995","0.008","90","0.01","89.998","0.008","2655","0.6","263","2","263","2","","","","","","","","7","P m n b","-P 2bc 2a","62","NiN33.6D2O","bis(hydrotris(1,2,4-triazolyl)borato)nickel(II)- hexakis(deuterium oxide)","","- C12 H14 B2 D12 N18 Ni O6 -","- C12 H14 B2 D12 N18 Ni O6 -","- C48 H56 B8 D48 N72 Ni4 O24 -","4","0.5","","Christoph Janiak; Tobias G. Scharmann; Sax A. Mason","Two-Dimensional Water and Ice Layers: Neutron Diffraction Studies at 278, 263, and 20 K","Journal of the American Chemical Society","2002","124","","14010","14011","10.1021/ja0274608","","neutron","1.3143","neutrons","","0.0659","0.0503","","","0.1132","0.1194","","","","","","1.278","","","","has coordinates","178924","2020-10-21","18:00:00",""
"4128538","39.342","0.008","8.2081","0.0016","8.3092","0.0017","90","","90","","90","","2683.2","0.9","293","2","293","2","","","","","","","","6","P m n b","-P 2bc 2a","62","","","","- C8 H24 Br7 Cs N2 Pb2 -","- C8 H24 Br7 Cs N2 Pb2 -","- C32 H96 Br28 Cs4 N8 Pb8 -","4","0.5","","Wu, Zhenyue; Liu, Xitao; Ji, Chengmin; Li, Lina; Wang, Sasa; Peng, Yu; Tao, Kewen; Sun, Zhihua; Hong, Maochun; Luo, Junhua","Discovery of an Above-Room-Temperature Antiferroelectric in Two-Dimensional Hybrid Perovskite.","Journal of the American Chemical Society","2019","141","9","3812","3816","10.1021/jacs.8b13827","","","0.71073","MoKα","","0.0669","0.0368","","","0.0762","0.0906","","","","","","1.004","","","","has coordinates","221619","2020-10-21","18:00:00",""
"4303611","7.7245","0.0012","13.609","0.002","14.061","0.002","90","","90","","90","","1478.1","0.4","298","","298","","","","","","","","","5","P m n b","-P 2bc 2a","62","","","","- C9 H11 Cr Mn N8 -","- C9 Cr Mn N8 -","- C36 Cr4 Mn4 N32 -","4","0.5","","Yusuke Yoshida; Katsuya Inoue; Mohamedally Kurmoo","Consecutive Irreversible Single-Crystal to Single-Crystal and Reversible Single-Crystal to Glass Transformations and Associated Magnetism of the Coordination Polymer, [MnII(rac-pnH)(H2O)CrIII(CN)6].H2O","Inorganic Chemistry","2009","48","","10726","10736","10.1021/ic901615e","","","0.71073","MoKα","","0.0882","0.0492","","","0.1101","0.1197","","","","","","0.936","","","","has coordinates","179074","2020-10-21","18:00:00",""
"4303612","7.73","0.004","13.627","0.007","14.064","0.007","90","","90","","90","","1481.5","1.3","298","","298","","","","","","","","","5","P m n b","-P 2bc 2a","62","","","","- C9 H11 Cr Mn N8 -","- C9 Cr Mn N8 -","- C36 Cr4 Mn4 N32 -","4","0.5","","Yusuke Yoshida; Katsuya Inoue; Mohamedally Kurmoo","Consecutive Irreversible Single-Crystal to Single-Crystal and Reversible Single-Crystal to Glass Transformations and Associated Magnetism of the Coordination Polymer, [MnII(rac-pnH)(H2O)CrIII(CN)6].H2O","Inorganic Chemistry","2009","48","","10726","10736","10.1021/ic901615e","","","0.71073","MoKα","","0.1018","0.0559","","","0.1224","0.135","","","","","","0.928","","","","has coordinates","179074","2020-10-21","18:00:00",""
"4332976","8.0896","0.0017","12.179","0.002","20.433","0.003","90","","90","","90","","2013.1","0.6","293","2","293","2","","","","","","","","4","P m n b","-P 2bc 2a","62","","","","- C9 H20 Gd2 O19 -","- C9 H6 Gd2 O19 -","- C36 H24 Gd8 O76 -","4","0.5","","Cañadillas-Delgado, Laura; Pasán, Jorge; Fabelo, Oscar; Hernández-Molina, María; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Two- and Three-Dimensional Networks of Gadolinium(III) with Dicarboxylate Ligands: Synthesis, Crystal Structure, and Magnetic Properties","Inorganic Chemistry","2006","45","26","10585","10594","10.1021/ic061173d","","x-ray","0.71073","MoKα","","0.0893","0.0562","","","0.1306","0.1431","","","","","","1.021","","","","has coordinates","179432","2020-10-21","18:00:00",""
"4335579","22.2825","0.0007","10.031","0.0004","8.55695","0.0003","90","","90","","90","","1912.61","0.12","293","","","","","","","","","","","5","P m n b","-P 2bc 2a","62","","","","- C12 Mg N2 O13 P4 -","- C12 Mg N2 O13 P4 -","- C48 Mg4 N8 O52 P16 -","4","0.5","","Rosario M. P. Colodrero; Giasemi K. Angeli; Montse Bazaga-Garcia; Pascual Olivera-Pastor; Didier Villemin; Enrique R. Losilla; Estefania Q. Martos; Gary B. Hix; Miguel A. G. Aranda; Konstantinos D. Demadis; Aurelio Cabeza","Structural Variability in Multifunctional Metal Xylenediaminetetraphosphonate Hybrids","Inorganic Chemistry","2013","52","","8770","8783","10.1021/ic400951s","powder diffraction","x-ray","0.2998","synchrotron","","","","","","","","0.08241","","1.98","","","","","","","has coordinates","179458","2020-10-21","18:00:00",""
"4335580","22.2105","0.0011","10.8441","0.0004","8.6118","0.00028","90","","90","","90","","2074.18","0.14","293","","293","","","","","","","","","5","P m n b","-P 2bc 2a","62","","","","- C12 Ca N2 O13 P4 -","- C12 Ca N2 O13 P4 -","- C48 Ca4 N8 O52 P16 -","4","0.5","","Rosario M. P. Colodrero; Giasemi K. Angeli; Montse Bazaga-Garcia; Pascual Olivera-Pastor; Didier Villemin; Enrique R. Losilla; Estefania Q. Martos; Gary B. Hix; Miguel A. G. Aranda; Konstantinos D. Demadis; Aurelio Cabeza","Structural Variability in Multifunctional Metal Xylenediaminetetraphosphonate Hybrids","Inorganic Chemistry","2013","52","","8770","8783","10.1021/ic400951s","powder diffraction","x-ray","0.2998","synchrotron","","","","","","","","0.07106","","2.07","","","","","","","has coordinates","179458","2020-10-21","18:00:00",""
"4335582","22.3117","0.0015","10.0175","0.0005","8.6021","0.0004","90","","90","","90","","1922.63","0.18","293","","293","","","","","","","","","5","P m n b","-P 2bc 2a","62","","","","- C12 N2 O13 P4 Zn -","- C12 N2 O13 P4 Zn -","- C48 N8 O52 P16 Zn4 -","4","0.5","","Rosario M. P. Colodrero; Giasemi K. Angeli; Montse Bazaga-Garcia; Pascual Olivera-Pastor; Didier Villemin; Enrique R. Losilla; Estefania Q. Martos; Gary B. Hix; Miguel A. G. Aranda; Konstantinos D. Demadis; Aurelio Cabeza","Structural Variability in Multifunctional Metal Xylenediaminetetraphosphonate Hybrids","Inorganic Chemistry","2013","52","","8770","8783","10.1021/ic400951s","powder diffraction","x-ray","1.5406","CuKα~1~","","","","","","","","0.0506","","1.97","","","","","","","has coordinates","179458","2020-10-21","18:00:00",""
"6000587","7.318","","10.602","","7.712","","90","","90","","90","","598.34","","","","","","","","","","","","","4","P m n b","","","","","","- Cu F7 In Na2 -","","","","","","Ruchaud, N.; Grannec, J.; Gravereau, P.; Nunez, P.; Tressaud, A.; Massa, W.; Frenzen, G.; Babel, D.","Copper weberites - crystal-structure and magnetic investigation of Na2CuGaF7 and Na2CuINF7","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1992","610","","67","74","10.1002/zaac.19926100112","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"7033130","10.0497","0.0001","19.9849","0.0003","19.7712","0.0002","90","","90","","90","","3970.89","0.08","150","2","150","2","","","","","","","","5","P m n b","-C 2c 2","63","","","","- C15 H12 N O39 Zr6 -","- C15 H12 N O39 Zr6 -","- C60 H48 N4 O156 Zr24 -","4","0.5","","Liang, Weibin; Babarao, Ravichandar; Murphy, Michael J.; D'Alessandro, Deanna Michelle","The First Example of a Zirconium-Oxide Based Metal-Organic Framework Constructed from Monocarboxylate Ligands","Dalton Transactions","2015","44","4","1516","1519","10.1039/C4DT03183K","","","1.54178","CuKα","","0.0572","0.0546","","","0.1687","0.1729","","","","","","1.064","","","","has coordinates,has disorder","180037","2020-10-21","18:00:00",""
"7034625","18.2674","0.0012","7.3169","0.0003","9.9574","0.0006","90","","90","","90","","1330.91","0.13","293","2","293","2","","","","","","","synthesis as described","5","P m n b","-P 2bc 2a","62","","","","- C11 H12 N2 O5 Sr -","- C11 H12 N2 O5 Sr -","- C44 H48 N8 O20 Sr4 -","4","0.5","","Yang, Ying; Lin, Rijia; Ge, Lei; Hou, Lei; Bernhardt, Paul; Rufford, Thomas E.; Wang, Shaobin; Rudolph, Victor; Wang, Yaoyu; Zhu, Zhonghua","Synthesis and characterization of three amino-functionalized metal-organic frameworks based on the 2-aminoterephthalic ligand.","Dalton transactions (Cambridge, England : 2003)","2015","44","17","8190","8197","10.1039/c4dt03927k","","x-ray","0.71073","MoKα","","0.0831","0.0703","","","0.147","0.1519","","","","","","1.227","","","","has coordinates","180052","2020-10-21","18:00:00",""
"7050595","9.452","0.0002","11","0.0003","19.359","0.0007","90","","90","","90","","2012.79","0.1","293","2","293","2","","","","","","","","6","P m n b","-P 2bc 2a","62","","","","- C15 H26 Cl2 Cu N4 O4 -","- C15 H28 Cl2 Cu N4 O4 -","- C60 H112 Cl8 Cu4 N16 O16 -","4","0.5","","Martin Chadim; Pilar Díaz; Enrique García-España; Jana Hodacova; Peter C. Junk; Julio Latorre; José M. Llinares; Conxa Soriano; Jiri Zavada","Copper(II) and Zn(II) coordination chemistry of tetraaza[n]cyclophanes","New J. Chem.","2003","27","7","1132","1139","10.1039/b303470d","","","0.71073","MoKα","","0.1042","0.0439","","","0.128","0.1754","","","","","","1.006","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051743","8.2428","0.0001","9.1428","0.0001","17.6493","0.0003","90","","90","","90","","1330.09","0.03","150","2","150","2","","","","","","","","6","P m n b","-P 2bc 2a","62","","","","- C11 H12 I N O4 S -","- C11 H12 I N O4 S -","- C44 H48 I4 N4 O16 S4 -","4","0.5","","Dolenc, Darko; Modec, Barbara","EDA Complexes of N-halosaccharins with N- and O-donor ligands","New Journal of Chemistry","2009","33","11","2344","","10.1039/b9nj00263d","","","0.71073","MoKα","","0.0226","0.0212","","","0.0521","0.0528","","","","","","1.129","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7105145","15.2889","0.0013","15.9079","0.0013","20.8008","0.0019","90","","90","","90","","5059.1","0.8","173","2","173","2","","","","","","","","5","P m n b","-P 2bc 2a","62","","","","- C40 H68 I4 N8 Rh2 -","- C34 H54 I4 N8 Rh2 -","- C136 H216 I16 N32 Rh8 -","4","0.5","","Krüger, Anneke; Neels, Antonia; Albrecht, Martin","Rhodium-mediated activation of an alkane-type C-H bond.","Chemical communications (Cambridge, England)","2009","46","2","315","317","10.1039/b918660c","","","0.71073","MoKα","","0.117","0.0751","","","0.1913","0.2086","","","","","","0.844","","","","has coordinates","180155","2020-10-21","18:00:00",""
"7204729","6.358","0.002","8.744","0.003","13.594","0.007","90","","90","","90","","755.7","0.5","173","2","173","2","","","","","","","","5","P m n b","-P 2bc 2a","62","2-Chlorocarboxypyridinium Chloride","2-Chlorocarboxypyridinium Chloride","","- C6 H5 Cl2 N O -","- C6 H5 Cl2 N O -","- C24 H20 Cl8 N4 O4 -","4","0.5","","Kalle I. Nättinen; Kari Rissanen","Chloride‒hydrogen interactions of picolinic, nicotinic and isonicotinic acid chloride hydrochlorides in the crystalline state","CrystEngComm","2003","5","57","326","330","10.1039/b307875b","","","0.71069","MoKα","","0.0324","0.0308","","","0.0758","0.0767","","","","","","1.079","","","","has coordinates","180378","2020-10-21","18:00:00",""
"7227817","7.1767","0.0003","7.3661","0.0004","12.3418","0.0007","90","","90","","90","","652.44","0.06","150","2","150","2","","","","","","","","5","P m n b","-P 2bc 2a","62","","","","- C H7 Cu N3 O5 -","- C H7 Cu N3 O5 -","- C4 H28 Cu4 N12 O20 -","4","0.5","","Bovill, Sally M.; Dixey, Richard J. C.; Saines, Paul J.","Three coordination frameworks with copper formate based low dimensional motifs: synthesis, structure and magnetic properties","CrystEngComm","2017","19","13","1831","","10.1039/C6CE01601D","","","0.71073","MoKα","","0.0734","0.0496","","","0.1366","0.1872","","","","","","1.205","","","","has coordinates","195024","2020-10-21","18:00:00",""
"7234501","7.571","0.003","13.666","0.005","13.86","0.005","90","","90","","90","","1434","0.9","200","2","","","","","","","","","","3","P m n b","-P 2bc 2a","62","","","","- Br14 Ce4 Cs2 -","- Br14 Ce4 Cs2 -","- Br28 Ce8 Cs4 -","2","0.25","","Yuntao Wu; Hongliang Shi; Bryan C. Chakoumakos; Mariya Zhuravleva; Mao-Hua Du; Charles L. Melcher","Crystal structure, electronic structure, temperature-dependent optical and scintillation properties of CsCe2Br7","Journal of Materials Chemistry C","2015","3","","11366","11376","10.1039/C5TC02721G","","","0.71073","MoKα","","0.0866","0.0724","","","0.2","0.2209","","","","","","1.167","","","","has coordinates","219199","2020-10-21","18:00:00",""
"7235276","10.892","0.003","8.013","0.0019","14.444","0.003","90","","90","","90","","1260.6","0.5","293","2","293","2","","","","","","","","4","P m n b","-P 2bc 2a","62","34a","34a","","- C11 H6 O2 S5 -","- C11 H6 O2 S5 -","- C44 H24 O8 S20 -","4","0.5","","Sun, Jibin; Lu, Xiaofeng; Shao, Jiafeng; Cui, Zili; Shao, Yu; Jiang, Guiyang; Yu, Wei; Shao, Xiangfeng","Straightforward access to aryl-substituted/fused 1,3-dithiole-2-chalcogenones by Cu-catalyzed C‒S coupling between aryl iodides and zinc‒thiolate complex (TBA)2[Zn(DMIT)2]","RSC Advances","2013","3","26","10193","","10.1039/c3ra41349g","","","0.71073","MoKα","","0.0466","0.0346","","","0.0814","0.0919","","","","","","1.046","","","","has coordinates,has disorder","232644","2020-10-21","18:00:00",""
"7237907","8.5385","0.0005","11.0894","0.0004","17.9031","0.0007","90","","90","","90","","1695.19","0.13","269.96","0.16","269.96","0.16","","","","","","","","5","P m n b","-P 2bc 2a","62","","","","- C8 H20 Cl5 N2 Sb -","- C8 H20 Cl5 N2 Sb -","- C32 H80 Cl20 N8 Sb4 -","4","0.5","","Ksiądzyna, Martyna; Gągor, Anna; Piecha-Bisiorek, Anna; Ciżman, Agnieszka; Medycki, Wojciech; Jakubas, Ryszard","Exploring a hybrid ferroelectric with a 1-D perovskite-like structure: bis(pyrrolidinium) pentachloroantimonate(iii)","Journal of Materials Chemistry C","2019","7","33","10360","","10.1039/C9TC02849H","","x-ray","0.71073","MoKα","","0.0998","0.0747","","","0.2412","0.2702","","","","","","1.06","","","","has coordinates","238738","2020-10-21","18:00:00",""
"8103684","10.4796","","5.0172","","17.479","","90","","90","","90","","919.015","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","Li1.94 Cu2.06 (Mo O4)3","","- Cu2.06 Li1.94 Mo3 O12 -","- Cu2.06 Li1.94 Mo3 O12 -","- Cu8.24 Li7.76 Mo12 O48 -","4","0.5","","Wiesmann, M.; Geselle, M.; Weitzel, H.; Fuess, H.","Crystal structure of lithium copper molybdate, Li2 Cu2 (Mo O4)3","Zeitschrift fuer Kristallographie (149,1979-)","1994","209","","615","615","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"9000260","5.83","","9.79","","4.769","","90","","90","","90","","272.194","","","","","","","","","","","","Fletcher Quarry, North Groton, New Hampshire, USA","4","P m n b","-P 2bc 2a","62","","","Heterosite","- Fe0.65 Mn0.35 O4 P -","- Fe0.65 Mn0.35 O4 P -","- Fe2.6 Mn1.4 O16 P4 -","4","0.5","","Eventoff, W.; Martin, R.; Peacor, D. R.","The crystal structure of heterosite","American Mineralogist","1972","57","","45","51","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000680","6.406","","10.52","","5.043","","90","","90","","90","","339.853","","","","723.15","","","","","","","","","4","P m n b","-P 2bc 2a","62","","","","- Li1.2 O4 Si1.6 Zn0.2 -","- Li1.2 O4 Si1.6 Zn0.2 -","- Li4.8 O16 Si6.4 Zn0.8 -","4","0.5","","Yu, S. C.; Smith, D. K.; Austerman, S. B.","The crystal structures and the phase transformation of Zn-Li silicates T = 450 C","American Mineralogist","1978","63","","1241","1248","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:39",""
"9002584","12.418","","15.427","","5.6895","","90","","90","","90","","1089.95","","","","","","","","","","","","Lengenbach quarry, Binnatal, Switzerland","5","P m n b","-P 2bc 2a","62","","","Sicherite","- Ag2 As2.03 S6 Sb0.97 Tl -","- Ag2 As2.03 S6 Sb0.97 Tl -","- Ag8 As8.12 S24 Sb3.88 Tl4 -","4","0.5","","Graeser, S.; Berlepsch, P.; Makovicky, E.; Balic-Zunic T","Sicherite, TlAg2(As,Sb)3S6 - a new sulfosalt from Lengenbach (Binntal, Switzerland): Description and structure determination Locality: Legenbach quarry, Binnatal, Switzerland","American Mineralogist","2001","86","","1087","1093","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9003495","8.882","","20.1","","4.614","","90","","90","","90","","823.729","","","","","","","","","","","","","2","P m n b","-P 2bc 2a","62","","","Empressite","- Ag Te -","- Ag Te -","- Ag16 Te16 -","16","2","","Bindi, L.; Spry, P. G.; Cipriani, C.","Empressite, AgTe, from the Empress-Josephine Mine, Colorado, USA: Composition, physical properties, and determination of the crystal structure","American Mineralogist","2004","89","","1043","1047","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:31",""
"9004121","6.861","","8.987","","5.045","","90","","90","","90","","311.074","","","","","","","","","","","","","7","P m n b","-P 2bc 2a","62","","","Maricite","- Ca0.01 Fe0.9 Mg0.03 Mn0.06 Na O4 P -","- Ca0.01 Fe0.9 Mg0.03 Mn0.06 Na O4 P -","- Ca0.04 Fe3.6 Mg0.12 Mn0.24 Na4 O16 P4 -","4","0.5","","Le Page, Y.; Donnay, G.","The crystal structure of the new mineral maricite, NaFePO4","The Canadian Mineralogist","1977","15","","518","521","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004174","5.249","","10.711","","5.133","","90","","90","","90","","288.588","","","","","","","","","","","","","3","P m n b","-P 2bc 2a","62","","","Tungstite","- H2 O4 W -","- H2 O4 W -","- H8 O16 W4 -","4","0.5","","Szymanski, J. T.; Roberts, A. C.","The crystal structure of tungstite, WO3.H2O","The Canadian Mineralogist","1984","22","","681","688","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004248","6.884","","9.976","","4.927","","90","","90","","90","","338.361","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","","Nalipoite","- Li2 Na O4 P -","- Li2 Na O4 P -","- Li8 Na4 O16 P4 -","4","0.5","","Ercit, T. S.","The crystal structure of nalipoite","The Canadian Mineralogist","1991","29","","569","573","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9007616","5.918","","10.037","","4.798","","90","","90","","90","","284.996","","","","","","","","","","","","Sidi-Bou-Othmane, Jebilet, Morocco","8","P m n b","-P 2bc 2a","62","","","Ferrisicklerite","- Ca0.017 Fe0.614 Li0.301 Mg0.036 Mn0.333 Na0.014 O4 P0.965 -","- Ca0.017 Fe0.614 Li0.301 Mg0.036 Mn0.333 Na0.0135 O4 P0.965 -","- Ca0.068 Fe2.456 Li1.204 Mg0.144 Mn1.332 Na0.054 O16 P3.86 -","4","0.5","","Alberti, A.","Crystal structure of ferrisicklerite, Li<1(Fe3+,Mn2+)PO4","Acta Crystallographica, Section B","1976","32","","2761","2764","10.1107/S0567740876008832","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9008046","5.963","","12.735","","4.325","","90","","90","","90","","328.435","","","","","","","","","","","","","2","P m n b","-P 2bc 2a","62","","","","- Cl2 Hg -","- Cl2 Hg -","- Cl16 Hg8 -","8","1","","Brakken, H.; Scholten, W.","Die kristallstruktur des quecksilberchlorids HgCl2","Zeitschrift fur Kristallographie","1934","89","","448","455","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9009358","13.011","","14.31","","6.757","","90","","90","","90","","1258.07","","","","","","","","","","","","Baveno, Novara, Italy","6","P m n b","-P 2bc 2a","62","","","Kainosite-(Y)","- C H2 Ca2 O16 Si4 Y2 -","- C H2 Ca2 O16 Si4 Y2 -","- C4 H8 Ca8 O64 Si16 Y8 -","4","0.5","","Giuseppetti, G.; Tadini, C.; Oddone, M.","Cenosite-(Y) from Baveno, Novara (Italy): crystal structure","Neues Jahrbuch fur Mineralogie, Monatshefte","1989","1989","","153","164","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009531","12.93","","14.3","","6.73","","90","","90","","90","","1244.37","","","","","","","","","","","","","5","P m n b","-P 2bc 2a","62","","","Kainosite-(Y)","- C Ca2 O16 Si4 Y2 -","- C Ca2 O16 Si4 Y2 -","- C4 Ca8 O64 Si16 Y8 -","4","0.5","","Volodina, G. F.; Rumanova, I. M.; Belov, N. V.","Crystal structure of kaynozite Ca2(Y,Tr)2[Si4O12]CO3*H2O Note: z(O3) adjusted to match reported bond lengths","Doklady Akademii Nauk SSSR","1963","149","","173","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9011037","6.1","","10.46","","4.744","","90","","90","","90","","302.696","","","","","","","","","","","","Synthetic","4","P m n b","-P 2bc 2a","62","","","Lithiophilite","- Li Mn O4 P -","- Li Mn O4 P -","- Li4 Mn4 O16 P4 -","4","0.5","","Geller, S.; Durand, J. L.","Refinement of the structure of LiMnPO4","Acta Crystallographica","1960","13","","325","331","10.1107/S0365110X60002521","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9011044","6.12","","10.53","","4.93","","90","","90","","90","","317.707","","","","","","","","","","","","","3","P m n b","-P 2bc 2a","62","","","Lithiophosphate","- Li3 O4 P -","- Li3 O4 P -","- Li12 O16 P4 -","4","0.5","","Zemann, J.","Die kristallstruktur von lithiumphosphat, Li3PO4","Acta Crystallographica","1960","13","","863","867","10.1107/S0365110X60002132","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9012081","7.38","","20.13","","7.22","","90","","90","","90","","1072.6","","","","","","","","","","","","","4","P m n b","-P 2bc 2a","62","","","Parabutlerite","- Fe H5 O7 S -","- Fe O7 S -","- Fe8 O56 S8 -","8","1","","Borene, J.","Structure cristalline de la parabutlerite","Bulletin de la Societe Francaise de Mineralogie et de Cristallographie","1970","93","","185","189","","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:28",""
"9012203","6.1153","","10.469","","4.9195","","90","","90","","90","","314.952","","","","","","","","","","","","Synthetic","4","P m n b","-P 2bc 2a","62","","","Lithiophosphate","- Li2.88 N0.14 O3.73 P -","- Li2.88 N0.14 O3.73 P -","- Li11.52 N0.56 O14.92 P4 -","4","0.5","","Wang, B.; Chakoumakos, B. C.; Sales, B. C.; Kwak, B. S.; Bates, J. B.","Synthesis, crystal structure, and ionic conductivity of a polycrystalline lithium phosphorus oxynitride with the gamma-Li3PO4 structure Note: reported bond lengths inconsistent with reported structure","Journal of Solid State Chemistry","1995","115","","313","323","10.1006/jssc.1995.1140","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012204","6.1113","","10.4612","","4.9208","","90","","90","","90","","314.594","","","","","","","","","","","","Synthetic","3","P m n b","-P 2bc 2a","62","","","Lithiophosphate","- Li3 O4 P -","- Li3 O4 P -","- Li12 O16 P4 -","4","0.5","","Wang, B.; Chakoumakos, B. C.; Sales, B. C.; Kwak, B. S.; Bates, J. B.","Synthesis, crystal structure, and ionic conductivity of a polycrystalline lithium phosphorus oxynitride with the gamma-Li3PO4 structure","Journal of Solid State Chemistry","1995","115","","313","323","10.1006/jssc.1995.1140","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012821","6.1147","","10.475","","4.9228","","90","","90","","90","","315.313","","","","","","","","","","","","Synthetic","3","P m n b","-P 2bc 2a","62","","","Lithiophosphate","- Li3 O4 P -","- Li3 O4 P -","- Li12 O16 P4 -","4","0.5","","Baur, W. H.","Solid solutions between octahedral and tetrahedral olivine types in Li-Zn-germanates","Inorganic and Nuclear Chemistry Letters","1980","16","","525","527","10.1016/0020-1650(80)80003-1","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9015471","6.9349","","25.1737","","11.2195","","90","","90","","90","","1958.67","","","","","","","","","","","","Mono Lake, California, USA","6","P m n b","-P 2bc 2a","62","","","Hazenite","- H28 K Mg2 Na O22 P2 -","- H28 K Mg2 Na O22 P2 -","- H112 K4 Mg8 Na4 O88 P8 -","4","0.5","","Yang, H.; Sun, H. J.; Downs, R. T.","Hazenite, KNaMg2(PO4)2*14H2O, a new biologically related phosphate mineral, from Mono Lake, California, U.S.A.","American Mineralogist","2011","96","","675","681","10.2138/am.2011.3668","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9016073","10.1035","","9.7819","","10.1523","","90","","90","","90","","1003.37","","","","","","","","","","","","Bundoora, Melbourne, Victoria, Australia","6","P m n b","-P 2bc 2a","62","","","Gobbinsite","- Al0.706 Ca0.154 H3.27 Na0.592 O5.635 Si1.294 -","- Al0.706 Ca0.154 H3.27 Na0.592 O5.635 Si1.294 -","- Al5.648 Ca1.232 H26.16 Na4.736 O45.08 Si10.352 -","8","1","","Gatta, G. D.; Birch, W. D.; Rotiroti, N.","Reinvestigation of the crystal structure of the zeolite gobbinsite: a single-crystal x-ray diffraction study","American Mineralogist","2010","95","","481","486","10.2138/am.2010.3390","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9017073","6.9661","","25.236","","11.2919","","90","","90","","90","","1985.08","","","","","","","","","","","","Synthetic","7","P m n b","-P 2bc 2a","62","","","","- H28 K0.216 Mg2 N0.784 Na O22 P2 -","- H28 K0.216 Mg2 N0.784 Na O22 P2 -","- H112 K0.864 Mg8 N3.136 Na4 O88 P8 -","4","0.5","","Yang, H.; Martinelli, L.; Tasso, F.; Sprocati, A. R.; Pinzari, F.; Liu, Z.; Downs, R. T.; Sun, H. J.","A new biogenic, struvite-related phosphate, the ammonium-analog of hazenite, (NH4)NaMg2(PO4)2*14H2O","American Mineralogist","2014","99","","1761","1766","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:55",""