# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-01-31T20:47:54+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'P 4/m c c' 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
"1510373","5.75","","5.75","","10.348","","90","","90","","90","","342.131","","","","","","","","","","","","","3","P 4/m c c","-P 4 2c","124","","Cd (Au F4)2","","- Au2 Cd F8 -","- Au2 Cd F8 -","- Au4 Cd2 F16 -","2","0.125","","Bialowons, H.; Mueller, B.G.","Synthese und Struktur von M(II) (Au F4)2 (M(II) = Cd, Hg)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1997","623","","1719","1722","10.1002/zaac.19976231108","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510401","5.756","","5.756","","10.423","","90","","90","","90","","345.33","","","","","","","","","","","","","3","P 4/m c c","-P 4 2c","124","","Hg (Au F4)2","","- Au2 F8 Hg -","- Au2 F8 Hg -","- Au4 F16 Hg2 -","2","0.125","","Bialowons, H.; Mueller, B.G.","Synthese und Struktur von M(II) (Au F4)2 (M(II) = Cd, Hg)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1997","623","","1719","1722","10.1002/zaac.19976231108","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510440","8.251","","8.251","","19.961","","90","","90","","90","","1358.93","","","","","","","","","","","","","4","P 4/m c c","-P 4 2c","124","","K2 (Au2 Sn2 Se6)","","- Au2 K2 Se6 Sn2 -","- Au2 K2 Se6 Sn2 -","- Au8 K8 Se24 Sn8 -","4","0.25","","Loeken, S.; Tremel, W.","Synthesis, Structures, and Properties of New Quaternary Gold-Chalcogenides: K2 Au2 Ge2 S6, K2 Au2 Sn2 Se6, and Cs2 Au2 Sn S4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1998","624","","1588","1594","10.1002/(SICI)1521-3749(199810)624:10<1588::AID-ZAAC1588>3.0.CO;2-X","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1533943","6.118","","6.118","","4.996","","90","","90","","90","","187","","","","","","","","","","","","","3","P 4/m c c","-P 4 2c","124","","Nb4 Co P","","- Co Nb4 P -","- Co Nb4 P -","- Co2 Nb8 P2 -","2","0.125","","Palfii, J.F.; Kuz'ma, Yu.B.","New Ternary Phosphides with the Nb4 Co Si Type Structure","Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Tekhnichni ta Matematichni Nauki","1977","1977","","262","265","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1545338","8.6742","0.0003","8.6742","0.0003","25.3428","0.001","90","","90","","90","","1906.84","0.12","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 Ce N O8 Pt2 S8 -","- C24 H44 Ce N O8 Pt2 S8 -","- C48 H88 Ce2 N2 O16 Pt4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.03","0.0175","","","0.0321","0.0362","","","","","","1.115","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545339","8.5991","0.0003","8.5991","0.0003","25.4694","0.0009","90","","90","","90","","1883.32","0.11","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 Ho N O8 Pt2 S8 -","- C24 H44 Ho N O8 Pt2 S8 -","- C48 H88 Ho2 N2 O16 Pt4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0262","0.017","","","0.0284","0.0306","","","","","","1.1019","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545340","8.6867","0.0004","8.6867","0.0004","25.3813","0.0015","90","","90","","90","","1915.24","0.17","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 La N O8 Pt2 S8 -","- C24 H44 La N O8 Pt2 S8 -","- C48 H88 La2 N2 O16 Pt4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0466","0.0287","","","0.0489","0.0537","","","","","","1.1112","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545341","8.5697","0.0003","8.5697","0.0003","25.5067","0.001","90","","90","","90","","1873.21","0.12","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 Lu N O8 Pt2 S8 -","- C24 H44 Lu N O8 Pt2 S8 -","- C48 H88 Lu2 N2 O16 Pt4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0243","0.0172","","","0.0365","0.0396","","","","","","1.1172","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545342","8.6502","0.0003","8.6502","0.0003","25.3992","0.0011","90","","90","","90","","1900.52","0.12","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 N Nd O8 Pt2 S8 -","- C24 H44 N Nd O8 Pt2 S8 -","- C48 H88 N2 Nd2 O16 Pt4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0234","0.0166","","","0.0603","0.0671","","","","","","1.0324","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545343","8.6615","0.0004","8.6615","0.0004","25.413","0.0014","90","","90","","90","","1906.52","0.16","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 N O8 Pr Pt2 S8 -","- C24 H44 N O8 Pr Pt2 S8 -","- C48 H88 N2 O16 Pr2 Pt4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0231","0.015","","","0.0303","0.0329","","","","","","1.0796","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545344","8.6302","0.0003","8.6302","0.0003","25.4187","0.0009","90","","90","","90","","1893.19","0.11","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 N O8 Pt2 S8 Sm -","- C24 H44 N O8 Pt2 S8 Sm -","- C48 H88 N2 O16 Pt4 S16 Sm2 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0213","0.014","","","0.0292","0.0321","","","","","","1.0902","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545345","8.6098","0.0011","8.6098","0.0011","25.515","0.004","90","","90","","90","","1891.4","0.5","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 Dy N O8 Pt2 S8 -","- C24 H44.0001 Dy N O8 Pt2 S8 -","- C48 H88.0002 Dy2 N2 O16 Pt4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0283","0.0182","","","0.0374","0.0409","","","","","","1.0728","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545346","8.5844","0.0004","8.5844","0.0004","25.5043","0.0014","90","","90","","90","","1879.46","0.16","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 N O8 Pt2 S8 Tm -","- C24 H44 N O8 Pt2 S8 Tm -","- C48 H88 N2 O16 Pt4 S16 Tm2 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0325","0.0189","","","0.0336","0.0374","","","","","","1.0957","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545347","8.5854","0.0004","8.5854","0.0004","25.5257","0.0015","90","","90","","90","","1881.48","0.17","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 N O8 Pt2 S8 Y -","- C24 H44 N O8 Pt2 S8 Y -","- C48 H88 N2 O16 Pt4 S16 Y2 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0225","0.0143","","","0.0296","0.0327","","","","","","1.0591","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545348","8.5693","0.0004","8.5693","0.0004","25.5201","0.0014","90","","90","","90","","1874.02","0.16","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 N O8 Pt2 S8 Yb -","- C24 H44 N O8 Pt2 S8 Yb -","- C48 H88 N2 O16 Pt4 S16 Yb2 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0217","0.0145","","","0.0296","0.033","","","","","","1.0647","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545349","8.5857","0.0003","8.5857","0.0003","25.5107","0.0009","90","","90","","90","","1880.5","0.11","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 Er N O8 Pt2 S8 -","- C24 H44 Er N O8 Pt2 S8 -","- C48 H88 Er2 N2 O16 Pt4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0219","0.014","","","0.0295","0.0322","","","","","","1.0967","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545350","8.6049","0.0003","8.6049","0.0003","25.4824","0.0011","90","","90","","90","","1886.83","0.12","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 N O8 Pt2 S8 Tb -","- C24 H44 N O8 Pt2 S8 Tb -","- C48 H88 N2 O16 Pt4 S16 Tb2 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0298","0.0177","","","0.0347","0.039","","","","","","1.0857","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545351","8.68","0.0004","8.68","0.0004","25.8359","0.0012","90","","90","","90","","1946.54","0.16","295","","295","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 Gd N O8 Pt2 S8 -","- C24 H44 Gd N O8 Pt2 S8 -","- C48 H88 Gd2 N2 O16 Pt4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0316","0.021","","","0.0653","0.074","","","","","","1.0425","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545352","8.6134","0.0003","8.6134","0.0003","25.4434","0.0009","90","","90","","90","","1887.66","0.11","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 Gd N O8 Pt2 S8 -","- C24 H44 Gd N O8 Pt2 S8 -","- C48 H88 Gd2 N2 O16 Pt4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0215","0.0164","","","0.0522","0.0559","","","","","","1.0895","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545353","8.6247","0.0003","8.6247","0.0003","25.4329","0.0009","90","","90","","90","","1891.84","0.11","122","","122","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 Eu N O8 Pt2 S8 -","- C24 H44 Eu N O8 Pt2 S8 -","- C48 H88 Eu2 N2 O16 Pt4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0232","0.0165","","","0.0339","0.0362","","","","","","1.1136","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545354","8.6832","0.0002","8.6832","0.0002","25.8856","0.0009","90","","90","","90","","1951.72","0.09","295","","295","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 Gd N O8 Pd2 S8 -","- C24 H44 Gd N O8 Pd2 S8 -","- C48 H88 Gd2 N2 O16 Pd4 S16 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.048","0.0283","","","0.048","0.0533","","","","","","1.1018","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1545355","8.6638","0.0003","8.6638","0.0003","25.8747","0.0009","90","","90","","90","","1942.19","0.12","295","","295","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C24 H44 N O8 Pd2 S8 Y -","- C24 H44 N O8 Pd2 S8 Y -","- C48 H88 N2 O16 Pd4 S16 Y2 -","2","0.125","","Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper","Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands","Chem. Sci.","2017","8","5","3566","","10.1039/C7SC00135E","","","0.71073","MoKα","","0.0378","0.0246","","","0.0467","0.0514","","","","","","1.0878","","","","has coordinates,has disorder","196331","2020-10-21","18:00:00",""
"1558516","9.352","0.002","9.352","0.002","17.264","0.004","90","","90","","90","","1509.9","0.6","","","293","","","","","","","","","6","P 4/m c c","-P 4 2c","124","Difluorotetrakis(3,5-dimethylpyridine)cobalt(II).n Hydrate [n = 2.6(3)]","","","- C28 H41.2 Co F2 N4 O2.6 -","- C28 Co F2 N4 O2.56 -","- C56 Co2 F4 N8 O5.12 -","2","0.125","","Kenessey, G.; Lashgari, K.; Machula, G.; Liptay, G.","Pyridine-Type Complexes of Transition-Metal Halides. VIII. Preparation, Characterization and Single-Crystal Structure of Difluorotetrakis(3,5-dimethylpyridine)cobalt(II).n Hydrate [n = 2.6(3)]","Acta Chemica Scandinavica","1994","48","","705","710","10.3891/acta.chem.scand.48-0705","","x-ray","0.71073","MoKα","","","0.041","","","0.047","0.056","","","","","","","","","","has coordinates","254059","2020-10-21","18:00:00",""
"1562163","7.497","0.002","7.497","0.002","14.886","0.004","90","","90","","90","","836.7","0.4","100","2","100","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","Calcium sodium thorium silicate","","","- Ca Na2 O20 Si8 Th -","- Ca Na2 O20 Si8 Th -","- Ca2 Na4 O40 Si16 Th2 -","2","0.125","","Jin, Geng Bang; Soderholm, L.","Solid-state syntheses and single-crystal characterizations of three tetravalent thorium and uranium silicates","Journal of Solid State Chemistry","2015","221","","405","410","10.1016/j.jssc.2014.10.018","","","0.71073","MoKα","","0.0349","0.0231","","","0.051","0.0563","","","","","","1.164","","","","has coordinates","264589","2021-04-27","09:29:37",""
"1562164","7.4379","0.0016","7.4379","0.0016","14.888","0.003","90","","90","","90","","823.6","0.3","100","2","100","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","Calcium sodium uranium silicate","","","- Ca Na2 O20 Si8 U -","- Ca Na2 O20 Si8 U -","- Ca2 Na4 O40 Si16 U2 -","2","0.125","","Jin, Geng Bang; Soderholm, L.","Solid-state syntheses and single-crystal characterizations of three tetravalent thorium and uranium silicates","Journal of Solid State Chemistry","2015","221","","405","410","10.1016/j.jssc.2014.10.018","","","0.71073","MoKα","","0.0388","0.0292","","","0.0727","0.0793","","","","","","1.267","","","","has coordinates","264589","2021-04-27","09:29:42",""
"2012331","8.173","0.001","8.173","0.001","20.278","0.004","90","","90","","90","","1354.5","0.4","293","2","293","2","","","","","","","","4","P 4/m c c","-P 4 2c","124","","Potassium Silver Tin Selenide","","- Ag2 K2 Se6 Sn2 -","- Ag2 K2 Se6 Sn2 -","- Ag8 K8 Se24 Sn8 -","4","0.25","IZ1017","Guo, Hongyou; Li, Zhenghe; Yang, Lin; Wang, Ping; Huang, Xiaoying; Li, Jing","Potassium silver tin selenide, K~2~Ag~2~Sn~2~Se~6~","Acta Crystallographica Section C","2001","57","11","1237","1238","10.1107/S0108270101014299","","","0.71073","MoKα","","0.088","0.0306","","","","0.0476","","","","","","0.993","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2101236","6.4835","0.0002","6.4835","0.0002","6.8217","0.0005","90","","90","","90","","286.76","","100","","100","","","","","","","","","2","P 4/m c c","-P 4 2c","","","","","- Nb Te4 -","- Nb0.25 Te -","- Nb2 Te8 -","8","0.5","SE0142","Kusz, J.; Böhm, H.","The low-temperature structure of NbTe~4~","Acta Crystallographica Section B","1994","50","6","649","655","10.1107/S0108768194005161","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","302835","2025-10-07","14:57:24",""
"2103884","13.997","0.002","13.997","0.002","6.523","0.001","90","","90","","90","","1278","0.3","293","2","293","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","iodine-doped uranium pthalocyianine","","","- C64 H32 I1.74 N16 U0.96 -","- C64 H32 I1.744 N16 U0.958 -","- C64 H32 I1.744 N16 U0.958 -","1","0.0625","CK0017","Krawczyk, J.; Pietraszko, A.; Kubiak, R.; Łukaszewicz, K.","Diffuse scattering and short-range order in uranium iodine phthalocyanine [U~1{-~<i>x</i>}Pc~2~]I~2{-~<i>y</i>} and the X-ray structure analysis of crystals with diffuse superstructure reflections","Acta Crystallographica Section B","2003","59","3","384","392","10.1107/S0108768103004804","","","0.71073","MoKα","","0.0473","0.0362","","","0.0779","0.0822","","","","","","1.199","","","","has coordinates,has Fobs","209451","2020-10-21","18:00:00",""
"2103885","13.995","0.002","13.993","0.002","6.513","0.001","90","","90","","90","","1275.5","0.3","293","2","293","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","iodine-doped uranium phtalocyianine","","","- C64 H32 I1.86 N16 U0.97 -","- C64 H32 I1.864 N16 U0.968 -","- C64 H32 I1.864 N16 U0.968 -","1","0.0625","CK0017","Krawczyk, J.; Pietraszko, A.; Kubiak, R.; Łukaszewicz, K.","Diffuse scattering and short-range order in uranium iodine phthalocyanine [U~1{-~<i>x</i>}Pc~2~]I~2{-~<i>y</i>} and the X-ray structure analysis of crystals with diffuse superstructure reflections","Acta Crystallographica Section B","2003","59","3","384","392","10.1107/S0108768103004804","","","0.71073","MoKα","","0.0453","0.0387","","","0.0909","0.0943","","","","","","1.173","","","","has coordinates,has Fobs","209451","2020-10-21","18:00:00",""
"2105476","9.4644","0.0006","9.4644","0.0005","31.9063","0.0019","90","","90","","90","","2858","0.3","300","1","300","1","","","","","","","","3","P 4/m c c","-P 4 2c","124","","","","- I3 Nb10 Se40 -","- I3 Nb10 Se40 -","- I6 Nb20 Se80 -","2","0.125","WF5106","Zubko, Maciej; Kusz, Joachim; Prodan, Albert; Šturm, Sašo; van Midden, Herman J. P.; Bennett, J. Craig; Dubin, Grzegorz; Zupanič, Erik; Böhm, Horst","Structural phase transition and related electronic properties in quasi-one-dimensional (NbSe~4~)~10/3~I","Acta Crystallographica Section B","2013","69","3","229","237","10.1107/S2052519213010336","","","0.71073","MoKα","","0.0482","0.032","","","0.0768","0.0806","","","","","","1.031","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2107430","7.58","","7.58","","14.77","","90","","90","","90","","848.631","","","","","","","","","","","","","6","P 4/m c c","-P 4 2c","124","","Th2 K2 Na2 Ca2 (Si16 O40)","","- Ca2 K2 Na2 O40 Si16 Th2 -","- Ca2 K2 Na2 O40 Si16 Th2 -","- Ca2 K2 Na2 O40 Si16 Th2 -","1","0.0625","","Richard, P.; Perrault, G.","Structure cristalline de l'ekanite de St-Hilaire, P.Q.","Acta Crystallographica B (24,1968-38,1982)","1972","28","","1994","1999","","","","","","","","","","","","","","","","","","","","","","has coordinates","174190","2020-10-21","18:00:00",""
"2300522","6.3616","","6.3616","","6.837","","90","","90","","90","","276.693","","","","","","","","","","","","","2","P 4/m c c","-P 4 2c","124","","","","- Nb Te4 -","- Nb Te4 -","- Nb2 Te8 -","2","0.125","","Dusek, M.; Petricek, V.; Dinnebier, R.E.; Wunschel, M.; van Smaalen, S.","Refinement of modulated structures against X-ray powder diffraction data with JANA2000","Journal of Applied Crystallography","2001","34","","398","404","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310810","6.21","","6.21","","11","","90","","90","","90","","424.205","","","","","","","","","","","","","3","P 4/m c c","-P 4 2c","124","","Ca O2 (H2 O)8","","- Ca H16 O10 -","- Ca H16 O10 -","- Ca2 H32 O20 -","2","0.125","","Shineman, R.S.; King, A.J.","The space group of calcium peroxide octahydrate","Acta Crystallographica (1,1948-23,1967)","1951","4","","67","68","","","","","","","","","","","","","","","","","","","","","","has coordinates","199684","2020-10-21","18:00:00",""
"4001732","7.968","","7.968","","19.2","","90","","90","","90","","1218.99","","","","","","","","","","","","","4","P 4/m c c","-P 4 2c","124","","K2 (Au2 Sn2 S6)","","- Au2 K2 S6 Sn2 -","- Au2 K2 S6 Sn2 -","- Au8 K8 S24 Sn8 -","4","0.25","","Kanatzidis, M.G.; Liao, J.-H.","Quaternary Rb2 Cu2 SnS4, A2 Cu2 Sn2 S6 (A= Na, K, Rb, Cs), A2 Cu2 Sn2 Se6 (A= K, Rb), K2 Au2 SnS4 and K2 Au2 Sn2 S6. Syntheses, structures and properties of new solid-state chalcogenides based on tetrahedral (Sn S4)(4-) units","Chemistry of Materials (1,1989-)","1993","5","","1561","1569","","","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4306198","8.988","0.002","8.988","0.002","17.355","0.004","90","","90","","90","","1402","0.5","93","2","93","2","","","","","","","","6","P 4/m c c","-P 4 2c","124","","","","- C6 H8 Cu0.25 F1.34 N V0.25 -","- C6 H8 Cu0.25 F1.344 N V0.25 -","- C48 H64 Cu2 F10.752 N8 V2 -","8","0.5","","Thushitha Mahenthirarajah; Yang Li; Philip Lightfoot","Hydrothermal Synthesis of Vanadium Oxyfluoride Chains Incorporating Covalently Bound Copper Coordination Complexes","Inorganic Chemistry","2008","47","","9097","9102","10.1021/ic801106h","","","0.71073","MoKα","","0.0829","0.0793","","","0.238","0.2433","","","","","","1.165","","","","has coordinates","179099","2020-10-21","18:00:00",""
"4321956","13.927","0.002","13.927","0.002","6.409","0.001","90","","90","","90","","1243.1","0.3","295","2","293","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","","","","- C64 H32 I2 N16 Yb -","- C64 H32 I2 N16 Yb -","- C64 H32 I2 N16 Yb -","1","0.0625","","Jan Janczak; Ryszard Kubiak; Adam Jezierski","Mixed-Valence, Disordered Structures and Characterization of Iodine-Doped Phthalocyanines: [YbPc2]I2 and [(AsPc)(Pc)]I2","Inorganic Chemistry","1999","38","","2043","2049","10.1021/ic981168c","","","0.71073","MoKα","","0.0934","0.039","","","0.0951","0.1124","","","","","","1.068","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321957","13.926","0.002","13.926","0.002","6.433","0.001","90","","90","","90","","1247.6","0.3","295","2","293","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","","","","- C32 H16 As0.5 I N8 -","- C32 H16 As0.5 I N8 -","- C64 H32 As I2 N16 -","2","0.125","","Jan Janczak; Ryszard Kubiak; Adam Jezierski","Mixed-Valence, Disordered Structures and Characterization of Iodine-Doped Phthalocyanines: [YbPc2]I2 and [(AsPc)(Pc)]I2","Inorganic Chemistry","1999","38","","2043","2049","10.1021/ic981168c","","","0.71073","MoKα","","0.1249","0.0638","","","0.1665","0.2008","","","","","","0.965","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4343736","9.908","","9.908","","6.487","","90","","90","","90","","636.819","","","","","","","","","","","","","5","P 4/m c c","-P 4 2c","124","","Tl4 Pt (C N)4 C O3","","- C5 N4 O3 Pt Tl4 -","- C5 N4 O3 Pt Tl4 -","- C10 N8 O6 Pt2 Tl8 -","2","0.125","","Beno, M.A.; Rotella, F.J.; Jorgensen, J.M.; Williams, J.M.","Structural studies of precursor and partially oxidized conducting complexes. 21. Single-crystal and powder time-of-flight neutron diffraction studies of Tl4 (Pt (C N)4)1 C O3","Inorganic Chemistry","1981","20","","1802","1806","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343875","6.201","","6.201","","11.639","","90","","90","","90","","447.547","","","","","","","","","","","","","4","P 4/m c c","-P 4 2c","124","","Y K (C4 O4)2","","- C8 K O8 Y -","- C8 K O8 Y -","- C16 K2 O16 Y2 -","2","0.125","","Mahe, N.; Bataille, T.","Synthesis, crystal structure from single-crystal and powder x-ray diffraction data, and thermal behavior of mixed potassium lanthanide squarates: thermal transformations of layered [Ln (H2 O)6)] K (H2 C2 O4) (C4 O4)2 into pillared Ln K (C4 O4)2 (Ln = Y, La, Gd, Er)","Inorganic Chemistry","2004","43","","8379","8386","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"6000064","6.877","","6.877","","5.66","","90","","90","","90","","267.68","","","","","","","","","","","","","3","P 4/m c c","","","","","","- Au1.15 Cr2 Sn8.85 -","","","","","","Walle, C.; Torgersen, A. N.; Karlsen, O. B.; Kjekshus, A.; Klewe, B.","The ternary system Au-Cr-Sn and the crystal structure of Au1.15Cr2Sn8.85","Journal of Alloys and Compounds","2000","308","","126","133","10.1016/S0925-8388(00)01021-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000609","7.5792","","7.5792","","14.7042","","90","","90","","90","","844.67","","","","","","","","","","","","","6","P 4/m c c","","","","","","- Ca K0.5 Na O20 Si8 Th -","","","","","","Kabalov, Y.; Sokolova, E.","Discovery of new minerals zlatogorite, turkestanite and belovite-(La) by Rietveld refinement from X-ray powder diffraction data","Epdic 5","1998","278","2","785","790","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"7017293","15.368","0.003","15.368","0.003","9.914","0.003","90","","90","","90","","2341.4","1","123.15","","123.15","","","","","","","","","7","P 4/m c c","-P 4 2c","124","H(SmV(TPPS)O)n","H[SmV(TPPS)O]n","","- C44 H26 N4 O13 S4 Sm V -","- C44 H24 N4 O13 S4 Sm V -","- C88 H48 N8 O26 S8 Sm2 V2 -","2","0.125","","Chen, Wen-Tong; Yamada, Yusuke; Liu, Guang-Ning; Kubota, Akira; Ichikawa, Takayuki; Kojima, Yoshitsugu; Guo, Guo-Cong; Fukuzumi, Shunichi","X-Ray crystal structure of [HSm{V(IV)O(TPPS)}](n) and encapsulation of nitrogen molecules in 1-D channels.","Dalton transactions (Cambridge, England : 2003)","2011","40","48","12826","12831","10.1039/c1dt10956a","","","0.71073","MoKα","","0.0675","0.0648","","","0.1677","0.1703","","","","","","1.02","","","","has coordinates","179876","2020-10-21","18:00:00",""
"7017294","15.3904","0.0008","15.3904","0.0008","9.8586","0.0005","90","","90","","90","","2335.2","0.2","123","2","123","2","","","","","","","","7","P 4/m c c","-P 4 2c","124","(HSm(VIVO(TPPS)).2N2)n","[HSm{VIVO(TPPS)}.2N2]n","","- C44 H26 N8 O13 S4 Sm V -","- C44 H24 N8 O13 S4 Sm V -","- C88 H48 N16 O26 S8 Sm2 V2 -","2","0.125","","Chen, Wen-Tong; Yamada, Yusuke; Liu, Guang-Ning; Kubota, Akira; Ichikawa, Takayuki; Kojima, Yoshitsugu; Guo, Guo-Cong; Fukuzumi, Shunichi","X-Ray crystal structure of [HSm{V(IV)O(TPPS)}](n) and encapsulation of nitrogen molecules in 1-D channels.","Dalton transactions (Cambridge, England : 2003)","2011","40","48","12826","12831","10.1039/c1dt10956a","","","0.7107","MoKα","","0.0807","0.0764","","","0.2328","0.2338","","","","","","1.998","","","","has coordinates","179876","2020-10-21","18:00:00",""
"7060172","11.6051","0.0005","11.6051","0.0005","25.651","0.003","90","","90","","90","","3454.6","0.5","173","","173","","","","","","","","","6","P 4/m c c","-P 4 2c","124","","","","- C56 H57 Cl3 Dy4 N16 O21 -","- C56 H56 Cl3 Dy4 N16 O21 -","- C112 H112 Cl6 Dy8 N32 O42 -","2","0.125","","Wu, Jianfeng; Liu, Dan; Yang, Qianqian; Ge, Yan; Tang, Jinkui; Qi, Zhenhui","Magnetic investigation in di- and tetranuclear lanthanide complexes","New Journal of Chemistry","2021","45","4","2200","2207","10.1039/D0NJ04247A","","","1.54178","CuKα","","0.1587","0.1185","","","0.2509","0.2773","","","","","","1.119","","","","has coordinates,has disorder","261738","2021-02-04","23:27:22",""
"7204066","14.226","0.002","14.226","0.002","6.414","0.001","90","","90","","90","","1298.1","0.3","288.2","","288.2","","","","","","","","","7","P 4/m c c","-P 4 2c","124","","","","- C64 H32 As Co0.9 F6 N16 Ni1.1 -","- C32 H16 As0.12 Co0.12 F3.84 N8 Ni0.14 -","- C32 H16 As0.12 Co0.12 F3.84 N8 Ni0.14 -","1","0.0625","","Ding, Yuqin; Simonyan, Mkhital; Yonehara, Yukako; Uruichi, Mikio; Yakushi, Kyuya","Preparation and characterization of phthalocyanine-based organic alloy CoxNi1 − xPc(AsF6)0.5 (0 ≤ x ≤ 1)","Journal of Materials Chemistry","2001","11","5","1469","","10.1039/b100043h","","","0.7107","MoKα","","","0.0701","","","0.0727","","","","","2.138","2.138","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7207458","23.567","0.0006","23.567","0.0006","46.997","0.002","90","","90","","90","","26102.3","1.5","123","0","123","0","","","","","","","","5","P 4/m c c","-P 4 2c","124","","","","- C54 H41 Cu6 N O36 -","- C54 H24 Cu6 N O35.75 -","- C432 H192 Cu48 N8 O286 -","8","0.5","","Li, Chuanqiang; Qiu, Wenge; Shi, Wei; Song, Haibin; Bai, Guangmei; He, Hong; Li, Jian; Zaworotko, Michael J.","A pcu-type metal‒organic framework based on covalently quadruple cross-linked supramolecular building blocks (SBBs): structure and adsorption properties","CrystEngComm","2012","14","6","1929","","10.1039/c2ce06384k","","","0.71073","MoKα","","0.0768","0.055","","","0.1588","0.1686","","","","","","0.537","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7217770","13.852","0.004","13.852","0.004","6.4216","0.0017","90","","90","","90","","1232.2","0.6","173","2","173","2","","","","","","","","4","P 4/m c c","-P 4 2c","124","lithium phthalocyanine","lithium phthalocyanine","","- C32 H16 Li N8 -","- C32 H16 Li N8 -","- C64 H32 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0483","0.0426","","","0.1054","0.1089","","","","","","1.094","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217771","13.843","0.0009","13.843","0.0009","6.4156","0.0006","90","","90","","90","","1229.41","0.16","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.11 Li N8 -","- C32 H16 Cl0.11 Li N8 -","- C64 H32 Cl0.22 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.07","0.0552","","","0.1138","0.1206","","","","","","1.12","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217772","13.829","0.005","13.829","0.005","6.406","0.002","90","","90","","90","","1225.1","0.7","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.2 Li N8 -","- C32 H16 Cl0.2 Li N8 -","- C64 H32 Cl0.4 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0624","0.0502","","","0.1129","0.1195","","","","","","1.082","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217773","13.864","0.006","13.864","0.006","6.414","0.003","90","","90","","90","","1232.8","0.9","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.21 Li N8 -","- C32 H16 Cl0.21 Li N8 -","- C64 H32 Cl0.42 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0866","0.074","","","0.1988","0.2126","","","","","","1.138","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217774","13.841","0.004","13.841","0.004","6.4027","0.0018","90","","90","","90","","1226.6","0.6","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.24 Li N8 -","- C32 H16 Cl0.24 Li N8 -","- C64 H32 Cl0.48 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0567","0.0471","","","0.1081","0.114","","","","","","1.106","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217775","13.843","0.004","13.843","0.004","6.394","0.002","90","","90","","90","","1225.3","0.6","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.38 Li N8 -","- C32 H16 Cl0.38 Li N8 -","- C64 H32 Cl0.76 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0638","0.0553","","","0.1542","0.1611","","","","","","1.138","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7217776","13.8605","0.0007","13.8605","0.0007","6.3917","0.0005","90","","90","","90","","1227.93","0.13","173","2","173","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","lithium phthalocyanine chloride","lithium phthalocyanine chloride","","- C32 H16 Cl0.46 Li N8 -","- C32 H16 Cl0.46 Li N8 -","- C64 H32 Cl0.92 Li2 N16 -","2","0.125","","Miyoshi, Yasuhito; Yoshikawa, Hirofumi; Awaga, Kunio","Crystal-to-crystal transformation in solid-state electrochemical doping of Cl−ions to the nanoporous neutral radical lithium phthalocyanine: revelation of electron‒electron correlations in the 1D half-filled system","CrystEngComm","2014","16","39","9266","","10.1039/C4CE01222D","","","0.7107","MoKα","","0.0588","0.0505","","","0.1419","0.1477","","","","","","1.124","","","","has coordinates","180508","2020-10-21","18:00:00",""
"7711335","15.2686","0.0003","15.2686","0.0003","29.2342","0.0006","90","","90","","90","","6815.4","0.2","250","2","250","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","","","","- C24 H34 Cu N5 O8 -","- C15 H10 Cu N2 O5 -","- C120 H80 Cu8 N16 O40 -","8","0.5","","Ghosh, Dipankar; Damodaran, Krishna K.","Analysing the Role of Anions in the Synthesis of Catalytic Active Urea-based MOF","Dalton Transactions","2022","","","","","10.1039/D2DT02421G","","","1.54178","CuKα","","0.1","0.0767","","","0.2625","0.2821","","","","","","1.099","","","","has coordinates","278198","2022-09-26","22:49:38",""
"7718578","13.876","0.0004","13.876","0.0004","6.4437","0.0004","90","","90","","90","","1240.69","0.09","293","2","293","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","","","","- C32 H16 Br0.75 Li N8 -","- C32 H16 Br0.75 Li N8 -","- C64 H32 Br1.5 Li2 N16 -","2","0.125","","Kaneko, Mayu; Masuda, Masahiro; Teruya, Ryota; Sato, Tetsu; Akutagawa, Tomoyuki; Matsuda, Masaki","Insulator-metal transition induced by band-filling modulation in molecular Mott insulators.","Dalton transactions (Cambridge, England : 2003)","2025","54","20","8331","8335","10.1039/d5dt00525f","","x-ray","0.71073","MoKα","","0.1023","0.0637","","","0.1557","0.1721","","","","","","1.063","","","","has coordinates","300867","2025-07-06","16:22:28",""
"7718579","14.2466","0.0004","14.2466","0.0004","6.4808","0.0004","90","","90","","90","","1315.38","0.1","293","2","293","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","","","","- C36 H20 I0.75 Li N4 -","- C36 H20 I0.75 Li N4 -","- C72 H40 I1.5 Li2 N8 -","2","0.125","","Kaneko, Mayu; Masuda, Masahiro; Teruya, Ryota; Sato, Tetsu; Akutagawa, Tomoyuki; Matsuda, Masaki","Insulator-metal transition induced by band-filling modulation in molecular Mott insulators.","Dalton transactions (Cambridge, England : 2003)","2025","54","20","8331","8335","10.1039/d5dt00525f","","x-ray","0.71073","MoKα","","0.0745","0.0495","","","0.1114","0.1216","","","","","","0.973","","","","has coordinates","300867","2025-07-06","16:22:28",""
"9004862","7.5505","","7.5505","","14.7104","","90","","90","","90","","838.641","","","","","","","","","","","","","13","P 4/m c c","-P 4 2c","124","","","Arapovite","- Ba0.02 Ca1.34 Ce0.02 Dy0.02 K0.52 Li0.59 Na0.68 Nd0.04 O20 Pr0.01 Si8 Sm0.01 Th0.26 -","- Ba0.02 Ca1.34 Ce0.02 Dy0.02 K0.52 Li0.59 Na0.68 Nd0.04 O20 Pr0.01 Si8 Sm0.01 Th0.26 -","- Ba0.04 Ca2.68 Ce0.04 Dy0.04 K1.04 Li1.18 Na1.36 Nd0.08 O40 Pr0.02 Si16 Sm0.02 Th0.52 -","2","0.125","","Uvarova, Y. A.; Sokolova, E. V.; Hawthorne, F. C.; Agakhanov, A. A.; Pautov, L. A.","The crystal structure of arapovite, U4+(Ca,Na)2(K1-x_x)[Si8O20],x~0.5, a new mineral species of the steacyite group from the Dara-i-Pioz moraine, Tien-Shan Mountains, Tajikistan Locality: Dara-i-Pioz moraine, Tien-Shan Mountains, Tajikistan","The Canadian Mineralogist","2004","42","","1005","1011","10.2113/gscanmin.42.4.1005","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50",""
"9009950","7.5792","","7.5792","","14.7042","","90","","90","","90","","844.672","","","","","","","","","","","","Dzhelisu massif, Alayskiy range, Tien Shan, Kyrgyzstan","6","P 4/m c c","-P 4 2c","124","","","Turkestanite","- Ca1.4 K0.53 Na0.5 O20 Si8 Th -","- Ca1.4 K0.53 Na0.5 O20 Si8 Th -","- Ca2.8 K1.06 Na O40 Si16 Th2 -","2","0.125","","Kabalov Yu, K.; Sokolova, E. V.; Pautov, L. A.; Schneider, J.","Crystal structure of a new mineral turkestanite: a calcium analogue of steacyite Locality: Dzhelisu massif, Alayskiy range, Tien Shan, Kyrgyzstan Note: calculated Biso's disagree with reported values Note: z(O3) adjusted to match reported bond lengths","Crystallography Reports","1998","43","","584","588","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:08",""
"9013306","13.1304","","13.1304","","5.4189","","90","","90","","90","","934.258","","","","","","","","","","","","Poudrette quarry, Mont Saint-Hilaire, Quebec, Canada","6","P 4/m c c","-P 4 2c","124","","","Niveolanite","- C H2.92 Be Ca0.09 Na0.9 O5 -","- C H2.92 Be Ca0.09 Na0.9 O5 -","- C8 H23.36 Be8 Ca0.72 Na7.2 O40 -","8","0.5","","Pekov, I. V.; Zubkova, N. V.; Chukanov, N. V.; Agakhanov, A. A.; Belakovskiy, D. I.; Horvath, L.; Filinchuk, Y. E.; Gobechiya, E. R.; Pushcharovsky, D. Y.; Rabadanov, M. K.","Niveolanite, the first natural beryllium carbonate, a new mineral species from Mont Saint-Hilaire, Quebec, Canada Locality: Poudrette quarry, Mont Saint-Hilaire, Quebec, Canada","The Canadian Mineralogist","2008","46","","1343","1354","10.3749/canmin.46.5.1343","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:50",""
"9014130","7.5505","","7.5505","","14.7104","","90","","90","","90","","838.641","","","","","","","","","","","","Dara-i-Pioz moraine, Tien-Shan Mountains, Tajikistan","13","P 4/m c c","-P 4 2c","124","","","Arapovite","- Ba0.02 Ca1.34 Ce0.02 Dy0.02 K0.52 Na0.68 Nd0.04 O20 Pr0.01 Si8 Sm0.01 Th0.26 U0.59 -","- Ba0.02 Ca1.34 Ce0.02 Dy0.02 K0.52 Na0.68 Nd0.04 O20 Pr0.01 Si8 Sm0.01 Th0.26 U0.59 -","- Ba0.04 Ca2.68 Ce0.04 Dy0.04 K1.04 Na1.36 Nd0.08 O40 Pr0.02 Si16 Sm0.02 Th0.52 U1.18 -","2","0.125","","Uvarova, Y. A.; Sokolova, E. V.; Hawthorne, F. C.; Agakhanov, A. A.; Pautov, L. A.","The crystal structure of arapovite, U4+(Ca,Na)2(K1-x_x)[Si8O20],x~0.5, a new mineral species of the steacyite group from the Dara-i-Pioz moraine, Tien-Shan Mountains, Tajikistan","The Canadian Mineralogist","2004","42","","1005","1011","10.2113/gscanmin.42.4.1005","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:10",""
"9015318","7.58","","7.58","","14.77","","90","","90","","90","","848.631","","","","","","","","","","","","Mont St-Hilaire, Quebec, Canada","10","P 4/m c c","-P 4 2c","124","","","Steacyite","- Ca0.74 Ce0.03 K0.6 Mg0.04 Mn0.2 Na0.9 O20 Pb0.01 Si8 Th0.88 -","- Ca0.74 Ce0.03 K0.6 Mg0.04 Mn0.2 Na0.9 O20 Pb0.01 Si8 Th0.88 -","- Ca1.48 Ce0.06 K1.2 Mg0.08 Mn0.4 Na1.8 O40 Pb0.02 Si16 Th1.76 -","2","0.125","","Prichard, P.; Perrault, G.","Structure cristalline de l'ekanite de St-Hilaire, P.Q.","Acta Crystallographica, Section B","1972","28","","1994","1999","10.1107/S0567740872005412","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:46",""