# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-18T00:25:08+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'I a -3' 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
"1000297","16.135","0.002","16.135","0.002","16.135","0.002","90","","90","","90","","4200.6","","","","","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","Tetrasodium barium tricopper fluoride","","- Ba Cu3 F12 Na4 -","- Ba Cu3 F12 Na4 -","- Ba16 Cu48 F192 Na64 -","16","0.333333","","de Kozak, A; Samouel, M; Renaudin, J; Ferey, G","Complex copper II fluorides: XII. Crystal structure and ferromagnetic properties of Na~4~BaCu~3~F~12~","European Journal of Solid State Inorganic Chemistry","1990","27","","771","782","","","","","","","0.058","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001048","10.453","0.002","10.453","0.002","10.453","0.002","90","","90","","90","","1142.1","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Cadmium lead(IV) oxide - I","","- Cd O3 Pb -","- Cd O3 Pb -","- Cd16 O48 Pb16 -","16","0.333333","","Levy-Clement, C; Michel, A","Sur un oxyde double Cd Pb O~3~ de type c des oxydes de lanthanides","Annales de Chimie (Paris) (Vol=Year)","1972","1972","","275","281","","","","","","","0.077","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001551","9.4312","0.0005","9.4312","0.0005","9.4312","0.0005","90","","90","","90","","838.9","","","","","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","Copper titanium ferrate *","","- Cu0.6667 Fe0.6667 O3 Ti0.6667 -","- Cu0.6666 Fe0.6666 O3 Ti0.6666 -","- Cu10.6656 Fe10.6656 O48 Ti10.6656 -","16","0.333333","","Mouron, P; Odier, P; Choisnet, J","Titanates de cuivre substitues a structure bixbyite: Les composes Cu~1- x~ Ti~1-x~ Fe~2x~ O~3~ (0.15<x<0.33)","Journal of Solid State Chemistry","1985","60","","87","94","10.1016/0022-4596(85)90167-7","","","","","","0.071","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001552","9.4312","0.0005","9.4312","0.0005","9.4312","0.0005","90","","90","","90","","838.9","","","","","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","Copper titanium iron oxide (0.66/0.66/0.66/3)","","- Cu0.66 Fe0.66 O3 Ti0.66 -","- Cu0.66 Fe0.66 O3 Ti0.66 -","- Cu10.56 Fe10.56 O48 Ti10.56 -","16","0.333333","","Mouron, P; Odier, P; Choisnet, J","Titanates des cuivre substitues a structure bixbyite: Les composes Cu~1- x~ Ti1~-x~ Fe~2x~ O~3~ (0.15 <= X <= 0.33)","Journal of Solid State Chemistry","1985","60","","87","94","10.1016/0022-4596(85)90167-7","","","","","","0.071","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001689","9.5219","0.0003","9.5219","0.0003","9.5219","0.0003","90","","90","","90","","863.3","","","","","","","","","","","","","5","I a -3","-I 2b 2c 3","206","","Copper titanium iron(III) antimony oxide (3/0.96/0.98/1/9.12)","","- Cu3 Fe0.98 O9.12 Sb Ti0.96 -","- Cu3 Fe0.98 O9.12 Sb Ti0.96 -","- Cu3 Fe0.98 O9.12 Sb Ti0.96 -","1","0.0208333","","Mouron, P; Choisnet, J","A new ordered solid solution with a bixbyite structure: The compounds Cu2+x Ti2-x Fe2-x Sbx O9 (0< x < 1.4)","Materials Research Bulletin","1987","22","","1355","1362","10.1016/0025-5408(87)90300-X","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008449","14.59","0.01","14.59","0.01","14.59","0.01","90","","90","","90","","3105.7","","","","","","","","","","","","","5","I a -3","-I 2b 2c 3","206","","Tris(guanidinium) diberyllium fluoride","","- C3 H18 Be2 F7 N9 -","- C3 H18 Be2 F7 N9 -","- C24 H144 Be16 F56 N72 -","8","0.166667","","Aleonard, S; Gorius, M","Structure cristalline du pyrofluoroberyllate de guanidinium (C N~3~ H~6~)~3~ Be~2~ F~7~","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-)","1989","309","","683","687","","","","","","","0.051","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008928","9.79","","9.79","","9.79","","90","","90","","90","","938.3","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Scandium oxide","","- O3 Sc2 -","- O3 Sc2 -","- O48 Sc32 -","16","0.333333","","Milligan, W O; Vernon, L W; Levy, H A; Peterson, S W","Neutron diffraction studies on scandium orthovanadate and scandium oxide","Journal of Physical Chemistry","1953","57","","535","537","10.1021/j150506a012","","","","","","","","","","","","","","","","","","","","","has coordinates","202026","2020-10-21","18:00:00",""
"1009013","10.6056","0.0003","10.6056","0.0003","10.6056","0.0003","90","","90","","90","","1192.9","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Yttrium oxide","","- O3 Y2 -","- O3 Y2 -","- O48 Y32 -","16","0.333333","","Baldinozzi, G.; Berar, J.-F.; Calvarin, G.","Rietveld refinement of two-phase Zr-doped Y~2~O~3~","Materials Science Forum","1998","","","680","685","10.4028/www.scientific.net/MSF.278-281.680","","","","","","0.011","","","","","","","","","","","","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1009014","10.5961","0.0003","10.5961","0.0003","10.5961","0.0003","90","","90","","90","","1189.7","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Yttrium oxide","","- O3 Y2 -","- O3 Y2 -","- O48 Y32 -","16","0.333333","","Baldinozzi, G.; Berar, J.-F.; Calvarin, G.","Rietveld refinement of two-phase Zr-doped Y~2~O~3~","Materials Science Forum","1998","","","680","685","10.4028/www.scientific.net/MSF.278-281.680","","","","","","0.011","","","","","","","","","","","","","","","has coordinates","202026","2020-10-21","18:00:00",""
"1009015","10.5957","0.0003","10.5957","0.0003","10.5957","0.0003","90","","90","","90","","1189.6","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Yttrium oxide","","- O3 Y2 -","- O3 Y2 -","- O48 Y32 -","16","0.333333","","Baldinozzi, G.; Berar, J.-F.; Calvarin, G.","Rietveld refinement of two-phase Zr-doped Y~2~O~3~","Materials Science Forum","1998","","","680","685","10.4028/www.scientific.net/MSF.278-281.680","","","","","","0.024","","","","","","","","","","","","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1009016","10.5392","0.0011","10.5392","0.0011","10.5392","0.0011","90","","90","","90","","1170.6","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Yttrium zirconium oxide (1/1/3)","","- O3 Y Zr -","- O3 Y1.0005 Zr0.9995 -","- O48 Y16.008 Zr15.992 -","16","0.333333","","Baldinozzi, G.; Berar, J.-F.; Calvarin, G.","Rietveld refinement of two-phase Zr-doped Y~2~O~3~","Materials Science Forum","1998","","","680","685","10.4028/www.scientific.net/MSF.278-281.680","","","","","","0.024","","","","","","","","","","","","","","","has coordinates","282478","2023-04-06","12:32:03",""
"1009017","10.5818","0.0007","10.5818","0.0007","10.5818","0.0007","90","","90","","90","","1184.9","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Yttrium oxide","","- O3 Y2 -","- O3 Y2 -","- O48 Y32 -","16","0.333333","","Baldinozzi, G.; Berar, J.-F.; Calvarin, G.","Rietveld refinement of two-phase Zr-doped Y~2~O~3~","Materials Science Forum","1998","","","680","685","10.4028/www.scientific.net/MSF.278-281.680","","","","","","0.024","","","","","","","","","","","","","","","has coordinates","282072","2023-03-26","19:37:37",""
"1009018","10.515","0.002","10.515","0.002","10.515","0.002","90","","90","","90","","1162.6","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Yttrium zirconium oxide (1/1/3)","","- O3 Y Zr -","- O3 Y1.0005 Zr0.9995 -","- O48 Y16.008 Zr15.992 -","16","0.333333","","Baldinozzi, G.; Berar, J.-F.; Calvarin, G.","Rietveld refinement of two-phase Zr-doped Y~2~O~3~","Materials Science Forum","1998","","","680","685","10.4028/www.scientific.net/MSF.278-281.680","","","","","","0.024","","","","","","","","","","","","","","","has coordinates","282478","2023-04-06","12:32:03",""
"1011266","9.365","0.02","9.365","0.02","9.365","0.02","90","","90","","90","","821.3","","","","","","","","","","","","from Simpson, Utah","3","I a -3","-I 2b 2c 3","206","","Iron manganese(IV) oxide","Bixbyite","- Fe Mn O3 -","- Fe Mn O3 -","- Fe16 Mn16 O48 -","16","0.333333","","Pauling, L; Shappell, M D","The Crystal Structure of Bixbyite and the C-Modification of the Sesquioxides","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1930","75","","128","142","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011347","12.33","0.07","12.33","","12.33","","90","","90","","90","","1874.5","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Magnesium arsenide","","- As2 Mg3 -","- As2 Mg3 -","- As32 Mg48 -","16","0.333333","","Zintl, E; Husemann, E","Bindungsart und Gitterbau binaerer Magnesiumverbindungen. 12. Mitteilung ueber Metalle und Legierungen","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1933","21","","138","155","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011360","12.01","0.01","12.01","0.01","12.01","0.01","90","","90","","90","","1732.3","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Magnesium phosphide","","- Mg3 P2 -","- Mg3 P2 -","- Mg48 P32 -","16","0.333333","","Stackelberg, M von; Paulus, R","Untersuchungen ueber die Kristallstruktur der Nitride und Phosphide zweiwertiger Metalle.","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1933","22","","305","322","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1509330","9.7985","","9.7985","","9.7985","","90","","90","","90","","940.76","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Ag (Sb F6)","","- Ag F6 Sb -","- Ag F6 Sb -","- Ag8 F48 Sb8 -","8","0.166667","","Tamada, O.; Matsumoto, K.; Hagiwara, R.; Ito, Y.","Crystal structures of Ag A F6 (A = P, As, Sb, Nb, Ta) at ambient temperatures","Journal of Fluorine Chemistry","2001","110","","117","122","10.1016/S0022-1139(01)00418-3","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509331","9.85","","9.85","","9.85","","90","","90","","90","","955.672","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Ag Sb F6","","- Ag F6 Sb -","- Ag F6 Sb -","- Ag8 F48 Sb8 -","8","0.166667","","Bode, H.","Die Kristallstruktur des Silberhexafluoroantimonats(V)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1951","267","","62","64","10.1002/zaac.19522670107","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1513300","10.604","0.000004","10.604","0.000004","10.604","0.000004","90","","90","","90","","1192.36","0.0008","295","","295","","","","","","","","","2","I a -3","-I 2b 2c 3","206","yttria oxide","yttria oxide","","- O3 Y2 -","- O3 Y2 -","- O48 Y32 -","16","0.333333","ML5212","Ferreira, Fabio Furlan; Granado, Eduardo; Carvalho Jr, Wilson; Kycia, Stefan W.; Bruno, Daniele; Droppa Jr, Roosevelt","X-ray powder diffraction beamline at D10B of LNLS: application to the Ba2FeReO6double perovskite","Journal of Synchrotron Radiation","2005","13","1","46","53","10.1107/S0909049505039208","","","1.37791","synchrotron","","","","","","","","","","0.83","","","","","","","has coordinates","190338","2020-10-21","18:00:00",""
"1514106","9.42","","9.42","","9.42","","90","","90","","90","","835.897","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Manganese(III) Oxide","Bixbyite","- Mn2 O3 -","- Mn2 O3 -","- Mn32 O48 -","16","0.333333","","Fert, A.","Structure de quelques oxydes de terres rares","Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)","1962","85","","267","270","","","","","","","0.035","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514107","9.41","0.01","9.41","","9.41","","90","","90","","90","","833.2","0.9","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Manganese(III) Oxide - Beta","Bixbyite C","- Mn2 O3 -","- Mn2 O3 -","- Mn32 O48 -","16","0.333333","","Aminoff, G.","Lattice dimensions and space group of braunite","Kunglia Svenska Vetenskaps Akademiens Handlingar","1931","9","","14","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514113","9.43","","9.43","","9.43","","90","","90","","90","","838.562","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Manganese(III) Oxide - Alpha","Bixbyite C","- Mn2 O3 -","- Mn2 O3 -","- Mn32 O48 -","16","0.333333","","Hase, W.","Neutronographische Bestimmung der Kristallstrukturparameter von Dy2 O3, Tm2 O3 und alpha-Mn2 O3","Physica Status Solidi","1963","3","","446","449","","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514119","9.408","","9.408","","9.408","","90","","90","","90","","832.706","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Manganese(III) Oxide","Bixbyite","- Mn2 O3 -","- Mn2 O3 -","- Mn32 O48 -","16","0.333333","","Morozov, I. S.; Kuznetsov, V. G.","The crystal structure of Mn2 O3","Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya","1949","1949","","343","353","","","","","","","","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514230","9.41","0.01","9.41","0.01","9.41","0.01","90","","90","","90","","833.2","1.5","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Manganese Oxide (2/3)","Bixbyite","- Mn2 O3 -","- Mn2 O3 -","- Mn32 O48 -","16","0.333333","","Zachariasen, W. H.","Untersuchungen über die Kristallstrukturen von Sesquioxiden und Verbindungen ABO~3~","Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk-Naturvidenskapelig Klasse","1928","","4","1","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514238","9.4173","0.0011","9.4173","0.0011","9.4173","0.0011","90","","90","","90","","835.18","0.17","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Dimanganese(III) Oxide","","- Mn2 O3 -","- Mn2 O3 -","- Mn32 O48 -","16","0.333333","","Wang, Xiaofeng; Li, Guanghua; Chu, Qingxin; Liu, Xiaoyang; Feng, Shouhua","Synthesis, structure characterization and magnetic properties of single crystal of dimanganese trioxide","Gaodeng Xuexiao Huaxue Xuebao","2007","28","4","821","823","","","","","","","0.0659","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1515048","48.8463","0.0007","48.8463","0.0007","48.8463","0.0007","90","","90","","90","","116545","3","123","2","123","2","","","","","","","","7","I a -3","-I 2b 2c 3","206","","","","- C348 H354 Cl6 Co24 N6 O72 S24 -","- C336 H312 Cl6 Co24 O72 S24 -","- C2688 H2496 Cl48 Co192 O576 S192 -","8","0.166667","","Xiong, Kecai; Jiang, Feilong; Gai, Yanli; Yuan, Daqiang; Chen, Lian; Wu, Mingyan; Su, Kongzhao; Hong, Maochun","Truncated octahedral coordination cage incorporating six tetranuclear-metal building blocks and twelve linear edges","Chemical Science","2012","3","7","2321","","10.1039/c2sc20264f","","","0.71073","MoKα","","0.1172","0.092","","","0.2329","0.2494","","","","","","1.076","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1515256","43.03","0.002","43.03","0.002","43.03","0.002","90","","90","","90","","79674","6","100","2","100","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","MMPF-4","","","- C156 H60 N12 O50 Zn19 -","- C156 H60 N12 O50 Zn19 -","- C1248 H480 N96 O400 Zn152 -","8","0.166667","","Wang, Xi-Sen; Chrzanowski, Matthew; Gao, Wen-Yang; Wojtas, Lukasz; Chen, Yu-Sheng; Zaworotko, Michael J.; Ma, Shengqian","Vertex-directed self-assembly of a high symmetry supermolecular building block using a custom-designed porphyrin","Chemical Science","2012","3","9","2823","","10.1039/c2sc20330h","","","0.41328","synchrotron","","0.1429","0.1163","","","0.2742","0.2905","","","","","","1.088","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516913","25.8063","0.001","25.8063","0.001","25.8063","0.001","90","","90","","90","","17186.1","1.2","273","2","273","2","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- C30 H30 Mo24 N6 O82.96 P2 -","- C30 H30 Mo24 N6 O82.96 P2 -","- C240 H240 Mo192 N48 O663.68 P16 -","8","0.166667","","Mingli Qi; Kai Yu; Zhanhua Su; Chunxiao Wang; Chunmei Wang; Baibin Zhou; Chuncheng Zhu","Assembly of four new supramolecular compounds based on Keggin phosphomolybdate and different organocations","Inorganica Chimica Acta","2013","400","","59","66","","","","0.71073","MoKα","","0.0626","0.0553","","","0.1244","0.1274","","","","","","1.079","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1520859","10.5989","","10.5989","","10.5989","","90","","90","","90","","1190.65","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm0.1 Y1.9) O3","","- O3 Tm0.1 Y1.9 -","- O3 Tm0.09995 Y1.90005 -","- O48 Tm1.5992 Y30.4008 -","16","0.333333","","Blanusa, J.; Mitric, M.; Slaski, M.; Rodic, D.; Szytula, A.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140419","2020-10-21","18:00:00",""
"1520861","10.5804","","10.5804","","10.5804","","90","","90","","90","","1184.42","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm0.4 Y1.6) O3","","- O3 Tm0.4 Y1.6 -","- O3 Tm0.40005 Y1.59995 -","- O48 Tm6.4008 Y25.5992 -","16","0.333333","","Blanusa, J.; Mitric, M.; Szytula, A.; Rodic, D.; Slaski, M.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140421","2020-10-21","18:00:00",""
"1520863","10.5717","","10.5717","","10.5717","","90","","90","","90","","1181.5","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm0.6 Y1.4) O3","","- O3 Tm0.6 Y1.4 -","- O3 Tm0.59995 Y1.40005 -","- O48 Tm9.5992 Y22.4008 -","16","0.333333","","Blanusa, J.; Slaski, M.; Rodic, D.; Mitric, M.; Szytula, A.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140423","2020-10-21","18:00:00",""
"1520865","10.5466","","10.5466","","10.5466","","90","","90","","90","","1173.11","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm Y) O3","","- O3 Tm Y -","- O3 Tm0.99995 Y1.00005 -","- O48 Tm15.9992 Y16.0008 -","16","0.333333","","Blanusa, J.; Rodic, D.; Mitric, M.; Szytula, A.; Slaski, M.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520866","10.5262","","10.5262","","10.5262","","90","","90","","90","","1166.31","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm1.4 Y0.6) O3","","- O3 Tm1.4 Y0.6 -","- O3 Tm1.39995 Y0.60005 -","- O48 Tm22.3992 Y9.6008 -","16","0.333333","","Blanusa, J.; Rodic, D.; Mitric, M.; Szytula, A.; Slaski, M.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140427","2020-10-21","18:00:00",""
"1520869","10.5022","","10.5022","","10.5022","","90","","90","","90","","1158.35","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Tm1.8 Y0.2) O3","","- O3 Tm1.8 Y0.2 -","- O3 Tm1.7995 Y0.2005 -","- O48 Tm28.792 Y3.208 -","16","0.333333","","Blanusa, J.; Mitric, M.; Rodic, D.; Szytula, A.; Slaski, M.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140430","2020-10-21","18:00:00",""
"1520870","10.4908","","10.4908","","10.4908","","90","","90","","90","","1154.58","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Tm2 O3","","- O3 Tm2 -","- O3 Tm2 -","- O48 Tm32 -","16","0.333333","","Blanusa, J.; Mitric, M.; Rodic, D.; Szytula, A.; Slaski, M.","An X-ray diffraction and magnetic susceptibility study of Tmx Y2-x O3","Journal of Magnetism and Magnetic Materials","2000","213","","75","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","140431","2020-10-21","18:00:00",""
"1520984","10.0692","","10.0692","","10.0692","","90","","90","","90","","1020.9","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Hf2 O N2","","- Hf2 N2 O -","- Hf2 N2.0001 O0.9999 -","- Hf32 N32.0016 O15.9984 -","16","0.333333","","Clarke, S.J.; Rosseinsky, M.J.; Michie, C.W.","Structure of Zr2 O N2 by neutron powder diffraction: the absence of nitride-oxide ordering","Journal of Solid State Chemistry","1999","146","","399","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521455","11.1108","","11.1108","","11.1108","","90","","90","","90","","1371.63","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Ce O1.695 -","- Ce O1.695 -","- Ce32 O54.24 -","32","0.666667","","Kuemmerle, E.A.; Heger, G.","The structures of C-(Ce2 O3+d), Ce7 O12 and Ce11 O20","Journal of Solid State Chemistry","1999","147","","485","500","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521769","17.328","","17.328","","17.328","","90","","90","","90","","5202.9","","","","","","","","","","","","","6","I a -3","-I 2b 2c 3","206","","K4 (S6.508 Te1.492 (Re (C N))6)","","- C6 K4 N6 Re6 S6.508 Te1.492 -","- C6 K4 N6 Re6 S6.508 Te1.492 -","- C48 K32 N48 Re48 S52.064 Te11.936 -","8","0.166667","","Podberezskaya, N.V.; Virovets, A.V.; Kozeeva, L.P.; Mironov, Yu.V.; Naumov, N.G.; Fedorov, V.E.","Statistical disordering of chalcogen atoms in the cluster fragments of K4 (Re6 (mue3-S)8-y (mue3-Te)y (C N)6)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1999","40","","530","535","","","","","","","","","","","","","","","","","","","","","","has coordinates","141983","2020-10-21","18:00:00",""
"1521770","17.278","","17.278","","17.278","","90","","90","","90","","5157.99","","","","","","","","","","","","","6","I a -3","-I 2b 2c 3","206","","K4 (S6.874 Te1.126 (Re (C N))6)","","- C6 K4 N6 Re6 S6.874 Te1.126 -","- C6 K4 N6 Re6 S6.874 Te1.126 -","- C48 K32 N48 Re48 S54.992 Te9.008 -","8","0.166667","","Podberezskaya, N.V.; Mironov, Yu.V.; Virovets, A.V.; Fedorov, V.E.; Kozeeva, L.P.; Naumov, N.G.","Statistical disordering of chalcogen atoms in the cluster fragments of K4 (Re6 (mue3-S)8-y (mue3-Te)y (C N)6)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1999","40","","530","535","","","","","","","","","","","","","","","","","","","","","","has coordinates","141984","2020-10-21","18:00:00",""
"1524892","10.0784","","10.0784","","10.0784","","90","","90","","90","","1023.71","","","","","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","(Zr1.613 Sc0.387) O1.387 N1.613","","- N1.614 O1.386 Sc0.159 Zr0.6745 -","- N1.614 O1.386 Sc0.159 Zr0.6745 -","- N25.824 O22.176 Sc2.544 Zr10.792 -","16","0.333333","","Martinez Meta, N.J.; Schweda, E.; Chasse, T.; Haug, A.; Boysen, H.; Hoelzel, M.","Zr50 Sc12 O43 N50 and Zr3 Sc4 N8 - synthesis, neutron powder diffraction an Raman spectroscopy","Zeitschrift fuer Anorganische und Allgemeine Chemie","2007","633","","790","794","","","","","","","","","","","","","","","","","","","","","","has coordinates","145746","2020-10-21","18:00:00",""
"1531889","13.677","","13.677","","13.677","","90","","90","","90","","2558.42","","","","","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","(Al (H2 O)6) (N O3)3","","- Al H12 N3 O15 -","- Al H12 N3 O15 -","- Al8 H96 N24 O120 -","8","0.166667","","Morozov, I.V.; Marsova, M.V.; Troyanov, S.I.","Synthesis and crystal structure of two modifications of aluminium nitrate hexahydrate Al (N O3)3 * 6(H2 O)","Zhurnal Neorganicheskoi Khimii","2002","47","","1055","1060","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532734","10.045","","10.045","","10.045","","90","","90","","90","","1013.56","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Li3 (Sc N2)","","- Li3 N2 Sc -","- Li3 N2 Sc -","- Li48 N32 Sc16 -","16","0.333333","","Niewa, R.; Leoni, S.; Zherebtsov, D.A.","Li3 (Sc N2): the first nitridoscandate(III) - tetrahedral Sc coordination and unusual M X2 framework","Chemistry - A European Journal","2003","9","","4255","4259","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534460","10.4579","","10.4579","","10.4579","","90","","90","","90","","1143.76","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Yb2 O3","","- O3 Yb2 -","- O3 Yb2 -","- O48 Yb32 -","16","0.333333","","Saiki, A.; Ishizawa, N.; Mizutani, N.; Kato, M.","Structural change of C-rare Earth sesquioxides Yb~2~O~3~ and Er~2~O~3~ as a function of temperature","Journal of the Ceramic Association, Japan","1985","93","1082","649","654","10.2109/jcersj1950.93.1082_649","","","","","","","","","","","","","","","","","","","","","has coordinates","175177","2020-10-21","18:00:00",""
"1534469","10.566","","10.566","","10.566","","90","","90","","90","","1179.59","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Er2 O3 -","- Er2 O3 -","- Er32 O48 -","16","0.333333","","Saiki, A.; Ishizawa, N.; Mizutani, N.; Kato, M.","Structural change of C-rare Earth sesquioxides Yb~2~O~3~ and Er~2~O~3~ as a function of temperature","Journal of the Ceramic Association, Japan","1985","93","1082","649","654","10.2109/jcersj1950.93.1082_649","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1534952","10.536","","10.536","","10.536","","90","","90","","90","","1169.57","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Er2 O3 -","- Er2 O3 -","- Er32 O48 -","16","0.333333","","Malinovskii, Yu.A.; Bondareva, O.S.","Refined crystal structure of Er2 O3","Kristallografiya","1991","36","","1558","1560","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1535188","10.5363","","10.5363","","10.5363","","90","","90","","90","","1169.67","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Tl2 O3","","- O3 Tl2 -","- O3 Tl2 -","- O48 Tl32 -","16","0.333333","","Berastegui, P.; Hull, S.; Eriksson, S.; Eriksen, J.; Garcia Garcia, F.J.","Synthesis and crystal structure of the alkaline-earth thallates Mn(n) Tl2 O(3+n) (M = Ca, Sr)","Solid State Sciences","2004","6","","433","441","","","","","","","","","","","","","","","","","","","","","","has coordinates","162417","2020-10-21","18:00:00",""
"1536366","13.3808","","13.3808","","13.3808","","90","","90","","90","","2395.78","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- Hg3 O6 Te -","- Hg3 O6 Te -","- Hg48 O96 Te16 -","16","0.333333","","Weil, M.","Preparation, Thermal Behaviour and Crystal Structure of the Basic Mercury(II) Tetraoxotellurate(VI), Hg2TeO5, and Redetermination of the Crystal Structure of Mercury(II) Orthotellurate(VI), Hg3TeO6","Zeitschrift fuer Anorganische und Allgemeine Chemie","2003","629","","653","657","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1537163","12.489","","12.489","","12.489","","90","","90","","90","","1947.97","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Tm2 S3","","- S3 Tm2 -","- S3 Tm2 -","- S48 Tm32 -","16","0.333333","","Kuz'micheva, G.M.; Smarina, E.I.; Khlyustova, S.Yu.; Chernyshev, V.V.","Crystal structure of theta - Tm2S3","Zhurnal Neorganicheskoi Khimii","1990","35","","869","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","165186","2020-10-21","18:00:00",""
"1537393","10.34","","10.34","","10.34","","90","","90","","90","","1105.51","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","K (Bi F6)","","- Bi F6 K -","- Bi F6 K -","- Bi8 F48 K8 -","8","0.166667","","Hebecker, C.","Ueber Kaliumhexafluorobismutat(V)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1971","384","","12","18","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537439","9.537","","9.537","","9.537","","90","","90","","90","","867.432","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Cu3 Te O6","","- Cu3 O6 Te -","- Cu3 O6 Te -","- Cu24 O48 Te8 -","8","0.166667","","Hostachy, A.; Coing-Boyat, J.","Structure cristalline de Cu3 Te O6","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie B","1968","267","","1435","1438","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537475","9.48","","9.48","","9.48","","90","","90","","90","","851.971","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Li3 Al N2","","- Al Li3 N2 -","- Al Li3 N2 -","- Al16 Li48 N32 -","16","0.333333","","Juza, R.; Hund, F.","Die ternaeren Nitride Li3 Al N2 und Li3 Ga N2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1948","257","","13","25","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537476","9.594","","9.594","","9.594","","90","","90","","90","","883.078","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Li3 Ga N2","","- Ga Li3 N2 -","- Ga Li3 N2 -","- Ga16 Li48 N32 -","16","0.333333","","Juza, R.; Hund, F.","Die ternaeren Nitride Li3 Al N2 und Li3 Ga N2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1948","257","","13","25","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537477","9.436","","9.436","","9.436","","90","","90","","90","","840.163","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Li53.33 Si10.67 N32","","- Li53.33 N32 Si10.67 -","- Li53.3328 N32 Si10.6672 -","- Li53.3328 N32 Si10.6672 -","1","0.0208333","","Juza, R.; Weber, H.H.; Meyer-Simon, E.","Ueber ternaere Nitride und Oxonitride von Elementen der 4. Gruppe","Zeitschrift fuer Anorganische und Allgemeine Chemie","1953","273","","48","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","165677","2020-10-21","18:00:00",""
"1537478","9.7","","9.7","","9.7","","90","","90","","90","","912.673","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Li53.33 Ti10.67 N32","","- Li53.33 N32 Ti10.67 -","- Li53.3328 N32 Ti10.6672 -","- Li53.3328 N32 Ti10.6672 -","1","0.0208333","","Juza, R.; Weber, H.H.; Meyer-Simon, E.","Ueber ternaere Nitride und Oxonitride von Elementen der 4. Gruppe","Zeitschrift fuer Anorganische und Allgemeine Chemie","1953","273","","48","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","165678","2020-10-21","18:00:00",""
"1537479","9.614","","9.614","","9.614","","90","","90","","90","","888.612","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Li53.33 Ge10.67 N32","","- Ge10.67 Li53.33 N32 -","- Ge10.6672 Li53.3328 N32 -","- Ge10.6672 Li53.3328 N32 -","1","0.0208333","","Juza, R.; Weber, H.H.; Meyer-Simon, E.","Ueber ternaere Nitride und Oxonitride von Elementen der 4. Gruppe","Zeitschrift fuer Anorganische und Allgemeine Chemie","1953","273","","48","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","165679","2020-10-21","18:00:00",""
"1537836","10.915","","10.915","","10.915","","90","","90","","90","","1300.38","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Sm2 O3","","- O3 Sm2 -","- O3 Sm2 -","- O48 Sm32 -","16","0.333333","","Bommer, H.","Die Gitterkonstanten der C-Formen der Oxyde der seltenen Erdmetalle","Zeitschrift fuer Anorganische und Allgemeine Chemie","1939","241","","273","273","","","","","","","","","","","","","","","","","","","","","","has coordinates","166188","2020-10-21","18:00:00",""
"1537837","10.71","","10.71","","10.71","","90","","90","","90","","1228.48","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Tb2 O3","","- O3 Tb2 -","- O3 Tb2 -","- O48 Tb32 -","16","0.333333","","Bommer, H.","Die Gitterkonstanten der C-Formen der Oxyde der seltenen Erdmetalle","Zeitschrift fuer Anorganische und Allgemeine Chemie","1939","241","","273","273","","","","","","","","","","","","","","","","","","","","","","has coordinates","166191","2020-10-21","18:00:00",""
"1537838","10.477","","10.477","","10.477","","90","","90","","90","","1150.03","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Tm2 O3","","- O3 Tm2 -","- O3 Tm2 -","- O48 Tm32 -","16","0.333333","","Bommer, H.","Die Gitterkonstanten der C-Formen der Oxyde der seltenen Erdmetalle","Zeitschrift fuer Anorganische und Allgemeine Chemie","1939","241","","273","273","","","","","","","","","","","","","","","","","","","","","","has coordinates","166194","2020-10-21","18:00:00",""
"1537839","10.429","","10.429","","10.429","","90","","90","","90","","1134.3","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Yb2 O3","","- O3 Yb2 -","- O3 Yb2 -","- O48 Yb32 -","16","0.333333","","Bommer, H.","Die Gitterkonstanten der C-Formen der Oxyde der seltenen Erdmetalle","Zeitschrift fuer Anorganische und Allgemeine Chemie","1939","241","","273","273","","","","","","","","","","","","","","","","","","","","","","has coordinates","166197","2020-10-21","18:00:00",""
"1537840","10.6","","10.6","","10.6","","90","","90","","90","","1191.02","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Ho2 O3 -","- Ho2 O3 -","- Ho32 O48 -","16","0.333333","","Bommer, H.","Die Gitterkonstanten der C-Formen der Oxyde der seltenen Erdmetalle","Zeitschrift fuer Anorganische und Allgemeine Chemie","1939","241","","273","273","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1537842","11.42","","11.42","","11.42","","90","","90","","90","","1489.35","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- La2 O3 -","- La2 O3 -","- La32 O48 -","16","0.333333","","Bommer, H.","Die Gitterkonstanten der C-Formen der Oxyde der seltenen Erdmetalle","Zeitschrift fuer Anorganische und Allgemeine Chemie","1939","241","","273","273","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1537844","10.396","","10.396","","10.396","","90","","90","","90","","1123.57","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Lu2 O3 -","- Lu2 O3 -","- Lu32 O48 -","16","0.333333","","Bommer, H.","Die Gitterkonstanten der C-Formen der Oxyde der seltenen Erdmetalle","Zeitschrift fuer Anorganische und Allgemeine Chemie","1939","241","","273","273","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1537846","11.072","","11.072","","11.072","","90","","90","","90","","1357.31","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Nd2 O3 -","- Nd2 O3 -","- Nd32 O48 -","16","0.333333","","Bommer, H.","Die Gitterkonstanten der C-Formen der Oxyde der seltenen Erdmetalle","Zeitschrift fuer Anorganische und Allgemeine Chemie","1939","241","","273","273","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1537882","10.601","","10.601","","10.601","","90","","90","","90","","1191.35","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Y2 O3","","- O3 Y2 -","- O3 Y2 -","- O48 Y32 -","16","0.333333","","Brauer, I.G.; Gradinger, H.","Ueber heterotype Mischphasen bei Seltenerdoxyden. I","Zeitschrift fuer Anorganische und Allgemeine Chemie","1954","276","","209","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","166258","2020-10-21","18:00:00",""
"1538144","9.72","","9.72","","9.72","","90","","90","","90","","918.33","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Sc2 O3","","- O3 Sc2 -","- O3 Sc2 -","- O48 Sc32 -","16","0.333333","","Goldschmidt, V.M.","Geochemische Verteilungsgesetze der Elemente.","Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk-Naturvidenskapelig Klasse","1925","7","","1","1","","","","","","","","","","","","","","","","","","","","","","has coordinates","166571","2020-10-21","18:00:00",""
"1538146","10.59","","10.59","","10.59","","90","","90","","90","","1187.65","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Tl2 O3","","- O3 Tl2 -","- O3 Tl2 -","- O48 Tl32 -","16","0.333333","","Goldschmidt, V.M.","Geochemische Verteilungsgesetze der Elemente.","Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk-Naturvidenskapelig Klasse","1925","7","","1","1","","","","","","","","","","","","","","","","","","","","","","has coordinates","166573","2020-10-21","18:00:00",""
"1538147","10.14","","10.14","","10.14","","90","","90","","90","","1042.59","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- In2 O3 -","- In2 O3 -","- In32 O48 -","16","0.333333","","Goldschmidt, V.M.","Geochemische Verteilungsgesetze der Elemente.","Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk-Naturvidenskapelig Klasse","1925","7","","1","59","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539489","10.715","","10.715","","10.715","","90","","90","","90","","1230.2","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Na2 Cd O2","","- Cd Na2 O2 -","- Cd0.999 Na2.001 O2 -","- Cd15.984 Na32.016 O32 -","16","0.333333","","Vielhaber, E.; Hoppe, R.","Ueber Oxocadmate der Alkalimetalle (I)","Revue de Chimie Minerale","1969","6","","169","181","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539587","10.6122","","10.6122","","10.6122","","90","","90","","90","","1195.13","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Y1.8 Dy.2) O3","","- Dy0.2 O3 Y1.8 -","- Dy0.2 O3 Y1.8 -","- Dy3.2 O48 Y28.8 -","16","0.333333","","Antic, B.; Oennerud, P.; Rodic, D.; Tellgren, R.","The structure characteristics of the diluted magnetic semiconductor Y2-xDyxO3","Powder Diffraction","1993","8","","216","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","168539","2020-10-21","18:00:00",""
"1539588","10.6199","","10.6199","","10.6199","","90","","90","","90","","1197.74","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Y1.5 Dy.5) O3","","- Dy0.5 O3 Y1.5 -","- Dy0.5 O3 Y1.5 -","- Dy8 O48 Y24 -","16","0.333333","","Antic, B.; Oennerud, P.; Rodic, D.; Tellgren, R.","The structure characteristics of the diluted magnetic semiconductor Y2-xDyxO3","Powder Diffraction","1993","8","","216","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","168540","2020-10-21","18:00:00",""
"1539589","10.63","","10.63","","10.63","","90","","90","","90","","1201.16","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Y1.26 Dy.74) O3","","- Dy0.74 O3 Y1.26 -","- Dy0.74 O3 Y1.26 -","- Dy11.84 O48 Y20.16 -","16","0.333333","","Antic, B.; Oennerud, P.; Rodic, D.; Tellgren, R.","The structure characteristics of the diluted magnetic semiconductor Y2-xDyxO3","Powder Diffraction","1993","8","","216","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","168541","2020-10-21","18:00:00",""
"1539590","10.6485","","10.6485","","10.6485","","90","","90","","90","","1207.44","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Y.6 Dy1.4) O3","","- Dy1.4 O3 Y0.6 -","- Dy1.4 O3 Y0.6 -","- Dy22.4 O48 Y9.6 -","16","0.333333","","Antic, B.; Oennerud, P.; Rodic, D.; Tellgren, R.","The structure characteristics of the diluted magnetic semiconductor Y2-xDyxO3","Powder Diffraction","1993","8","","216","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","168542","2020-10-21","18:00:00",""
"1539591","10.6603","","10.6603","","10.6603","","90","","90","","90","","1211.46","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Y.2 Dy1.8) O3","","- Dy1.8 O3 Y0.2 -","- Dy1.8 O3 Y0.2 -","- Dy28.8 O48 Y3.2 -","16","0.333333","","Antic, B.; Oennerud, P.; Tellgren, R.; Rodic, D.","The structure characteristics of the diluted magnetic semiconductor Y2-xDyxO3","Powder Diffraction","1993","8","","216","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","168543","2020-10-21","18:00:00",""
"1539592","10.63","","10.63","","10.63","","90","","90","","90","","1201.16","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Dy2 O3 -","- Dy2 O3 -","- Dy32 O48 -","16","0.333333","","Antic, B.; Oennerud, P.; Rodic, D.; Tellgren, R.","The structure characteristics of the diluted magnetic semiconductor Y2-x Dyx O3","Powder Diffraction","1993","8","","216","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1541680","11.006","","11.006","","11.006","","90","","90","","90","","1333.18","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Pr.6 Gd.4 O1.500","","- Gd0.4 O1.5 Pr0.6 -","- Gd0.4 O1.505 Pr0.6 -","- Gd12.8 O48.16 Pr19.2 -","32","0.666667","","Endo, Kazuhiro; Yamauchi, Shigeru; Fueki, Kazuo; Mukaibo, Takashi","An X-Ray Study of Non-stoichiometric Pr~0.6~Gd~0.4~O~1.5+δ~","Bulletin of the Chemical Society of Japan","1976","49","","1191","1193","10.1246/bcsj.49.1191","","","","","","","","","","","","","","","","","","","","","has coordinates","176253","2020-10-21","18:00:00",""
"1541681","10.957","","10.957","","10.957","","90","","90","","90","","1315.45","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Pr.6 Gd.4 O1.575","","- Gd0.4 O1.575 Pr0.6 -","- Gd0.4 O1.575 Pr0.6 -","- Gd12.8 O50.4 Pr19.2 -","32","0.666667","","Endo, Kazuhiro; Yamauchi, Shigeru; Fueki, Kazuo; Mukaibo, Takashi","An X-Ray Study of Non-stoichiometric Pr~0.6~Gd~0.4~O~1.5+δ~","Bulletin of the Chemical Society of Japan","1976","49","","1191","1193","10.1246/bcsj.49.1191","","","","","","","","","","","","","","","","","","","","","has coordinates","176253","2020-10-21","18:00:00",""
"1541682","10.927","","10.927","","10.927","","90","","90","","90","","1304.68","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Pr0.6 Gd0.4) O1.62","","- Gd0.4 O1.62 Pr0.6 -","- Gd0.4 O1.62 Pr0.6 -","- Gd12.8 O51.84 Pr19.2 -","32","0.666667","","Endo, Kazuhiro; Yamauchi, Shigeru; Fueki, Kazuo; Mukaibo, Takashi","An X-Ray Study of Non-stoichiometric Pr~0.6~Gd~0.4~O~1.5+δ~","Bulletin of the Chemical Society of Japan","1976","49","","1191","1193","10.1246/bcsj.49.1191","","","","","","","","","","","","","","","","","","","","","has coordinates","176253","2020-10-21","18:00:00",""
"1541683","10.897","","10.897","","10.897","","90","","90","","90","","1293.96","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Pr.6 Gd.4 O1.675","","- Gd0.4 O1.675 Pr0.6 -","- Gd0.4 O1.665 Pr0.6 -","- Gd12.8 O53.28 Pr19.2 -","32","0.666667","","Endo, Kazuhiro; Yamauchi, Shigeru; Fueki, Kazuo; Mukaibo, Takashi","An X-Ray Study of Non-stoichiometric Pr~0.6~Gd~0.4~O~1.5+δ~","Bulletin of the Chemical Society of Japan","1976","49","","1191","1193","10.1246/bcsj.49.1191","","","","","","","","","","","","","","","","","","","","","has coordinates","176253","2020-10-21","18:00:00",""
"1541702","10.727","","10.727","","10.727","","90","","90","","90","","1234.34","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Ca U O3","","- Ca U -","- Ca U -","- Ca16 U16 -","16","0.333333","","Alberman, K.B.; Blakey, R.C.; Anderson, J.S.","The Oxides of Uranium. Part II. The Binary System U O2 Ca O","Journal of the Chemical Society","1951","1951","","1352","1356","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541708","10.032","","10.032","","10.032","","90","","90","","90","","1009.63","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","O2 (Pt F6)","","- F6 O2 Pt -","- F6 O2 Pt -","- F48 O16 Pt8 -","8","0.166667","","Bartlett, N.; Lohmann, D.H.","Dioxygenyl hexafluoroplatinate(V) O2(+) (Pt F6)(-)","Proceedings of the Chemical Society (London)","1962","1962","","115","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541743","10.55","","10.55","","10.55","","90","","90","","90","","1174.24","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Y2 O3","","- O3 Y2 -","- O3 Y2 -","- O48 Y32 -","16","0.333333","","Fert, A.","Structure de quelques oxydes de terres rares","Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)","1962","85","","267","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","173202","2020-10-21","18:00:00",""
"1541744","10.606","","10.606","","10.606","","90","","90","","90","","1193.04","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Ho2 O3 -","- Ho2 O3 -","- Ho32 O48 -","16","0.333333","","Fert, A.","Structure de quelques oxydes de terres rares","Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)","1962","85","","267","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1541745","10.548","","10.548","","10.548","","90","","90","","90","","1173.57","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Er2 O3 -","- Er2 O3 -","- Er32 O48 -","16","0.333333","","Fert, A.","Structure de quelques oxydes de terres rares","Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)","1962","85","","267","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1548396","39.7584","0.0002","39.7584","0.0002","39.7584","0.0002","90","","90","","90","","62847.3","0.5","293","2","293","2","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- C28 H30 N4 Ni2 O15 S -","- C28 H30 N4 Ni2 O15 S -","- C1344 H1440 N192 Ni96 O720 S48 -","48","1","","Feng, Rui; Jia, Yan-Yuan; Li, Zhao-Yang; Chang, Ze; Bu, Xian-He","Enhancing the stability and porosity of penetrated metal-organic frameworks through the insertion of coordination sites.","Chemical science","2018","9","4","950","955","10.1039/c7sc04192f","","","1.54178","CuKα","","0.09","0.0721","","","0.1988","0.2155","","","","","","1.022","","","","has coordinates","228714","2020-10-21","18:00:00",""
"1548517","10.4786","0.0022","10.4786","0.0022","10.4786","0.0022","90","","90","","90","","1150.6","0.4","1123.15","0.5","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Lutetium(III) Oxide (2/3)","","- Lu2 O3 -","- Lu2 O3 -","- Lu32 O48 -","16","0.333333","","Pavlik, III, Alfred J.; Ushakov, Sergey V.; Navrotsky, Alexandra; Benmore, Chris J.; Weber, Richard J.K.","Structure and thermal expansion of Lu 2 O 3 and Yb 2 O 3 up to the melting points","Journal of Nuclear Materials","2017","495","","385","","10.1016/j.jnucmat.2017.08.031","powder diffraction","","","","","","","","","0.10616","","","","7.867","","","","","","","has coordinates","213925","2020-10-21","18:00:00",""
"1548518","10.5278","0.0004","10.5278","0.0004","10.5278","0.0004","90","","90","","90","","1166.84","0.08","1723.15","0.5","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Lutetium(III) Oxide (2/3)","","- Lu2 O3 -","- Lu2 O3 -","- Lu32 O48 -","16","0.333333","","Pavlik, III, Alfred J.; Ushakov, Sergey V.; Navrotsky, Alexandra; Benmore, Chris J.; Weber, Richard J.K.","Structure and thermal expansion of Lu 2 O 3 and Yb 2 O 3 up to the melting points","Journal of Nuclear Materials","2017","495","","385","","10.1016/j.jnucmat.2017.08.031","powder diffraction","","","","","","","","","0.02628","","","","1.898","","","","","","","has coordinates","213925","2020-10-21","18:00:00",""
"1548519","10.5476","0.0015","10.5476","0.0015","10.5476","0.0015","90","","90","","90","","1173.4","0.3","2773.15","0.5","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Lutetium(III) Oxide (2/3)","","- Lu2 O3 -","- Lu2 O3 -","- Lu32 O48 -","16","0.333333","","Pavlik, III, Alfred J.; Ushakov, Sergey V.; Navrotsky, Alexandra; Benmore, Chris J.; Weber, Richard J.K.","Structure and thermal expansion of Lu 2 O 3 and Yb 2 O 3 up to the melting points","Journal of Nuclear Materials","2017","495","","385","","10.1016/j.jnucmat.2017.08.031","powder diffraction","","","","","","","","","0.02121","","","","0.894","","","","","","","has coordinates","213925","2020-10-21","18:00:00",""
"1548520","10.5078","0.0008","10.5078","0.0008","10.5078","0.0008","90","","90","","90","","1160.21","0.15","1123.15","0.5","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Ytterbium(III) Oxide (2/3)","","- O3 Yb2 -","- O3 Yb2 -","- O48 Yb32 -","16","0.333333","","Pavlik, III, Alfred J.; Ushakov, Sergey V.; Navrotsky, Alexandra; Benmore, Chris J.; Weber, Richard J.K.","Structure and thermal expansion of Lu 2 O 3 and Yb 2 O 3 up to the melting points","Journal of Nuclear Materials","2017","495","","385","","10.1016/j.jnucmat.2017.08.031","powder diffraction","","","","","","","","","0.0613","","","","4.771","","","","","","","has coordinates","213925","2020-10-21","18:00:00",""
"1548521","10.5629","0.0004","10.5629","0.0004","10.5629","0.0004","90","","90","","90","","1178.55","0.08","1873.15","0.5","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Ytterbium(III) Oxide (2/3)","","- O3 Yb2 -","- O3 Yb2 -","- O48 Yb32 -","16","0.333333","","Pavlik, III, Alfred J.; Ushakov, Sergey V.; Navrotsky, Alexandra; Benmore, Chris J.; Weber, Richard J.K.","Structure and thermal expansion of Lu 2 O 3 and Yb 2 O 3 up to the melting points","Journal of Nuclear Materials","2017","495","","385","","10.1016/j.jnucmat.2017.08.031","powder diffraction","","","","","","","","","0.02228","","","","1.746","","","","","","","has coordinates","213925","2020-10-21","18:00:00",""
"1548522","10.6552","0.0008","10.6552","0.0008","10.6552","0.0008","90","","90","","90","","1209.72","0.16","2873.15","0.5","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Ytterbium(III) Oxide (2/3)","","- O3 Yb2 -","- O3 Yb2 -","- O48 Yb32 -","16","0.333333","","Pavlik, III, Alfred J.; Ushakov, Sergey V.; Navrotsky, Alexandra; Benmore, Chris J.; Weber, Richard J.K.","Structure and thermal expansion of Lu 2 O 3 and Yb 2 O 3 up to the melting points","Journal of Nuclear Materials","2017","495","","385","","10.1016/j.jnucmat.2017.08.031","powder diffraction","","","","","","","","","0.02209","","","","1.837","","","","","","","has coordinates","213925","2020-10-21","18:00:00",""
"1548619","11.00425","0.00028","11.00425","0.00028","11.00425","0.00028","90","","90","","90","","1332.54","0.06","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Cerium(IV) Neodymium Oxide (0.5/0.5/1.75)","","- Ce0.5 Nd0.5 O1.75 -","- Ce0.5 Nd0.5 O1.755 -","- Ce16 Nd16 O56.16 -","32","0.666667","","Chakraborty, K. R.; Krishna, P. S. R.; Chavan, S. V.; Tyagi, A. K.","A neutron diffraction study on ceria - neodia solid solutions","Powder Diffraction","2006","21","","36","39","","","","","","","","","","","","","","","","","","","","","","has coordinates","204931","2020-10-21","18:00:00",""
"1557417","9.842","0.001","9.842","0.001","9.842","0.001","90","","90","","90","","953.34","0.17","","","298","","","","100","","","","","10","I a -3","-I 2b 2c 3","206","Sc,Ti,Al,Zr,Mg,Ca,[])2O3","","kangite","- Al0.16 Ca0.06 Fe0.02 Mg0.11 O3 Sc0.54 Ti0.66 V0.03 Y0.07 Zr0.13 -","- O3 Sc1.2685 -","- O48 Sc20.296 -","16","0.333333","","Ma, C.; Tschauner, O.; Beckett, J.R.; Rossman, G.R.; Liu, W.","Kangite, (Sc,Ti,Al,Zr,Mg,Ca,[])2O3, a new ultra-refractory scandia mineral from the Allende meteorite: Synchrotron micro-Laue diffraction and electron backscatter diffraction","American Mineralogist","2013","98","","870","878","10.2138/am.2013.4290","","","","","","","","","","","","","","","","","","","","","has coordinates","248581","2020-10-21","18:00:00",""
"1557963","9.5393","0.0001","9.5393","0.0001","9.5393","0.0001","90","","90","","90","","868.06","0.016","","","298","","","","100","","","","","3","I a -3","-I 2b 2c 3","206","Cu3TeO6","","mcalpineite","- Cu3 O6 Te -","- Cu3 O6 Te -","- Cu24 O48 Te8 -","8","0.166667","","Carbone, C.; Basso, R.; Cabella, R.; Martinelli, A.; Grice, J.D.; Lucchetti, G.","Mcalpineite from the Gambatesa mine, Italy, and redefinition of the species","American Mineralogist","2013","98","","1899","1905","10.2138/am.2013.4525","","","","","","","","","","","","","","","","","","","","","has coordinates","251311","2020-10-21","18:00:00",""
"1560993","16.9248","0.0013","16.9248","0.0013","16.9248","0.0013","90","","90","","90","","4848.1","0.6","296","2","296","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","","","","- C26 H18 Co N16 -","- C26.0004 H18.0006 Co N15.9996 -","- C208.003 H144.005 Co8 N127.997 -","8","0.166667","","Feng, Ying; Cai, Song-Liang; Gao, Yong; Zheng, Sheng-Run","Construction of coordination polymers based on a rigid tripodal nitrogen-containing heterotopic ligand that designed by mixed-donors strategy","Journal of Solid State Chemistry","2018","265","","64","71","10.1016/j.jssc.2018.05.031","","","0.71073","MoKα","","0.0414","0.0304","","","0.0785","0.0856","","","","","","1.012","","","","has coordinates,has disorder","262969","2021-03-10","10:04:17",""
"1560994","17.0295","0.0013","17.0295","0.0013","17.0295","0.0013","90","","90","","90","","4938.6","0.7","296","2","296","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","","","","- C26 H18 N16 Zn -","- C26.0004 H18.0006 N15.9996 Zn -","- C208.003 H144.005 N127.997 Zn8 -","8","0.166667","","Feng, Ying; Cai, Song-Liang; Gao, Yong; Zheng, Sheng-Run","Construction of coordination polymers based on a rigid tripodal nitrogen-containing heterotopic ligand that designed by mixed-donors strategy","Journal of Solid State Chemistry","2018","265","","64","71","10.1016/j.jssc.2018.05.031","","","0.71073","MoKα","","0.1423","0.0626","","","0.1411","0.1862","","","","","","0.899","","","","has coordinates,has disorder","262969","2021-03-10","10:04:21",""
"1562990","10.842","0.0001","10.842","0.0001","10.842","0.0001","90","","90","","90","","1274.47","0.02","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.9 Gd0.1 O1.95 -","- Ce0.9 Gd0.1 O1.95 -","- Ce28.8 Gd3.2 O62.4 -","32","0.666667","","Artini, Cristina; Costa, Giorgio A.; Pani, Marcella; Lausi, Andrea; Plaisier, Jasper","Structural characterization of the CeO2/Gd2O3 mixed system by synchrotron X-ray diffraction","Journal of Solid State Chemistry","2012","190","","24","28","10.1016/j.jssc.2012.01.056","powder diffraction","x-rays","0.689","","","","","","","","","","1.8637","","","","","","","","has coordinates","265628","2021-05-31","08:34:05",""
"1562991","10.8544","0.0001","10.8544","0.0001","10.8544","0.0001","90","","90","","90","","1278.84","0.02","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.8 Gd0.2 O1.9 -","- Ce0.8 Gd0.2 O1.905 -","- Ce25.6 Gd6.4 O60.96 -","32","0.666667","","Artini, Cristina; Costa, Giorgio A.; Pani, Marcella; Lausi, Andrea; Plaisier, Jasper","Structural characterization of the CeO2/Gd2O3 mixed system by synchrotron X-ray diffraction","Journal of Solid State Chemistry","2012","190","","24","28","10.1016/j.jssc.2012.01.056","powder diffraction","x-rays","0.689","","","","","","","","","","2.7592","","","","","","","","has coordinates","265628","2021-05-31","08:34:05",""
"1562992","10.8642","0.0002","10.8642","0.0002","10.8642","0.0002","90","","90","","90","","1282.31","0.04","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.7 Gd0.3 O1.85 -","- Ce0.7 Gd0.3 O1.885 -","- Ce22.4 Gd9.6 O60.32 -","32","0.666667","","Artini, Cristina; Costa, Giorgio A.; Pani, Marcella; Lausi, Andrea; Plaisier, Jasper","Structural characterization of the CeO2/Gd2O3 mixed system by synchrotron X-ray diffraction","Journal of Solid State Chemistry","2012","190","","24","28","10.1016/j.jssc.2012.01.056","powder diffraction","x-rays","0.689","","","","","","","","","","4.3841","","","","","","","","has coordinates","265628","2021-05-31","08:34:05",""
"1562993","10.8678","0.0001","10.8678","0.0001","10.8678","0.0001","90","","90","","90","","1283.59","0.02","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.6 Gd0.4 O1.8 -","- Ce0.6 Gd0.4 O1.825 -","- Ce19.2 Gd12.8 O58.4 -","32","0.666667","","Artini, Cristina; Costa, Giorgio A.; Pani, Marcella; Lausi, Andrea; Plaisier, Jasper","Structural characterization of the CeO2/Gd2O3 mixed system by synchrotron X-ray diffraction","Journal of Solid State Chemistry","2012","190","","24","28","10.1016/j.jssc.2012.01.056","powder diffraction","x-rays","0.689","","","","","","","","","","6.0513","","","","","","","","has coordinates","265628","2021-05-31","08:34:05",""
"1562994","10.8684","0.0001","10.8684","0.0001","10.8684","0.0001","90","","90","","90","","1283.8","0.02","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.5 Gd0.5 O1.75 -","- Ce0.5 Gd0.5 O1.745 -","- Ce16 Gd16 O55.84 -","32","0.666667","","Artini, Cristina; Costa, Giorgio A.; Pani, Marcella; Lausi, Andrea; Plaisier, Jasper","Structural characterization of the CeO2/Gd2O3 mixed system by synchrotron X-ray diffraction","Journal of Solid State Chemistry","2012","190","","24","28","10.1016/j.jssc.2012.01.056","powder diffraction","x-rays","0.689","","","","","","","","","","7.3394","","","","","","","","has coordinates","265628","2021-05-31","08:34:05",""
"1562995","10.8647","0.0001","10.8647","0.0001","10.8647","0.0001","90","","90","","90","","1282.49","0.02","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.4 Gd0.6 O1.7 -","- Ce0.4 Gd0.6 O1.69 -","- Ce12.8 Gd19.2 O54.08 -","32","0.666667","","Artini, Cristina; Costa, Giorgio A.; Pani, Marcella; Lausi, Andrea; Plaisier, Jasper","Structural characterization of the CeO2/Gd2O3 mixed system by synchrotron X-ray diffraction","Journal of Solid State Chemistry","2012","190","","24","28","10.1016/j.jssc.2012.01.056","powder diffraction","x-rays","0.689","","","","","","","","","","7.907","","","","","","","","has coordinates","265628","2021-05-31","08:34:05",""
"1562996","10.8581","0.0001","10.8581","0.0001","10.8581","0.0001","90","","90","","90","","1280.15","0.02","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.3 Gd0.7 O1.65 -","- Ce0.3 Gd0.7 O1.64 -","- Ce9.6 Gd22.4 O52.48 -","32","0.666667","","Artini, Cristina; Costa, Giorgio A.; Pani, Marcella; Lausi, Andrea; Plaisier, Jasper","Structural characterization of the CeO2/Gd2O3 mixed system by synchrotron X-ray diffraction","Journal of Solid State Chemistry","2012","190","","24","28","10.1016/j.jssc.2012.01.056","powder diffraction","x-rays","0.689","","","","","","","","","","6.4344","","","","","","","","has coordinates","265628","2021-05-31","08:34:05",""
"1562997","10.8472","0.0001","10.8472","0.0001","10.8472","0.0001","90","","90","","90","","1276.3","0.02","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.2 Gd0.8 O1.6 -","- Ce0.2 Gd0.8 O1.595 -","- Ce6.4 Gd25.6 O51.04 -","32","0.666667","","Artini, Cristina; Costa, Giorgio A.; Pani, Marcella; Lausi, Andrea; Plaisier, Jasper","Structural characterization of the CeO2/Gd2O3 mixed system by synchrotron X-ray diffraction","Journal of Solid State Chemistry","2012","190","","24","28","10.1016/j.jssc.2012.01.056","powder diffraction","x-rays","0.689","","","","","","","","","","5.681","","","","","","","","has coordinates","265628","2021-05-31","08:34:07",""
"1562998","10.8345","0.0001","10.8345","0.0001","10.8345","0.0001","90","","90","","90","","1271.82","0.02","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.1 Gd0.9 O1.55 -","- Ce0.1 Gd0.9 O1.55 -","- Ce3.2 Gd28.8 O49.6 -","32","0.666667","","Artini, Cristina; Costa, Giorgio A.; Pani, Marcella; Lausi, Andrea; Plaisier, Jasper","Structural characterization of the CeO2/Gd2O3 mixed system by synchrotron X-ray diffraction","Journal of Solid State Chemistry","2012","190","","24","28","10.1016/j.jssc.2012.01.056","powder diffraction","x-rays","0.689","","","","","","","","","","4.8874","","","","","","","","has coordinates","265628","2021-05-31","08:34:07",""
"1562999","10.8175","0.0001","10.8175","0.0001","10.8175","0.0001","90","","90","","90","","1265.85","0.02","298","","298","","","","","","","","","2","I a -3","-I 2b 2c 3","206","Gd oxide","","","- Gd2 O3 -","- Gd2 O3.02 -","- Gd32 O48.32 -","16","0.333333","","Artini, Cristina; Costa, Giorgio A.; Pani, Marcella; Lausi, Andrea; Plaisier, Jasper","Structural characterization of the CeO2/Gd2O3 mixed system by synchrotron X-ray diffraction","Journal of Solid State Chemistry","2012","190","","24","28","10.1016/j.jssc.2012.01.056","powder diffraction","x-rays","0.689","","","","","","","","","","6.9345","","","","","","","","has coordinates","265628","2021-05-31","08:34:07",""
"1563926","27.646","0.003","27.646","0.003","27.646","0.003","90","","90","","90","","21130","4","200","","200","","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C54 H79.5 N5.5 O3 Tb -","- C54 H79.5 N5.5 O3 Tb -","- C864 H1272 N88 O48 Tb16 -","16","0.333333","","Molloy, Jennifer K.; Fedele, Lionel; Jarjayes, Olivier; Philouze, Christian; Imbert, Daniel; Thomas, Fabrice","Structural and spectroscopic investigations of redox active seven coordinate luminescent lanthanide complexes","Inorganica Chimica Acta","2018","483","","609","617","10.1016/j.ica.2018.08.054","","x-ray","0.71073","MoKα","","0.0775","0.0345","","","0.0695","0.1057","","","","","","1.394","","","","has coordinates,has disorder","266989","2021-07-05","08:57:34",""
"1563927","27.545","0.003","27.545","0.003","27.545","0.003","90","","90","","90","","20899","4","200","","200","","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C54 H79.5 N5.5 O3 Yb -","- C54 H79.5 N5.5 O3 Yb -","- C864 H1272 N88 O48 Yb16 -","16","0.333333","","Molloy, Jennifer K.; Fedele, Lionel; Jarjayes, Olivier; Philouze, Christian; Imbert, Daniel; Thomas, Fabrice","Structural and spectroscopic investigations of redox active seven coordinate luminescent lanthanide complexes","Inorganica Chimica Acta","2018","483","","609","617","10.1016/j.ica.2018.08.054","","x-ray","0.71073","MoKα","","0.0747","0.0311","","","0.058","0.0891","","","","","","1.449","","","","has coordinates,has disorder","266989","2021-07-05","08:57:36",""
"1563928","27.514","0.003","27.514","0.003","27.514","0.003","90","","90","","90","","20829","4","200","","200","","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C54 H79.5 Lu N5.5 O3 -","- C54 H79.5 Lu N5.5 O3 -","- C864 H1272 Lu16 N88 O48 -","16","0.333333","","Molloy, Jennifer K.; Fedele, Lionel; Jarjayes, Olivier; Philouze, Christian; Imbert, Daniel; Thomas, Fabrice","Structural and spectroscopic investigations of redox active seven coordinate luminescent lanthanide complexes","Inorganica Chimica Acta","2018","483","","609","617","10.1016/j.ica.2018.08.054","","x-ray","0.71073","MoKα","","0.0512","0.0274","","","0.0595","0.0792","","","","","","1.255","","","","has coordinates,has disorder","266989","2021-07-05","08:57:36",""
"1570669","4.43069","","4.43069","","4.43069","","90","","90","","90","","86.979","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- C3 O -","- C3 O -","- C48 O16 -","16","0.333333","","Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel","Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.","Chemical science","2023","14","45","12984","12994","10.1039/d3sc04406h","","","","","","0","","","","","","","","","","","","","","","has coordinates","288675","2024-01-04","10:21:04",""
"1570673","3.79654","","3.79654","","3.79654","","90","","90","","90","","54.722","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- C3 O -","- C3 O -","- C48 O16 -","16","0.333333","","Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel","Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.","Chemical science","2023","14","45","12984","12994","10.1039/d3sc04406h","","","","","","0","","","","","","","","","","","","","","","has coordinates","288675","2024-01-04","10:21:04",""
"1571056","36.5768","0.0008","36.5768","0.0008","36.5768","0.0008","90","","90","","90","","48934.7","1.9","170","2","170","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","MS6T@C70","","- C310 H264 O24 S12 -","- C310.014 H264 O24 S12 -","- C2480.11 H2112 O192 S96 -","8","0.166667","","An, Dongyue; Zhang, Rong; Zhu, Jiangyu; Wang, Teng; Zhao, Yan; Lu, Xuefeng; Liu, Yunqi","From π-conjugated macrocycles to heterocycloarenes based on benzo[2,1-<i>b</i>:3,4-<i>b</i>']dithiophene (BDTh): size- and geometry-dependent host-guest properties.","Chemical science","2024","15","12","4590","4601","10.1039/d3sc05074b","","","1.54178","CuKα","","0.2527","0.1824","","","0.4436","0.5144","","","","","","1.586","","","","has coordinates,has disorder","290873","2024-04-04","22:59:50",""
"2002147","9.5565","0.0005","9.5565","0.0005","9.5565","0.0005","90","","90","","90","","872.8","","","","","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","Tricopper trizinc bis(tellurate)","","- Cu3 O12 Te2 Zn3 -","- Cu3 O12 Te2 Zn3 -","- Cu12 O48 Te8 Zn12 -","4","0.0833333","","Mueller-Buschbaum, H; Wulff, L","Zur Kristallchemie der Kupfer(II)-Zink-Tellurate Cu5 Zn4 Te3 O18 und Cu1.5 Zn1.5 Te O6, mit einer Notiz ueber Cu1.5 Co1.5 Te O6","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1998","53","","53","57","","","","","","","0.0434","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002148","9.5702","0.0005","9.5702","0.0005","9.5702","0.0005","90","","90","","90","","876.5","","","","","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","Tricopper tricobalt bis(tellurate)","","- Co3 Cu3 O12 Te2 -","- Co3 Cu3 O12 Te2 -","- Co12 Cu12 O48 Te8 -","4","0.0833333","","Mueller-Buschbaum, H; Wulff, L","Zur Kristallchemie der Kupfer(II)-Zink-Tellurate Cu5 Zn4 Te3 O18 und Cu1.5 Zn1.5 Te O6, mit einer Notiz ueber Cu1.5 Co1.5 Te O6","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1998","53","","53","57","","","","","","","0.015","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2018151","14.253","0.006","14.253","0.006","14.253","0.006","90","","90","","90","","2895","2","153","2","153","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","","tribarium biyttrium hexaborate","","- B6 Ba3 O15 Y2 -","- B6 Ba3 O15 Y2 -","- B48 Ba24 O120 Y16 -","8","0.166667","OV3004","Zhao, Sangen; Yao, Jiyong; Zhang, Guochun; Fu, Peizhen; Wu, Yicheng","Ba~3~Y~2~B~6~O~15~, a novel cubic borate","Acta Crystallographica Section C","2011","67","7","i39","i41","10.1107/S010827011102052X","","","0.71073","MoKα","","0.0223","0.0212","","","0.0461","0.0466","","","","","","1.087","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2018519","13.7962","0.0002","13.7962","0.0002","13.7962","0.0002","90","","90","","90","","2625.9","0.07","190","2","190","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","iron nitrate hexahydrate","hexaaquairon(III) trinitrate","","- Fe H12 N3 O15 -","- Fe H12 N3 O15 -","- Fe8 H96 N24 O120 -","8","0.166667","YP3012","Schmidt, Horst; Asztalos, Annifrid; Bok, Frank; Voigt, Wolfgang","New iron(III) nitrate hydrates: Fe(NO~3~)~3~·<i>x</i>H~2~O with <i>x</i> = 4, 5 and 6","Acta Crystallographica Section C","2012","68","6","i29","i33","10.1107/S0108270112015855","","","0.71073","MoKα","","0.0338","0.0278","","","0.0755","0.0814","","","","","","1.093","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019465","9.41","","9.41","","9.41","","90","","90","","90","","833.238","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Dimanganese Trioxide","","- Mn2 O3 -","- Mn2 O3 -","- Mn32 O48 -","16","0.333333","","Klein, H.; David, J.","The quality of precession electron diffraction data is higher than necessary for structure solution of unknown crystalline phases","Acta Crystallographica, Section A: Foundations of Crystallography","2011","67","3","297","302","10.1107/S0108767311006581","","","","","","0.09","","","","","","","","","","","","","","","has coordinates","176341","2020-10-21","18:00:00",""
"2022541","22.27","0.02","22.27","0.02","22.27","0.02","90","","90","","90","","11045","17","293","2","293","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","Poly[[bis(μ~3~-benzene-1,3,5-tricarboxylato)bis[μ~3~-1,3,5-tris(2-methylimidazol-1-yl)benzene]tricopper(II)] hexahydrate]","","- C54 H42 Cu3 N12 O12 -","- C54 H42 Cu3 N12 O12 -","- C432 H336 Cu24 N96 O96 -","8","0.166667","OV3157","Chen, Hui-Ru","Synthesis, crystal structure and photocatalytic properties of a three-dimensional copper(II) metal–organic framework based on 1,3,5-tris(2-methylimidazol-1-yl)benzene","Acta Crystallographica Section C","2022","78","3","","","10.1107/S2053229622001322","","","0.71073","MoKα","","0.0648","0.0456","","","0.0814","0.0864","","","","","","0.975","","","","has coordinates","272900","2022-02-10","02:58:36",""
"2101512","10.605","0.001","10.605","0.001","10.605","0.001","90","","90","","90","","1192.7","0.19","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Ho2 O3 -","- Ho2 O3 -","- Ho32 O48 -","16","0.333333","AS0696","Maslen, E. N.; Streltsov, V. A.; Ishizawa, N.","A synchrotron X-ray study of the electron density in <i>C</i>-type rare earth oxides","Acta Crystallographica Section B","1996","52","3","414","422","10.1107/S0108768195013371","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2105489","12.7","0.003","12.7","0.003","12.7","0.003","90","","90","","90","","2048.4","0.8","85","2","85","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","tetralithium hypodiphosphate hexahydrate","","","- H12 Li4 O12 P2 -","- H12 Li4 O12 P2 -","- H96 Li32 O96 P16 -","8","0.166667","PI5015","Kinzhybalo, Vasyl; Mermer, Adrian; Lis, Tadeusz; Starynowicz, Przemysław","Electron density distribution in tetralithium hypodiphosphate hexahydrate, Li~4~P~2~O~6~·6H~2~O","Acta Crystallographica Section B","2013","69","4","344","355","10.1107/S2052519213017442","","","0.7107","MoKα","","0.019","0.014","","","","0.013","","","","","","1.723","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105791","9.4146","0.0001","9.4146","0.0001","9.4146","0.0001","90","","90","","90","","834.46","0.015","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Manganese(III) Oxide - Ht","Bixbyite C","- Mn2 O3 -","- Mn2 O3 -","- Mn32 O48 -","16","0.333333","","Geller, S.","Structures of α-Mn~2~O~3~, (Mn~0.983~Fe~0.017~)~2~O~3~, (Mn~0.37~Fe~0.63~)~2O~3~ and relation to magnetic ordering","Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry","1971","27","4","821","828","10.1107/S0567740871002966","","","","","","0.027","","","","","","","","","","","","","","","has coordinates","176330","2020-10-21","18:00:00",""
"2106051","10.956","","10.956","","10.956","","90","","90","","90","","1315.09","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Ti (Te3 O8)","","- O8 Te3 Ti -","- O8 Te3 Ti -","- O64 Te24 Ti8 -","8","0.166667","","Meunier, G.; Galy, J.","Sur une deformation inedite du reseau de type fluorine. Structure cristalline des phases M Te3 O8 (M = Ti, Sn, Hf, Zr)","Acta Crystallographica B (24,1968-38,1982)","1971","27","","602","608","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106052","11.144","","11.144","","11.144","","90","","90","","90","","1383.96","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Sn (Te3 O8)","","- O8 Sn Te3 -","- O8 Sn Te3 -","- O64 Sn8 Te24 -","8","0.166667","","Meunier, G.; Galy, J.","Sur une deformation inedite du reseau de type fluorine. structure cristalline des phases M Te3 O8 (M = Ti, Sn, Hf, Zr)","Acta Crystallographica B (24,1968-38,1982)","1971","27","","602","608","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106053","11.291","","11.291","","11.291","","90","","90","","90","","1439.45","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Hf Te3 O8","","- Hf O8 Te3 -","- Hf O8 Te3 -","- Hf8 O64 Te24 -","8","0.166667","","Meunier, G.; Galy, J.","Sur une deformation inedite du reseau de type fluorine. structure cristalline des phases M Te3 O8 (M = Ti, Sn, Hf, Zr)","Acta Crystallographica B (24,1968-38,1982)","1971","27","","602","608","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106306","9.537","","9.537","","9.537","","90","","90","","90","","867.432","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Cu3 Te O6","","- Cu3 O6 Te -","- Cu3 O6 Te -","- Cu24 O48 Te8 -","8","0.166667","","Falck, L.; Lindqvist, O.; Moret, J.","Tricopper(II) tellurate(VI)","Acta Crystallographica B (24,1968-38,1982)","1978","34","","896","897","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106365","10.404","","10.404","","10.404","","90","","90","","90","","1126.16","","","","","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","(N2 H6) (Ti F6)","","- F6 H6 N2 Ti -","- F6 N2 Ti -","- F48 N16 Ti8 -","8","0.166667","","Kojic-Prodic, B.; Matkovic, B.; Scavnicar, S.","The crystal structure of hydrazinium(+2) hexafluorotitanate(IV), N2 H6 Ti F6","Acta Crystallographica B (24,1968-38,1982)","1971","27","","635","637","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106812","10.536","","10.536","","10.536","","90","","90","","90","","1169.57","","","","","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","In32 O N17 F43","","- F43 In32 N17 O -","- F43.008 In32 N16.96 O1.024 -","- F43.008 In32 N16.96 O1.024 -","1","0.0208333","","Abrait, N.; Laval, J.P.; Frit, B.; Roult, G.","Structure Cristalline de l'Oxynitrofluorure d'Indium In32 O N17 F43","Acta Crystallographica B (24,1968-38,1982)","1982","38","","1088","1093","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106880","10.58","","10.58","","10.58","","90","","90","","90","","1184.29","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Ho2 O3 -","- Ho2 O3 -","- Ho32 O48 -","16","0.333333","","Bartos, A.; Lieb, K.P.; Wiarda, D.; Uhrmacher, M.","Refinement of atomic positions in bixbyite oxides using perturbed angular correlation spectroscopy","Acta Crystallographica B (39,1983-)","1993","49","","165","169","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106881","10.79","","10.79","","10.79","","90","","90","","90","","1256.22","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Gd2 O3 -","- Gd2 O3 -","- Gd32 O48 -","16","0.333333","","Bartos, A.; Lieb, K.P.; Uhrmacher, M.; Wiarda, D.","Refinement of atomic positions in bixbyite oxides using perturbed angular correlation spectroscopy","Acta Crystallographica B (39,1983-)","1993","49","","165","169","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106983","17.6","","17.6","","17.6","","90","","90","","90","","5451.78","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- P4 S9 -","- P4 S9 -","- P64 S144 -","16","0.333333","","Hilmer, W.","Die Struktur eines Phosphor(III,V)-Sulfids der ungefaehren Zusammensetzung P4 S9","Acta Crystallographica B (24,1968-38,1982)","1969","25","","1229","1231","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2211384","9.5677","0.0005","9.5677","0.0005","9.5677","0.0005","90","","90","","90","","875.84","0.08","292","3","292","3","","","","","","","","4","I a -3","-I 2b 2c 3","206","Dicopper(II) cobalt(II) tellurium(VI) hexaoxide","","","- Co Cu2 O6 Te -","- Co0.999 Cu2.001 O6 Te -","- Co7.992 Cu16.008 O48 Te8 -","8","0.166667","FI2018","Becker, Richard; Berger, Helmuth","Cu~2~CoTeO~6~","Acta Crystallographica Section E","2006","62","12","i261","i262","10.1107/S1600536806049075","","","0.71073","MoKα","","0.0148","0.0143","","","0.0432","0.0433","","","","","","1.75","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2243989","11.1574","0.0004","11.1574","0.0004","11.1574","0.0004","90","","90","","90","","1388.96","0.09","296","2","296","2","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Tin(IV) trioxidotellurate(IV)","","- O8 Sn Te3 -","- O8 Sn Te3 -","- O64 Sn8 Te24 -","8","0.166667","HB7998","Ketter, Michael; Weil, Matthias","Single crystals of SnTe~3~O~8~ in the millimetre range grown by chemical vapor transport reactions","Acta Crystallographica Section E","2021","77","12","1276","1279","10.1107/S2056989021011828","","","0.71073","MoKα","","0.0158","0.0137","","","0.0293","0.03","","","","","","1.072","","","","has coordinates,has Fobs","271908","2022-01-06","23:10:39",""
"2300049","10.8542","0.0001","10.8542","0.0001","10.8542","0.0001","90","","90","","90","","1278.77","0.02","293","","293","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Gadolinium Cerium oxide","","- Ce0.4 Gd0.6 O1.7 -","- Ce0.4 Gd0.6 O1.705 -","- Ce12.8 Gd19.2 O54.56 -","32","0.666667","","V. Grover; S. N. Achary; A. K. Tyagi","Structural analysis of excess-anion C-type rare earth oxide: a case study with Gd~1{-~<i>x</i>}Ce~<i>x~</i>O~1.5+<i>x~/2</i> (<i>x</i> = 0.20 and 0.40)","Journal of Applied Crystallography","2003","36","4","1082","1084","10.1107/S0021889803010288","","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2300050","10.8488","0.0001","10.8488","0.0001","10.8488","0.0001","90","","90","","90","","1276.87","0.02","293","","293","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Gadolinium Cerium oxide","","- Ce0.2 Gd0.8 O1.6 -","- Ce0.2 Gd0.8 O1.625 -","- Ce6.4 Gd25.6 O52 -","32","0.666667","","V. Grover; S. N. Achary; A. K. Tyagi","Structural analysis of excess-anion C-type rare earth oxide: a case study with Gd~1{-~<i>x</i>}Ce~<i>x~</i>O~1.5+<i>x~/2</i> (<i>x</i> = 0.20 and 0.40)","Journal of Applied Crystallography","2003","36","4","1082","1084","10.1107/S0021889803010288","","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2300531","10.54504","","10.54504","","10.54504","","90","","90","","90","","1172.59","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Er2 O3 -","- Er2 O3 -","- Er32 O48 -","16","0.333333","","Heiba, Z.; Okuyucu, H.; Hascicek, Y.S.","X-ray structure determination of the rare earth oxides (Er1-u Gdu)2 O3 applying the Rietveld method","Journal of Applied Crystallography","2002","35","","577","580","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2300532","10.6511","","10.6511","","10.6511","","90","","90","","90","","1208.32","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Er0.8 Gd0.2)2 O3","","- Er1.6 Gd0.4 O3 -","- Er1.61 Gd0.39 O3 -","- Er25.76 Gd6.24 O48 -","16","0.333333","","Heiba, Z.; Okuyucu, H.; Hascicek, Y.S.","X-ray structure determination of the rare earth oxides (Er1-u Gdu)2 O3 applying the Rietveld method","Journal of Applied Crystallography","2002","35","","577","580","","","","","","","","","","","","","","","","","","","","","","has coordinates","156804","2020-10-21","18:00:00",""
"2300533","10.73652","","10.73652","","10.73652","","90","","90","","90","","1237.63","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Er0.5 Gd0.5)2 O3","","- Er Gd O3 -","- Er1.02 Gd0.98 O3 -","- Er16.32 Gd15.68 O48 -","16","0.333333","","Heiba, Z.; Okuyucu, H.; Hascicek, Y.S.","X-ray structure determination of the rare earth oxides (Er1-u Gdu)2 O3 applying the Rietveld method","Journal of Applied Crystallography","2002","35","","577","580","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2300534","10.7911","","10.7911","","10.7911","","90","","90","","90","","1256.6","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Er0.2 Gd0.8)2 O3","","- Er0.4 Gd1.6 O3 -","- Er0.4 Gd1.6 O3 -","- Er6.4 Gd25.6 O48 -","16","0.333333","","Heiba, Z.; Okuyucu, H.; Hascicek, Y.S.","X-ray structure determination of the rare earth oxides (Er1-u Gdu)2 O3 applying the Rietveld method","Journal of Applied Crystallography","2002","35","","577","580","","","","","","","","","","","","","","","","","","","","","","has coordinates","156809","2020-10-21","18:00:00",""
"2300536","10.86831","","10.86831","","10.86831","","90","","90","","90","","1283.77","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Eu2 O3 -","- Eu2 O3 -","- Eu32 O48 -","16","0.333333","","Heiba, Z.K.; Akin, Y.; Sigmund, W.; Hascicek, Y.S.","X-ray structure and microstructure determination of the mixed sesquioxides (Eu1-x Ybx)2 O3 prepared by a sol-gel process","Journal of Applied Crystallography","2003","36","","1411","1416","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2300537","10.81718","","10.81718","","10.81718","","90","","90","","90","","1265.73","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Eu1.8 Yb0.2) O3","","- Eu1.8 O3 Yb0.2 -","- Eu1.8005 O3 Yb0.1995 -","- Eu28.808 O48 Yb3.192 -","16","0.333333","","Heiba, Z.K.; Akin, Y.; Hascicek, Y.S.; Sigmund, W.","X-ray structure and microstructure determination of the mixed sesquioxides (Eu1-x Ybx)2 O3 prepared by a sol-gel process","Journal of Applied Crystallography","2003","36","","1411","1416","","","","","","","","","","","","","","","","","","","","","","has coordinates","156820","2020-10-21","18:00:00",""
"2300538","10.76778","","10.76778","","10.76778","","90","","90","","90","","1248.47","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Eu1.6 Yb0.4) O3","","- Eu1.6 O3 Yb0.4 -","- Eu1.5995 O3 Yb0.4005 -","- Eu25.592 O48 Yb6.408 -","16","0.333333","","Heiba, Z.K.; Akin, Y.; Hascicek, Y.S.; Sigmund, W.","X-ray structure and microstructure determination of the mixed sesquioxides (Eu1-x Ybx)2 O3 prepared by a sol-gel process","Journal of Applied Crystallography","2003","36","","1411","1416","","","","","","","","","","","","","","","","","","","","","","has coordinates","156823","2020-10-21","18:00:00",""
"2300539","10.62842","","10.62842","","10.62842","","90","","90","","90","","1200.62","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Eu Yb) O3","","- Eu O3 Yb -","- Eu O3 Yb -","- Eu16 O48 Yb16 -","16","0.333333","","Heiba, Z.K.; Akin, Y.; Sigmund, W.; Hascicek, Y.S.","X-ray structure and microstructure determination of the mixed sesquioxides (Eu1-x Ybx)2 O3 prepared by a sol-gel process","Journal of Applied Crystallography","2003","36","","1411","1416","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2300540","10.49964","","10.49964","","10.49964","","90","","90","","90","","1157.51","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Eu0.4 Yb1.6) O3","","- Eu0.4 O3 Yb1.6 -","- Eu0.3995 O3 Yb1.6005 -","- Eu6.392 O48 Yb25.608 -","16","0.333333","","Heiba, Z.K.; Akin, Y.; Sigmund, W.; Hascicek, Y.S.","X-ray structure and microstructure determination of the mixed sesquioxides (Eu1-x Ybx)2 O3 prepared by a sol-gel process","Journal of Applied Crystallography","2003","36","","1411","1416","","","","","","","","","","","","","","","","","","","","","","has coordinates","156829","2020-10-21","18:00:00",""
"2300541","10.46596","","10.46596","","10.46596","","90","","90","","90","","1146.4","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","(Eu0.2 Yb1.8) O3","","- Eu0.2 O3 Yb1.8 -","- Eu0.2005 O3 Yb1.7995 -","- Eu3.208 O48 Yb28.792 -","16","0.333333","","Heiba, Z.K.; Hascicek, Y.S.; Akin, Y.; Sigmund, W.","X-ray structure and microstructure determination of the mixed sesquioxides (Eu1-x Ybx)2 O3 prepared by a sol-gel process","Journal of Applied Crystallography","2003","36","","1411","1416","","","","","","","","","","","","","","","","","","","","","","has coordinates","156832","2020-10-21","18:00:00",""
"2300542","10.42828","","10.42828","","10.42828","","90","","90","","90","","1134.06","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Yb2 O3","","- O3 Yb2 -","- O3 Yb2 -","- O48 Yb32 -","16","0.333333","","Heiba, Z.K.; Akin, Y.; Sigmund, W.; Hascicek, Y.S.","X-ray structure and microstructure determination of the mixed sesquioxides (Eu1-x Ybx)2 O3 prepared by a sol-gel process","Journal of Applied Crystallography","2003","36","","1411","1416","","","","","","","","","","","","","","","","","","","","","","has coordinates","156835","2020-10-21","18:00:00",""
"2310009","10.117","0.001","10.117","0.001","10.117","0.001","90","","90","","90","","1035.51","0.18","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Indium Oxide","","- In2 O3 -","- In2 O3 -","- In32 O48 -","16","0.333333","","Marezio, M.","Refinement of the crystal structure of In~2~O~3~ at two wavelengths","Acta Crystallographica","1966","66","6","723","728","10.1107/s0365110x66001749","","","","","","","","","","","","","","","","","","","","","has coordinates","200781","2020-10-21","18:00:00",""
"3000431","23.722","0.005","23.722","0.005","23.722","0.005","90","","90","","90","","13349","5","100","2","100","2","","","","","","","","5","I a -3","-I 2b 2c 3","","","","","- C66 H66 K4 O28 U2 -","","","","","","Wu, Jin-Cheng; Escudero-Adan, Eduardo C.; Martinez-Belmonte, Marta; de Mendoza, Javier","","To be published in Frontiers in Chemistry","","","","","","","","","0.71073","MoKα","","0.1184","0.0563","","","0.1277","0.1543","","","","","","1.127","","","","","280888","2023-02-14","13:42:28","2023-07-14"
"4000504","26.865","0.007","26.865","0.007","26.865","0.007","90","","90","","90","","19390","9","293","2","293","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C48 H48 N6 Nd3 O33 -","- C48 H17.88 N5.94 Nd3 O33 -","- C384 H143.04 N47.52 Nd24 O264 -","8","0.166667","","","","Chemistry of Materials","2005","","","","","10.1021/cm050526o","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"4000529","27.028","0.006","27.028","0.006","27.028","0.006","90","","90","","90","","19744","8","293","2","293","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C48 H50 N7 O35 Pr3 -","- C48 H6 N6.94 O35.02 Pr3 -","- C384 H48 N55.52 O280.16 Pr24 -","8","0.166667","","","","Chemistry of Materials","2005","","","","","10.1021/cm050526o","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"4004084","10.8113","0.0002","10.8113","0.0002","10.8113","0.0002","90","","90","","90","","1263.67","0.04","293","2","293","3","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Gd2 O3 -","- Gd2.00006 O3.00012 -","- Gd32.001 O48.0019 -","16","0.333333","","Delacotte, C.; Pomelova, T.A.; Stephant, T.; Guizouarn, T.; Cordier, S.; Naumov, N.G.; Lemoine, P.","'NaGdS2: a promising sulfide for cryogenic magnetic cooling'","Chemistry of Materials","2022","34","4","1829","1837","10.1021/acs.chemmater.1c04105","powder diffraction","","","X-ray","","","","","","","","","25.5494","","","","","","","","has coordinates","281154","2023-02-27","10:57:11",""
"4070959","26.6451","0.0009","26.6451","0.0009","26.6451","0.0009","90","","90","","90","","18917","1.1","173","2","173","2","","","","","","","synthesis as described","6","I a -3","-I 2b 2c 3","206","","","","- C91.5 H160.5 I0.5 K O14.5 Sm6 -","- C91.51 H48 I0.49 K O14.51 Sm6 -","- C732.08 H384 I3.92 K8 O116.08 Sm48 -","8","0.166667","","Summerscales, Owen T.; Johnston, David R.; Cloke, F. Geoffrey N.; Hitchcock, Peter B.","Samarium(III) Pentalene Sandwich Compounds [Sm(η8-C8H4{SiiPr3-1,4}2)(Cp*)] and [Sm(η8-C8H4{SiiPr3-1,4}2)(η5-C8H5{SiiPr3-1,4}2)] and a Mixed-Valence Hexasamarium Cluster Derived from Sm(II)-Based Solvent Activation","Organometallics","2008","27","21","5612","","10.1021/om701152k","","x-ray","0.71073","MoKα","","0.1054","0.0587","","","0.1365","0.16","","","","","","1.036","","","","has coordinates,has disorder","178598","2020-10-21","18:00:00",""
"4076316","31.7161","0.0005","31.7161","0.0005","31.7161","0.0005","90","","90","","90","","31903.6","0.9","153","2","153","2","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- C56 H66 Cl2 Cr2 N4 O -","- C56 H66 Cl2 Cr2 N4 O -","- C1344 H1584 Cl48 Cr48 N96 O24 -","24","0.5","","Conde-Guadano, Susana; Danopoulos, Andreas A.; Pattacini, Roberto; Hanton, Martin; Tooze, Robert P.","Indenyl Functionalized N-Heterocyclic Carbene Complexes of Chromium: Syntheses, Structures, and Reactivity Studies Relevant to Ethylene Oligomerization and Polymerization","Organometallics","2012","31","5","1643","","10.1021/om200641u","","","0.71073","MoKα","","0.2179","0.1354","","","0.2492","0.2844","","","","","","1.173","","","","has coordinates","271475","2021-12-16","11:44:41",""
"4082615","39.675","0.0007","39.675","0.0007","39.675","0.0007","90","","90","","90","","62452.6","1.9","150","2","150","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C48 H60 K N3 Si -","- C48 H60 K N3 Si -","- C2304 H2880 K48 N144 Si48 -","48","1","","Arrowsmith, Merle; Hill, Michael S.; Kociok-Köhn, Gabriele","Dearomatized BIAN Alkaline-Earth Alkyl Catalysts for the Intramolecular Hydroamination of Hindered Aminoalkenes","Organometallics","2014","33","1","206","","10.1021/om400955v","","","0.71073","MoKα","","0.1786","0.1001","","","0.2422","0.2848","","","","","","1.037","","","","has coordinates","270074","2021-10-24","17:53:43",""
"4105260","34.1837","0.0003","34.1837","0.0003","34.1837","0.0003","90","","90","","90","","39944.5","0.6","293","2","293","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C36 H88 Ge12 Nd8 O68 -","- C36 Ge12 Nd8 O54.98 -","- C576 Ge192 Nd128 O879.68 -","16","0.333333","","Huan He; Gao-Juan Cao; Shou-Tian Zheng; Guo-Yu Yang","Lanthanide Germanate Cluster Organic Frameworks Constructed from {Ln8Ge12} or {Ln11Ge12} Cage Cluster Building Blocks","Journal of the American Chemical Society","2009","131","","15588","15589","10.1021/ja906735v","","","0.71073","MoKα","","0.0556","0.0513","","","0.1438","0.1471","","","","","","1.093","","","","has coordinates","178798","2020-10-21","18:00:00",""
"4109146","24.756","0.004","24.756","0.004","24.756","0.004","90","","90","","90","","15172","4","238","","","","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C48 H36 Cd N16 O12 -","- C48 H36 Cd N12 O12 -","- C384 H288 Cd8 N96 O96 -","8","0.166667","","Shinpei Hasegawa; Satoshi Horike; Ryotaro Matsuda; Shuhei Furukawa; Katsunori Mochizuki; Yoshinori Kinoshita; Susumu Kitagawa","Three-Dimensional Porous Coordination Polymer Functionalized with Amide Groups Based on Tridentate Ligand: Selective Sorption and Catalysis","Journal of the American Chemical Society","2007","129","","2607","2614","10.1021/ja067374y","","","0.7107","MoKα","","","0.08","","","","0.216","","","","","","0.904","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4111646","22.541","0.005","22.541","0.005","22.541","0.005","90","0.005","90","0.005","90","0.005","11453","4","293","2","293","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C59 H63 N5 O17 Zn4 -","- C42 H24 N2 O13 Zn4 -","- C336 H192 N16 O104 Zn32 -","8","0.166667","","Eun Young Lee; Seung Yeon Jang; Myunghyun Paik Suh","Multifunctionality and Crystal Dynamics of a Highly Stable, Porous Metal-Organic Framework [Zn4O(NTB)2]","Journal of the American Chemical Society","2005","127","","6374","6381","10.1021/ja043756x","","","0.71073","MoKα","","0.1358","0.0898","","","0.2815","0.3019","","","","","","1.07","","","","has coordinates","213986","2020-10-21","18:00:00",""
"4111648","22.4509","0.0004","22.4509","0.0004","22.4509","0.0004","90","","90","","90","","11316.2","0.3","293","2","293","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C42 H24 N2 O13 Zn4 -","- C14 H8 N0.666667 O4.33333 Zn1.33333 -","- C336 H192 N16 O104 Zn32 -","24","0.5","","Eun Young Lee; Seung Yeon Jang; Myunghyun Paik Suh","Multifunctionality and Crystal Dynamics of a Highly Stable, Porous Metal-Organic Framework [Zn4O(NTB)2]","Journal of the American Chemical Society","2005","127","","6374","6381","10.1021/ja043756x","","","0.71073","MoKα","","0.1185","0.0823","","","0.2442","0.2854","","","","","","1.17","","","","has coordinates","178887","2020-10-21","18:00:00",""
"4111667","22.541","0.005","22.541","0.005","22.541","0.005","90","0.005","90","0.005","90","0.005","11453","4","293","2","293","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C59 H63 N5 O17 Zn4 -","- C48 H24 N5 O13 Zn4 -","- C384 H192 N40 O104 Zn32 -","8","0.166667","","Eun Young Lee; Seung Yeon Jang; Myunghyun Paik Suh","Multifunctionality and Crystal Dynamics of a Highly Stable, Porous Metal-Organic Framework [Zn4O(NTB)2]","Journal of the American Chemical Society","2005","127","","6374","6381","10.1021/ja043756x","","","0.71073","MoKα","","0.1605","0.0978","","","0.2775","0.3103","","","","","","1.102","","4111646","","has coordinates","215354","2020-10-21","18:00:00",""
"4117453","10.6513","0.0004","10.6513","","10.6513","","90","","90","","90","","1208.39","0.05","298","","298","","","","","","","","Syn","2","I a -3","-I 2b 2c 3","206","Neptunium nitride","Neptunium nitride","","- N3 Np2 -","- N3 Np2 -","- N48 Np32 -","16","0.333333","","G. W. Chinthaka Silva; Philippe F. Weck; Eunja Kim; Charles B. Yeamans; Gary S. Cerefice; Alfred P. Sattelberger; Kenneth R. Czerwinski","Crystal and Electronic Structures of Neptunium Nitrides Synthesized Using a Fluoride Route","Journal of the American Chemical Society","2012","134","","3111","3119","10.1021/ja209503n","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","0.04038","","0.93","","","","","","","has coordinates,has Fobs","178945","2020-10-21","18:00:00",""
"4117583","33.975","0.003","33.975","0.003","33.975","0.003","90","","90","","90","","39217","6","188","2","188","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C27.5 H26.5 In N1.5 O9.5 -","- C20 H10 In O8 -","- C960 H480 In48 O384 -","48","1","","Dorina F. Sava; Lauren E. S. Rohwer; Mark A. Rodriguez; Tina M. Nenoff","Intrinsic Broad-Band White-Light Emission by a Tuned, Corrugated Metal-Organic Framework","Journal of the American Chemical Society","2012","134","","3983","3986","10.1021/ja211230p","","","0.71073","MoKα","","0.1118","0.0691","","","0.2242","0.2664","","","","","","0.924","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4119630","22.573","0.005","22.573","0.005","22.573","0.005","90","0.005","90","0.005","90","0.005","11502","4","293","2","293","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","","","","- C24 Br F6 I6 -","- C24 Br F6 I6 -","- C192 Br8 F48 I48 -","8","0.166667","","Julien Lieffrig; Olivier Jeannin; Marc Fourmigué","Expanded Halogen-Bonded Anion Organic Networks with Star-Shaped Iodoethynyl-Substituted Molecules: From Corrugated 2D Hexagonal Lattices to Pyrite-Type 2-Fold Interpenetrated Cubic Lattices","Journal of the American Chemical Society","2013","135","","6200","6210","10.1021/ja400740v","","","0.71073","MoKα","","0.1167","0.0773","","","0.1902","0.2193","","","","","","1.173","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4123157","20.203","0.003","20.203","0.003","20.203","0.003","90","","90","","90","","8246","2","100","2","100","2","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- C31 H21 -","- C31 H21 -","- C496 H336 -","16","0.333333","","Mou, Zhongyu; Uchida, Kazuyuki; Kubo, Takashi; Kertesz, Miklos","Evidence of σ- and π-Dimerization in a Series of Phenalenyls.","Journal of the American Chemical Society","2014","","","141216073244005","","10.1021/ja509243p","","","0.71075","MoKα","","0.0466","0.041","","","0.1009","0.1042","","","","","","1.091","","","","has coordinates","179033","2020-10-21","18:00:00",""
"4123159","20.4186","0.0004","20.4186","0.0004","20.4186","0.0004","90","","90","","90","","8512.9","0.3","300","2","300","2","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- C31 H21 -","- C31 H21 -","- C496 H336 -","16","0.333333","","Mou, Zhongyu; Uchida, Kazuyuki; Kubo, Takashi; Kertesz, Miklos","Evidence of σ- and π-Dimerization in a Series of Phenalenyls.","Journal of the American Chemical Society","2014","","","141216073244005","","10.1021/ja509243p","","","0.71075","MoKα","","0.0655","0.057","","","0.174","0.1819","","","","","","1.178","","","","has coordinates","179033","2020-10-21","18:00:00",""
"4123446","25.9639","0.0007","25.9639","0.0007","25.9639","0.0007","90","","90","","90","","17502.9","0.8","296","2","296","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C54 H18 F12 O13 Zn4 -","- C54 H18 F12 O13 Zn4 -","- C432 H144 F96 O104 Zn32 -","8","0.166667","","Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M.","Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177.","Journal of the American Chemical Society","2015","137","7","2641","2650","10.1021/ja512311a","","","1.54178","CuKα","","0.1097","0.0978","","","0.3111","0.3259","","","","","","1.36","","","","has coordinates","179036","2020-10-21","18:00:00",""
"4124681","10.699","","10.699","","10.699","","90","","90","","90","","1224.7","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","U2 N3","","- N3 U2 -","- N3 U2 -","- N48 U32 -","16","0.333333","","Rundle, R.E.; Baenziger, N.C.; McDonald, R.A.; Wilson, A.S.","The structures of the carbides, nitrides and oxides of uranium","Journal of the American Chemical Society","1948","70","","99","105","","","","","","","","","","","","","","","","","","","","","","has coordinates","167805","2020-10-21","18:00:00",""
"4124688","11.03","","11.03","","11.03","","90","","90","","90","","1341.92","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Am2 O3 -","- Am2 O3 -","- Am32 O48 -","16","0.333333","","Templeton, D.H.; Dauben, C.H.","Crystal Structures of Americium Compounds","Journal of the American Chemical Society","1953","75","","4560","4562","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4128114","35.066","0.007","35.066","0.007","35.066","0.007","90","","90","","90","","43118","15","100","2","99.98","","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C55 H76.36 Co2 N8 O18.1 -","- C55 H76.36 Co2 N8 O18.106 -","- C1320 H1832.64 Co48 N192 O434.544 -","24","0.5","","Du, Kang; Thorarinsdottir, Agnes E.; Harris, T. David","Selective Binding and Quantitation of Calcium with a Cobalt-Based Magnetic Resonance Probe.","Journal of the American Chemical Society","2019","141","17","7163","7172","10.1021/jacs.9b02661","","","0.71073","MoKα","","0.1196","0.0805","","","0.2235","0.2755","","","","","","1.064","","","","has coordinates,has disorder","221244","2020-10-21","18:00:00",""
"4128115","34.793","0.003","34.793","0.003","34.793","0.003","90","","90","","90","","42119","6","100","2","100","","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- C52 H72 Co2 N9 Na2 O21 -","- C52 H72 Co2 N9 Na2 O21 -","- C1248 H1728 Co48 N216 Na48 O504 -","24","0.5","","Du, Kang; Thorarinsdottir, Agnes E.; Harris, T. David","Selective Binding and Quantitation of Calcium with a Cobalt-Based Magnetic Resonance Probe.","Journal of the American Chemical Society","2019","141","17","7163","7172","10.1021/jacs.9b02661","","","0.71073","MoKα","","0.1662","0.1523","","","0.4727","0.4885","","","","","","2.32","","","","has coordinates","221245","2020-10-21","18:00:00",""
"4133210","34.502","0.004","34.502","0.004","34.502","0.004","90","","90","","90","","41071","8","100","2","100","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","b-ZIF-65(Zn)","","","- C12 H8 N12 O8 Zn2 -","- C12 H8 N12 O8 Zn2 -","- C576 H384 N576 O384 Zn96 -","48","1","","Choi, Yejin; Noh, Kyungkyou; Lee, Jisu; Kim, Jaheon","Porosity Properties of the Conformers of Sodalite-like Zeolitic Imidazolate Frameworks.","Journal of the American Chemical Society","2018","140","44","14586","14589","10.1021/jacs.8b08997","","","0.61","synchrotron","","0.068","0.0467","","","0.1433","0.1499","","","","","","1.069","","","","has coordinates","243047","2020-10-21","18:00:00",""
"4133211","34.6372","0.0002","34.6372","0.0002","34.6372","0.0002","90","","90","","90","","41555.5","0.4","296","2","296","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C12 H8 N12 O8 Zn2 -","- C12 H8 N12 O8 Zn2 -","- C576 H384 N576 O384 Zn96 -","48","1","","Choi, Yejin; Noh, Kyungkyou; Lee, Jisu; Kim, Jaheon","Porosity Properties of the Conformers of Sodalite-like Zeolitic Imidazolate Frameworks.","Journal of the American Chemical Society","2018","140","44","14586","14589","10.1021/jacs.8b08997","","","0.71073","MoKα","","0.0828","0.0487","","","0.12","0.1391","","","","","","1.015","","","","has coordinates","243048","2020-10-21","18:00:00",""
"4133982","22.8962","0.00004","22.8962","0.00004","22.8962","0.00004","90","","90","","90","","12003","0.04","293","","293","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- Ga27 Rb8 Sb19 -","- Ga27 Rb8 Sb19 -","- Ga216 Rb64 Sb152 -","8","0.166667","","Owens-Baird, Bryan; Wang, Jian; Wang, Suyin Grass; Chen, Yu-Sheng; Lee, Shannon; Donadio, Davide; Kovnir, Kirill","III-V Clathrate Semiconductors with Outstanding Hole Mobility: Cs<sub>8</sub>In<sub>27</sub>Sb<sub>19</sub> and <i>A</i><sub>8</sub>Ga<sub>27</sub>Sb<sub>19</sub> (<i>A</i> = Cs, Rb).","Journal of the American Chemical Society","2020","142","4","2031","2041","10.1021/jacs.9b12351","powder diffraction","x-ray","0.41275","synchrotron","","0.0514","0.0426","","0.0508","0.0499","","","","1.32","","","","","","","has coordinates","247530","2020-10-21","18:00:00",""
"4133983","22.9497","0.0008","22.9497","0.0008","22.9497","0.0008","90","","90","","90","","12087.3","0.7","100","2","100","2","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- Cs8 Ga27 Sb19 -","- Cs8 Ga27 Sb19 -","- Cs64 Ga216 Sb152 -","8","0.166667","","Owens-Baird, Bryan; Wang, Jian; Wang, Suyin Grass; Chen, Yu-Sheng; Lee, Shannon; Donadio, Davide; Kovnir, Kirill","III-V Clathrate Semiconductors with Outstanding Hole Mobility: Cs<sub>8</sub>In<sub>27</sub>Sb<sub>19</sub> and <i>A</i><sub>8</sub>Ga<sub>27</sub>Sb<sub>19</sub> (<i>A</i> = Cs, Rb).","Journal of the American Chemical Society","2020","142","4","2031","2041","10.1021/jacs.9b12351","","","0.71073","MoKα","","0.1654","0.0715","","","0.1194","0.149","","","","","","1.031","","","","has coordinates","247530","2020-10-21","18:00:00",""
"4133984","24.462","0.0008","24.462","0.0008","24.462","0.0008","90","","90","","90","","14637.8","0.8","100","2","100","2","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- Cs8 In27 Sb19 -","- Cs8 In27 Sb19 -","- Cs64 In216 Sb152 -","8","0.166667","","Owens-Baird, Bryan; Wang, Jian; Wang, Suyin Grass; Chen, Yu-Sheng; Lee, Shannon; Donadio, Davide; Kovnir, Kirill","III-V Clathrate Semiconductors with Outstanding Hole Mobility: Cs<sub>8</sub>In<sub>27</sub>Sb<sub>19</sub> and <i>A</i><sub>8</sub>Ga<sub>27</sub>Sb<sub>19</sub> (<i>A</i> = Cs, Rb).","Journal of the American Chemical Society","2020","142","4","2031","2041","10.1021/jacs.9b12351","","","0.71073","MoKα","","0.0334","0.0241","","","0.0533","0.0588","","","","","","1.219","","","","has coordinates","247530","2020-10-21","18:00:00",""
"4133985","24.4593","0.0007","24.4593","0.0007","24.4593","0.0007","90","","90","","90","","14633","0.7","10","2","10","2","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- Cs8 In27 Sb19 -","- Cs8 In27 Sb19 -","- Cs64 In216 Sb152 -","8","0.166667","","Owens-Baird, Bryan; Wang, Jian; Wang, Suyin Grass; Chen, Yu-Sheng; Lee, Shannon; Donadio, Davide; Kovnir, Kirill","III-V Clathrate Semiconductors with Outstanding Hole Mobility: Cs<sub>8</sub>In<sub>27</sub>Sb<sub>19</sub> and <i>A</i><sub>8</sub>Ga<sub>27</sub>Sb<sub>19</sub> (<i>A</i> = Cs, Rb).","Journal of the American Chemical Society","2020","142","4","2031","2041","10.1021/jacs.9b12351","","","0.24797","synchrotron","","0.0134","0.0112","","","0.0331","0.0384","","","","","","1.193","","","","has coordinates","247530","2020-10-21","18:00:00",""
"4316019","32.631","0.004","32.631","0.004","32.631","0.004","90","","90","","90","","34745","7","291","2","293","2","","","","","","","","7","I a -3","-I 2b 2c 3","206","","","","- C60 H54 Cu3 Mo12 N12 O40 P -","- C60 H54 Cu3 Mo12 N12 O40 P -","- C960 H864 Cu48 Mo192 N192 O640 P16 -","16","0.333333","","Guangfeng Hou; Lihua Bi; Bao Li; Lixin Wu","Reaction Controlled Assemblies of Polyoxotungstates (-molybdates) and Coordination Polymers","Inorganic Chemistry","2010","49","","6474","6483","10.1021/ic1001495","","","0.71073","MoKα","","0.0605","0.0481","","","0.1246","0.1309","","","","","","1.186","","","","has coordinates","179240","2020-10-21","18:00:00",""
"4317272","39.854","0.002","39.854","0.002","39.854","0.002","90","","90","","90","","63302","6","293","2","293","2","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- C576 H1168 Ce12 N48 O332 S120 -","- C576 H1167.84 Ce12 N48 O332 S120 -","- C1152 H2335.68 Ce24 N96 O664 S240 -","2","0.0416667","","Yinfeng Han; Xiaoyan Li; Liqing Li; Chunlin Ma; Zhen Shen; You Song; Xiaozeng You","Structures and Properties of Porous Coordination Polymers Based on Lanthanide Carboxylate Building Units","Inorganic Chemistry","2010","49","","10781","10787","10.1021/ic902194g","","","0.71073","MoKα","","0.0831","0.0487","","","0.0863","0.0916","","","","","","1.084","","","","has coordinates","179252","2020-10-21","18:00:00",""
"4326666","9.8431","0.0004","9.8431","","9.8431","","90","","90","","90","","953.66","0.04","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- O3 Sc2 -","- O3 Sc2 -","- O48 Sc32 -","16","0.333333","","John P. S. Mowat; Stuart R. Miller; John M. Griffin; Valerie R. Seymour; Sharon E. Ashbrook; Stephen P. Thompson; David Fairen-Jimenez; Ana-Maria Banu; Tina Düren; Paul A. Wright","Structural Chemistry, monoclinic-to-orthorhombic Phase Transition, and CO2 Adsorption Behavior of the Small Pore Scandium Terephthalate, Sc2(O2CC6H4CO2)3, and Its Nitro- And Amino-Functionalized Derivatives","Inorganic Chemistry","2011","50","","10844","10858","10.1021/ic201387d","powder diffraction","x-ray","0.826019","","","","","","","","","0.19202","","4.91","","","","","","","has coordinates,has Fobs","179369","2020-10-21","18:00:00",""
"4326667","9.8545","0.0006","9.8545","","9.8545","","90","","90","","90","","956.98","0.06","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- O3 Sc2 -","- O3 Sc2 -","- O48 Sc32 -","16","0.333333","","John P. S. Mowat; Stuart R. Miller; John M. Griffin; Valerie R. Seymour; Sharon E. Ashbrook; Stephen P. Thompson; David Fairen-Jimenez; Ana-Maria Banu; Tina Düren; Paul A. Wright","Structural Chemistry, monoclinic-to-orthorhombic Phase Transition, and CO2 Adsorption Behavior of the Small Pore Scandium Terephthalate, Sc2(O2CC6H4CO2)3, and Its Nitro- And Amino-Functionalized Derivatives","Inorganic Chemistry","2011","50","","10844","10858","10.1021/ic201387d","powder diffraction","x-ray","1.54056","","","","","","","","","0.1462","","1.22","","","","","","","has coordinates,has Fobs","179369","2020-10-21","18:00:00",""
"4337109","22.9082","0.0003","22.9082","0.0003","22.9082","0.0003","90","","90","","90","","12021.9","0.3","100","2","100","2","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- C84 H48 N0 O30 P4 Zn6 -","- C84 H48 O30 P4 Zn6 -","- C336 H192 O120 P16 Zn24 -","4","0.0833333","","Li, Xing-Jun; Jiang, Fei-Long; Wu, Ming-Yan; Chen, Lian; Qian, Jin-Jie; Zhou, Kang; Yuan, Da-Qiang; Hong, Mao-Chun","Construction of Two Microporous Metal-Organic Frameworks with flu and pyr Topologies Based on Zn4(μ3-OH)2(CO2)6 and Zn6(μ6-O)(CO2)6 Secondary Building Units.","Inorganic chemistry","2014","53","2","1032","1038","10.1021/ic402481b","","","1.54184","CuKα","","0.127","0.0846","","","0.1808","0.1963","","","","","","1.005","","","","has coordinates,has disorder","179474","2020-10-21","18:00:00",""
"4341042","10.8876","0.00001","10.8876","0.00001","10.8876","0.00001","90","","90","","90","","1290.61","0.002","673","","673","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.9 Gd0.1 O1.95 -","- Ce0.9 Gd0.1 O1.947 -","- Ce28.8 Gd3.2 O62.304 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","1.4617","1.3898","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341043","10.90065","0.00001","10.90065","0.00001","10.90065","0.00001","90","","90","","90","","1295.26","0.002","773","","773","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.9 Gd0.1 O1.95 -","- Ce0.9 Gd0.1 O2 -","- Ce28.8 Gd3.2 O64 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","1.4144","1.53","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341044","10.91406","0.00001","10.91406","0.00001","10.91406","0.00001","90","","90","","90","","1300.05","0.002","873","","873","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.9 Gd0.1 O1.95 -","- Ce0.9 Gd0.1 O1.9665 -","- Ce28.8 Gd3.2 O62.928 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","1.0595","1.269","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341045","10.92744","0.00001","10.92744","0.00001","10.92744","0.00001","90","","90","","90","","1304.83","0.002","973","","973","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.9 Gd0.1 O1.95 -","- Ce0.9 Gd0.1 O2.895 -","- Ce28.8 Gd3.2 O92.64 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","1.1087","1.237","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341046","10.94174","0.00001","10.94174","0.00001","10.94174","0.00001","90","","90","","90","","1309.96","0.002","1073","","1073","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.9 Gd0.1 O1.95 -","- Ce0.9 Gd0.1 O1.986 -","- Ce28.8 Gd3.2 O63.552 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","1.4959","1.253","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341047","10.90557","0.00001","10.90557","0.00001","10.90557","0.00001","90","","90","","90","","1297.02","0.002","673","","673","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.7 Gd0.3 O1.85 -","- Ce0.7 Gd0.3 O1.8825 -","- Ce22.4 Gd9.6 O60.24 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","1.6782","1.254","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341048","10.91884","0.00001","10.91884","0.00001","10.91884","0.00001","90","","90","","90","","1301.76","0.002","773","","773","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.7 Gd0.3 O1.85 -","- Ce0.7 Gd0.3 O1.8585 -","- Ce22.4 Gd9.6 O59.472 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","1.6247","1.186","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341049","10.93237","0.00002","10.93237","0.00002","10.93237","0.00002","90","","90","","90","","1306.6","0.004","873","","873","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.7 Gd0.3 O1.85 -","- Ce0.7 Gd0.3 O1.869 -","- Ce22.4 Gd9.6 O59.808 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","1.3269","1.167","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341050","10.9459","0.00002","10.9459","0.00002","10.9459","0.00002","90","","90","","90","","1311.46","0.004","973","","973","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.7 Gd0.3 O1.85 -","- Ce0.7 Gd0.3 O1.8705 -","- Ce22.4 Gd9.6 O59.856 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","1.3799","1.165","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341051","10.96125","0.00002","10.96125","0.00002","10.96125","0.00002","90","","90","","90","","1316.98","0.004","1073","","1073","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.7 Gd0.3 O1.85 -","- Ce0.7 Gd0.3 O1.8645 -","- Ce22.4 Gd9.6 O59.664 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","1.3335","1.174","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341052","10.90602","0.00002","10.90602","0.00002","10.90602","0.00002","90","","90","","90","","1297.18","0.004","673","","673","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.5 Gd0.5 O1.75 -","- Ce0.5 Gd0.5 O1.81 -","- Ce16 Gd16 O57.92 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","3.4092","1.556","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341053","10.91813","0.00002","10.91813","0.00002","10.91813","0.00002","90","","90","","90","","1301.5","0.004","773","","773","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.5 Gd0.5 O1.75 -","- Ce0.5 Gd0.5 O1.839 -","- Ce16 Gd16 O58.848 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","3.795","1.759","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341054","10.93027","0.00002","10.93027","0.00002","10.93027","0.00002","90","","90","","90","","1305.85","0.004","873","","873","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.5 Gd0.5 O1.75 -","- Ce0.5 Gd0.5 O1.7985 -","- Ce16 Gd16 O57.552 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","2.5505","1.389","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341055","10.94266","0.00002","10.94266","0.00002","10.94266","0.00002","90","","90","","90","","1310.29","0.004","973","","973","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.5 Gd0.5 O1.75 -","- Ce0.5 Gd0.5 O1.8045 -","- Ce16 Gd16 O57.744 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","2.2788","1.334","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341056","10.95611","0.00002","10.95611","0.00002","10.95611","0.00002","90","","90","","90","","1315.13","0.004","1073","","1073","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.5 Gd0.5 O1.75 -","- Ce0.5 Gd0.5 O1.8 -","- Ce16 Gd16 O57.6 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","1.9816","1.293","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341057","10.89237","0.00002","10.89237","0.00002","10.89237","0.00002","90","","90","","90","","1292.31","0.004","673","","673","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.3 Gd0.7 O1.65 -","- Ce0.3 Gd0.7 O1.7085 -","- Ce9.6 Gd22.4 O54.672 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","2.8927","1.353","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341058","10.90326","0.00002","10.90326","0.00002","10.90326","0.00002","90","","90","","90","","1296.19","0.004","773","","773","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.3 Gd0.7 O1.65 -","- Ce0.3 Gd0.7 O1.713 -","- Ce9.6 Gd22.4 O54.816 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","2.6279","1.33","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341059","10.91433","0.00002","10.91433","0.00002","10.91433","0.00002","90","","90","","90","","1300.14","0.004","873","","873","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.3 Gd0.7 O1.65 -","- Ce0.3 Gd0.7 O1.713 -","- Ce9.6 Gd22.4 O54.816 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","2.5859","1.274","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341060","10.9252","0.00003","10.9252","0.00003","10.9252","0.00003","90","","90","","90","","1304.03","0.006","973","","973","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.3 Gd0.7 O1.65 -","- Ce0.3 Gd0.7 O1.7055 -","- Ce9.6 Gd22.4 O54.576 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","2.5947","1.268","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341061","10.9369","0.00003","10.9369","0.00003","10.9369","0.00003","90","","90","","90","","1308.23","0.006","1073","","1073","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Ce-Gd mixed oxide","","","- Ce0.3 Gd0.7 O1.65 -","- Ce0.3 Gd0.7 O1.6965 -","- Ce9.6 Gd22.4 O54.288 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Lausi, Andrea; Masini, Roberto; Costa, Giorgio A.","High Temperature Structural Study of Gd-Doped Ceria by Synchrotron X-ray Diffraction (673 K ≤ T ≤ 1073 K).","Inorganic chemistry","2014","53","19","10140","10149","10.1021/ic5011242","powder diffraction","","0.689","synchrotron","","","","","","","","","2.2681","1.219","","","","","","","has coordinates","179513","2020-10-21","18:00:00",""
"4341606","31.194","0.0001","31.194","0.0001","31.194","0.0001","90","","90","","90","","30353.8","0.17","173","2","173","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C18 H16 In N3 O8 -","- C18 H16 In N3 O8 -","- C864 H768 In48 N144 O384 -","48","1","","Qian, Jinjie; Jiang, Feilong; Su, Kongzhao; Li, Qipeng; Yuan, Daqiang; Hong, Maochun","Self-Assembly of Polyhedral Indium-Organic Nanocages.","Inorganic chemistry","2014","","","141113093006000","","10.1021/ic501728z","","","1.54184","CuKα","","0.0604","0.0502","","","0.1434","0.1516","","","","","","1.097","","","","has coordinates","179519","2020-10-21","18:00:00",""
"4343143","10.88937","0.00007","10.88937","0.00007","10.88937","0.00007","90","","90","","90","","1291.24","0.014","295","","295","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.7 O1.85 Sm0.3 -","- Ce0.7 O1.96329 Sm0.3 -","- Ce22.4 O62.8253 Sm9.6 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","2.7065","1.45","","","","","","","has coordinates","137918","2020-10-21","18:00:00",""
"4343144","10.89875","0.00006","10.89875","0.00006","10.89875","0.00006","90","","90","","90","","1294.58","0.012","298","","295","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.6 O1.8 Sm0.4 -","- Ce0.6 O1.88175 Sm0.4 -","- Ce19.2 O60.216 Sm12.8 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","3.6655","1.57","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343145","10.91198","0.00006","10.91198","0.00006","10.91198","0.00006","90","","90","","90","","1299.3","0.012","295","","295","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.5 O1.75 Sm0.5 -","- Ce0.5 O1.855 Sm0.5 -","- Ce16 O59.36 Sm16 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","8.7646","1.87","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343146","10.91514","0.00011","10.91514","0.00011","10.91514","0.00011","90","","90","","90","","1300.43","0.02","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.4 O1.7 Sm0.6 -","- Ce0.4 O1.7565 Sm0.6 -","- Ce12.8 O56.208 Sm19.2 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","5.7315","1.36","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343147","10.92623","0.00007","10.92623","0.00007","10.92623","0.00007","90","","90","","90","","1304.4","0.014","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.3 O1.65 Sm0.7 -","- Ce0.3 O1.71046 Sm0.7 -","- Ce9.6 O54.7349 Sm22.4 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","4.6119","1.41","","","","","","","has coordinates","137918","2020-10-21","18:00:00",""
"4343148","10.92917","0.00008","10.92917","0.00008","10.92917","0.00008","90","","90","","90","","1305.45","0.017","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.2 O1.6 Sm0.8 -","- Ce0.2 O1.68152 Sm0.8 -","- Ce6.4 O53.8085 Sm25.6 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","5.3179","1.53","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343149","10.9305","0.00013","10.9305","0.00013","10.9305","0.00013","90","","90","","90","","1305.93","0.03","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.1 O1.55 Sm0.9 -","- Ce0.1 O1.655 Sm0.9 -","- Ce3.2 O52.96 Sm28.8 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","4.4572","1.39","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343152","10.89286","0.00011","10.89286","0.00011","10.89286","0.00011","90","","90","","90","","1292.49","0.02","295","","295","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.7 O1.85 Sm0.3 -","- Ce0.7 O1.99 Sm0.3 -","- Ce22.4 O63.68 Sm9.6 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74963","","","","","","","","","","2.4967","1.77","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343153","10.90056","0.00005","10.90056","0.00005","10.90056","0.00005","90","","90","","90","","1295.23","0.01","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.6 O1.8 Sm0.4 -","- Ce0.6 O1.85777 Sm0.4 -","- Ce19.2 O59.4485 Sm12.8 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","4.4735","1.36","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343154","10.91683","0.00011","10.91683","0.00011","10.91683","0.00011","90","","90","","90","","1301.04","0.02","295","","295","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.5 O1.75 Sm0.5 -","- Ce0.5 O1.81 Sm0.5 -","- Ce16 O57.92 Sm16 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74963","","","","","","","","","","4.1364","1.46","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343155","10.9195","0.0002","10.9195","0.0002","10.9195","0.0002","90","","90","","90","","1301.99","0.04","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.4 O1.7 Sm0.6 -","- Ce0.4 O1.759 Sm0.6 -","- Ce12.8 O56.288 Sm19.2 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","5.2755","1.28","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343156","10.92913","0.00008","10.92913","0.00008","10.92913","0.00008","90","","90","","90","","1305.44","0.017","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.3 O1.65 Sm0.7 -","- Ce0.3 O1.65545 Sm0.7 -","- Ce9.6 O52.9742 Sm22.4 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","5.0052","1.28","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343157","10.93412","0.00005","10.93412","0.00005","10.93412","0.00005","90","","90","","90","","1307.23","0.01","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.2 O1.6 Sm0.8 -","- Ce0.2 O1.6415 Sm0.8 -","- Ce6.4 O52.528 Sm25.6 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","5.6079","1.92","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343158","10.9328","0.0004","10.9328","0.0004","10.9328","0.0004","90","","90","","90","","1306.76","0.08","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.1 O1.55 Sm0.9 -","- Ce0.1 O1.53 Sm0.9 -","- Ce3.2 O48.96 Sm28.8 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74923","","","","","","","","","","5.4643","1.26","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343159","10.93179","0.00005","10.93179","0.00005","10.93179","0.00005","90","","90","","90","","1306.39","0.01","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.2 O1.6 Sm0.8 -","- Ce0.2 O1.67 Sm0.8 -","- Ce6.4 O53.44 Sm25.6 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74963","","","","","","","","","","2.6945","1.35","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343160","10.9345","0.0003","10.9345","0.0003","10.9345","0.0003","90","","90","","90","","1307.36","0.06","298","","298","","","","","","","","","3","I a -3","-I 2b 2c 3","206","Cerium samarium mixed oxide","","","- Ce0.1 O1.55 Sm0.9 -","- Ce0.1 O1.6385 Sm0.9 -","- Ce3.2 O52.432 Sm28.8 -","32","0.666667","","Artini, Cristina; Pani, Marcella; Carnasciali, Maria Maddalena; Buscaglia, Maria Teresa; Plaisier, Jasper Rikkert; Costa, Giorgio Andrea","Structural Features of Sm- and Gd-Doped Ceria Studied by Synchrotron X-ray Diffraction and μ-Raman Spectroscopy.","Inorganic chemistry","2015","54","8","4126","4137","10.1021/acs.inorgchem.5b00395","powder diffraction","","0.74963","","","","","","","","","","5.0928","1.25","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4501030","40.059","0.005","40.059","0.005","40.059","0.005","90","","90","","90","","64284","14","100","2","100","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","Pentamanganese(II) decabutyrate dihydrate","Manganese(II) butyrate hydrate (0.4)","","- C40 H74 Mn5 O22 -","- C40 H74 Mn5 O22 -","- C1920 H3552 Mn240 O1056 -","48","1","","Martínez Casado, F. J.; Fabelo, O.; Rodríguez-Velamazán, J. A.; Ramos Riesco, M.; Rodríguez Cheda, J. A.; Labrador, A.; Rodríguez-Blanco, C.; Campo, J.; Sánchez-Alarcos, V.; Müller, H.","Manganese(II) Butyrate-Based MOFs: Structures, Thermal and Magnetic Properties","Crystal Growth & Design","2011","11","9","4080","","10.1021/cg200649n","","","0.7514","Synchrotron","","0.0351","0.0343","","","0.09","0.0905","","","","","","1.026","","","","has coordinates,has disorder","179541","2020-10-21","18:00:00",""
"4501031","40.58","0.005","40.58","0.005","40.58","0.005","90","","90","","90","","66825","14","298","2","298","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","Pentamanganese(II) decabutyrate dihydrate","Manganese(II) butyrate hydrate (0.4)","","- C40 H74 Mn5 O22 -","- C40 H74 Mn5 O22 -","- C1920 H3552 Mn240 O1056 -","48","1","","Martínez Casado, F. J.; Fabelo, O.; Rodríguez-Velamazán, J. A.; Ramos Riesco, M.; Rodríguez Cheda, J. A.; Labrador, A.; Rodríguez-Blanco, C.; Campo, J.; Sánchez-Alarcos, V.; Müller, H.","Manganese(II) Butyrate-Based MOFs: Structures, Thermal and Magnetic Properties","Crystal Growth & Design","2011","11","9","4080","","10.1021/cg200649n","","","0.7513","Synchrotron","","0.0424","0.0394","","","0.1109","0.1137","","","","","","1.006","","","","has coordinates,has disorder","179541","2020-10-21","18:00:00",""
"4501808","9.8349","0.0001","9.8349","0.0001","9.8349","0.0001","90","","90","","90","","951.283","0.017","296","2","296","2","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- O3 Sc2 -","- O3 Sc2 -","- O48 Sc32 -","16","0.333333","","Cong, Hengjiang; Zhang, Huaijin; Yao, Bin; Yu, Wentao; Zhao, Xian; Wang, Jiyang; Zhang, Guangcai","ScVO4: Explorations of Novel Crystalline Inorganic Optical Materials in Rare-Earth Orthovanadate Systems","Crystal Growth & Design","2010","10","10","4389","","10.1021/cg1004962","","","0.71073","MoKα","","0.0153","0.0146","","","0.0395","0.0436","","","","","","1.359","","","","has coordinates","176432","2020-10-21","18:00:00",""
"5910214","9.613","","9.613","","9.613","","90","","90","","90","","888.335","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- Ga Li3 N2 -","- Ga256 Li384 N128 -","- Ga256 Li384 N128 -","","","","Wyckoff, R. W. G.","Pages 57 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","57","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910218","9.48","","9.48","","9.48","","90","","90","","90","","851.971","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- Al Li3 N2 -","- Al128 Li384 N128 -","- Al128 Li384 N128 -","","","","Wyckoff, R. W. G.","Page 57 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","57","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"6000248","10.1394","","10.1394","","10.1394","","90","","90","","90","","1042.41","","","","","","","","","","","","","3","I a -3","","","","","","- N2 O Zr2 -","","","","","","Clarke, S. J.; Michie, C. W.; Rosseinsky, M. J.","Structure of Zr2ON2 by neutron powder diffraction: The absence of nitride-oxide ordering","Journal of Solid State Chemistry","1999","146","","399","405","10.1006/jssc.1999.8372","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"7005478","22.535","0.003","22.535","0.003","22.535","0.003","90","","90","","90","","11444","3","123","2","123","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","tetraethylammonium hexa(dicyanonitrosomethanido)cerate","tetraethylammonium hexa(dicyanonitrosomethanido)cerate","","- C42 H60 Ce N21 O6 -","- C42 H60 Ce N21 O6 -","- C336 H480 Ce8 N168 O48 -","8","0.166667","","Chesman, Anthony S. R.; Turner, David R.; Izgorodina, Ekaterina I.; Batten, Stuart R.; Deacon, Glen B.","Homoleptic 12-coordinate lanthanoids with eta(2)-nitroso ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1371","1373","10.1039/b702473h","","","0.71073","MoKα","","0.091","0.0303","","","0.0681","0.0863","","","","","","0.92","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005479","22.3927","0.0004","22.3927","0.0004","22.3927","0.0004","90","","90","","90","","11228.4","0.3","123","1","123","1","","","","","","","","5","I a -3","-I 2b 2c 3","206","tetraethylammonium hexa(dicyanonitrosomethanido)gadolinium(iii)","tetraethylammonium hexa(dicyanonitrosomethanido)gadolinium(III)","","- C42 H60 Gd N21 O6 -","- C42 H60 Gd N21 O6 -","- C336 H480 Gd8 N168 O48 -","8","0.166667","","Chesman, Anthony S. R.; Turner, David R.; Izgorodina, Ekaterina I.; Batten, Stuart R.; Deacon, Glen B.","Homoleptic 12-coordinate lanthanoids with eta(2)-nitroso ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1371","1373","10.1039/b702473h","","","0.71073","MoKα","","0.046","0.0261","","","0.058","0.0685","","","","","","1.027","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005480","22.5835","0.0001","22.5835","0.0001","22.5835","0.0001","90","","90","","90","","11517.9","0.09","123","2","123","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","tetraethylammonium (hexa(dicyanonitrosomethanido)lanthanate(iii))","tetraethylammonium [hexa(dicyanonitrosomethanido)lanthanate(III)]","","- C42 H60 La N21 O6 -","- C42 H60 La N21 O6 -","- C336 H480 La8 N168 O48 -","8","0.166667","","Chesman, Anthony S. R.; Turner, David R.; Izgorodina, Ekaterina I.; Batten, Stuart R.; Deacon, Glen B.","Homoleptic 12-coordinate lanthanoids with eta(2)-nitroso ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1371","1373","10.1039/b702473h","","","0.71073","MoKα","","0.0569","0.0374","","","0.0857","0.098","","","","","","1.062","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005481","22.4898","0.0003","22.4898","0.0003","22.4898","0.0003","90","","90","","90","","11375.1","0.3","123","2","123","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","tetraethylammonium hexa(dicyanonitrosomethanido)neodymiate(iii)","tetraethylammonium hexa(dicyanonitrosomethanido)neodymiate(III)","","- C42 H60 N21 Nd O6 -","- C42 H60 N21 Nd O6 -","- C336 H480 N168 Nd8 O48 -","8","0.166667","","Chesman, Anthony S. R.; Turner, David R.; Izgorodina, Ekaterina I.; Batten, Stuart R.; Deacon, Glen B.","Homoleptic 12-coordinate lanthanoids with eta(2)-nitroso ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1371","1373","10.1039/b702473h","","","0.71073","MoKα","","0.0414","0.0265","","","0.0525","0.0588","","","","","","1.063","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005612","22.1927","0.0017","22.1927","0.0017","22.1927","0.0017","90","","90","","90","","10930.3","1.5","295","2","295","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C42 H61 Fe6 N3 O20 -","- C42 H61 Fe6 N3 O20 -","- C336 H488 Fe48 N24 O160 -","8","0.166667","","Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano; Zazzaroni, Enrico","Synthesis and X-ray structure of the [{Fe3(CO)9(micro3-O)}2H]3- trianion: dimerization of a metal carbonyl cluster via formation of an exceptionally short hydrogen bond.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2644","2651","10.1039/b703628k","","","0.71073","MoKα","","0.0958","0.0505","","","0.0849","0.101","","","","","","1.012","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7021475","27.8099","0.0004","27.8099","0.0004","27.8099","0.0004","90","","90","","90","","21507.9","0.5","296","2","296","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C62 H122 Mn18 N12 O42 -","- C62.01 H122.01 Mn18 N12 O42.02 -","- C496.08 H976.08 Mn144 N96 O336.16 -","8","0.166667","","Zhou, Ai-Ju; Leng, Ji-Dong; Hu, Jin-Sheng; Tong, Ming-Liang","High symmetry superoctahedron cluster [Mn(III)18O14](26+) from the use of N,N,N',N'-tetrakis(2-hydroxyethyl)ethylenediamine.","Dalton transactions (Cambridge, England : 2003)","2013","42","26","9428","9431","10.1039/c3dt50695a","","","0.71073","MoKα","","0.1324","0.0852","","","0.2318","0.2703","","","","","","1.102","","","","has coordinates,has disorder","179919","2020-10-21","18:00:00",""
"7031582","22.308","0.002","22.308","0.002","22.308","0.002","90","","90","","90","","11101.5","1.7","160.15","","160.15","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","","","- C8 H4 Co O6 -","- C8 H4 Co O6 -","- C384 H192 Co48 O288 -","48","1","","Wang, Kai; Zou, Hua-Hong; Chen, Zi-Lu; Zhang, Zhong; Sun, Wei-Yin; Liang, Fu-Pei","A series of 3D metal organic frameworks based on [24-MC-6] metallacrown clusters: structure, magnetic and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2014","43","34","12989","","10.1039/c4dt01593b","","","0.71073","MoKα","","0.0549","0.0367","","","0.0961","0.1087","","","","","","1.0515","","","","has coordinates","180021","2020-10-21","18:00:00",""
"7031583","22.68","0.002","22.68","0.002","22.68","0.002","90","","90","","90","","11666.2","1.8","160.15","","160.15","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","","","- C8 H4 Mn O6 -","- C8 H4 Mn O6 -","- C384 H192 Mn48 O288 -","48","1","","Wang, Kai; Zou, Hua-Hong; Chen, Zi-Lu; Zhang, Zhong; Sun, Wei-Yin; Liang, Fu-Pei","A series of 3D metal organic frameworks based on [24-MC-6] metallacrown clusters: structure, magnetic and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2014","43","34","12989","","10.1039/c4dt01593b","","","0.71073","MoKα","","0.0583","0.0424","","","0.1255","0.1437","","","","","","1.187","","","","has coordinates","180021","2020-10-21","18:00:00",""
"7031584","22.9897","0.0018","22.9897","0.0018","22.9897","0.0018","90","","90","","90","","12150.7","1.6","160.15","","160.15","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","","","- C8 H4 Cd O6 -","- C8 H4 Cd O6 -","- C384 H192 Cd48 O288 -","48","1","","Wang, Kai; Zou, Hua-Hong; Chen, Zi-Lu; Zhang, Zhong; Sun, Wei-Yin; Liang, Fu-Pei","A series of 3D metal organic frameworks based on [24-MC-6] metallacrown clusters: structure, magnetic and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2014","43","34","12989","","10.1039/c4dt01593b","","","0.71073","MoKα","","0.0254","0.0241","","","0.0668","0.0685","","","","","","1.053","","","","has coordinates","180021","2020-10-21","18:00:00",""
"7031585","22.283","0.005","22.283","0.005","22.283","0.005","90","","90","","90","","11064","4","160.15","","160.15","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","Bruker APEX-II CCD","","- C48 H24 O37 Zn6 -","- C48 H24 O37 Zn6 -","- C384 H192 O296 Zn48 -","8","0.166667","","Wang, Kai; Zou, Hua-Hong; Chen, Zi-Lu; Zhang, Zhong; Sun, Wei-Yin; Liang, Fu-Pei","A series of 3D metal organic frameworks based on [24-MC-6] metallacrown clusters: structure, magnetic and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2014","43","34","12989","","10.1039/c4dt01593b","","","0.71073","MoKα","","0.0814","0.0436","","","0.0824","0.0969","","","","","","1.0098","","","","has coordinates","180021","2020-10-21","18:00:00",""
"7041474","27.0972","0.0002","27.0972","0.0002","27.0972","0.0002","90","","90","","90","","19896.3","0.3","100.01","0.1","100.01","0.1","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- C55 H52 Si3 -","- C55 H52 Si3 -","- C880 H832 Si48 -","16","0.333333","","Tomaschautzky, Janek; Neumann, Beate; Stammler, Hans-Georg; Mitzel, Norbert W.","Poly-Lewis-acids based on bowl-shaped tribenzotriquinacene.","Dalton transactions (Cambridge, England : 2003)","2017","46","4","1112","1123","10.1039/c6dt04350j","","x-ray","1.54184","CuKα","","0.1012","0.0866","","","0.2836","0.2981","","","","","","1.083","","","","has coordinates,has disorder","191615","2020-10-21","18:00:00",""
"7041765","41.2312","0.0007","41.2312","0.0007","41.2312","0.0007","90","","90","","90","","70094","2","173","0.14","173","0.14","","","","","","","","8","I a -3","-I 2b 2c 3","206","","","","- C162 H176 Cl3 Fe7 N18 O64 S6 Si12 -","- C162 H176 Cl3 Fe7 N18 O64.0004 S6 Si12 -","- C1296 H1408 Cl24 Fe56 N144 O512.003 S48 Si96 -","8","0.166667","","Shova, Sergiu; Cazacu, Maria; Novitchi, Ghenadie; Zoppellaro, Giorgio; Train, Cyrille; Arion, Vladimir B.","An iron(iii)-centred ferric wheel Fe⊂{Fe6} with a siloxane-based bis-salicylidene Schiff base.","Dalton transactions (Cambridge, England : 2003)","2017","46","6","1789","1793","10.1039/c7dt00141j","","","0.7107","MoKα","","0.296","0.1175","","","0.1572","0.1919","","","","","","1.248","","","","has coordinates,has disorder","193808","2020-10-21","18:00:00",""
"7047570","32.1011","0.0003","32.1011","0.0003","32.1011","0.0003","90","","90","","90","","33079.6","0.5","173","2","173.15","","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- C28 H34 Dy2 N10 Ni O14 -","- C28 H34 Dy2 N10 Ni O14 -","- C672 H816 Dy48 N240 Ni24 O336 -","24","0.5","","Feng, Dan-Dan; Dong, Hui-Ming; Liu, Zheng-Yu; Zhao, Xiao-Jun; Yang, En-Cui","Three microporous metal-organic frameworks assembled from dodecanuclear {NiLn} subunits: synthesis, structure, gas adsorption and magnetism.","Dalton transactions (Cambridge, England : 2003)","2018","47","43","15344","15352","10.1039/c8dt02816h","","","0.71073","MoKα","","0.0299","0.0208","","","0.0458","0.0493","","","","","","1.03","","","","has coordinates,has disorder","229439","2020-10-21","18:00:00",""
"7047571","32.2995","0.0005","32.2995","0.0005","32.2995","0.0005","90","","90","","90","","33696.7","0.9","173","2","173.15","","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- C28 H34 N10 Ni O14 Tb2 -","- C28 H34 N10 Ni O14 Tb2 -","- C672 H816 N240 Ni24 O336 Tb48 -","24","0.5","","Feng, Dan-Dan; Dong, Hui-Ming; Liu, Zheng-Yu; Zhao, Xiao-Jun; Yang, En-Cui","Three microporous metal-organic frameworks assembled from dodecanuclear {NiLn} subunits: synthesis, structure, gas adsorption and magnetism.","Dalton transactions (Cambridge, England : 2003)","2018","47","43","15344","15352","10.1039/c8dt02816h","","","0.71073","MoKα","","0.0373","0.0252","","","0.055","0.0608","","","","","","1.039","","","","has coordinates,has disorder","229439","2020-10-21","18:00:00",""
"7047572","32.6462","0.0005","32.6462","0.0005","32.6462","0.0005","90","","90","","90","","34793.5","0.9","173","0.1","173","0.1","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- C28 H34 Gd2 N10 Ni O14 -","- C28 H34 Gd2 N10 Ni O14 -","- C672 H816 Gd48 N240 Ni24 O336 -","24","0.5","","Feng, Dan-Dan; Dong, Hui-Ming; Liu, Zheng-Yu; Zhao, Xiao-Jun; Yang, En-Cui","Three microporous metal-organic frameworks assembled from dodecanuclear {NiLn} subunits: synthesis, structure, gas adsorption and magnetism.","Dalton transactions (Cambridge, England : 2003)","2018","47","43","15344","15352","10.1039/c8dt02816h","","x-ray","1.54184","CuKα","","0.0645","0.0432","","","0.109","0.1178","","","","","","1.022","","","","has coordinates,has disorder","229439","2020-10-21","18:00:00",""
"7100216","38.9497","0.0006","38.9497","0.0006","38.9497","0.0006","90","","90","","90","","59089.8","1.6","173","2","173","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C210 H474 N6 Ni24 O156 -","- C126 H234 N6 Ni24 O102 -","- C1008 H1872 N48 Ni192 O816 -","8","0.166667","","George Christou; Khalil Abboud; Dolos Foguet-Albiol","High-nuclearity homometallic iron and nickel clusters: Fe22 and Ni24 complexes from the use of N-methyldiethanolamine","Chemical Communications","2005","","","","","10.1039/b507748f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7108123","22.5597","0.0012","22.5597","0.0012","22.5597","0.0012","90","","90","","90","","11481.5","1.1","291","2","291","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C88 H58 N8 O53 Zn12 -","- C88 H58 N7.992 O53.0102 Zn12 -","- C352 H232 N31.968 O212.041 Zn48 -","4","0.0833333","","Jiehu Cui; Zhenzhong Lu; Yizhi Li; Zijian Guo; Hegen Zheng","A microporous metal-organic framework with FeS2 topology based on [Zn6(mu6-O)] cluster for reversible sensing of small molecules","Chem.Commun.","2012","48","","7967","","10.1039/c2cc34047j","","","0.71073","MoKα","","0.0446","0.0351","","","0.0843","0.0869","","","","","","1.062","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7108124","22.515","0.0009","22.515","0.0009","22.515","0.0009","90","","90","","90","","11413.4","0.8","291","2","291","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C88 H58 N8 O53 Zn12 -","- C88 H58 N8.0004 O53.0001 Zn12 -","- C352 H232 N32.0016 O212 Zn48 -","4","0.0833333","","Jiehu Cui; Zhenzhong Lu; Yizhi Li; Zijian Guo; Hegen Zheng","A microporous metal-organic framework with FeS2 topology based on [Zn6(mu6-O)] cluster for reversible sensing of small molecules","Chem.Commun.","2012","48","","7967","","10.1039/c2cc34047j","","","0.71073","MoKα","","0.0584","0.0398","","","0.1065","0.1123","","","","","","1.036","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7114782","23.6916","0.001","23.6916","0.001","23.6916","0.001","90","","90","","90","","13297.9","1","173","2","173","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C36 H18 F12 Ir N3 -","- C36 H18 F12 Ir N3 -","- C576 H288 F192 Ir16 N48 -","16","0.333333","","Grushin, Vladimir V.; Herron, Norman; LeCloux, Daniel D.; Marshall, William J.; Petrov, Viacheslav A.; Wang, Ying","New, efficient electroluminescent materials based on organometallic Ir complexes","Chemical Communications","2001","","16","1494","","10.1039/b103490c","","","0.71073","MoKα","","0.0404","0.0289","","","0.0714","0.0785","","","","","","1.017","","","","has coordinates","180261","2020-10-21","18:00:00",""
"7115114","30.806","0.0007","30.806","0.0007","30.806","0.0007","90","","90","","90","","29235.2","1.2","180","2","180","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C79 H74 N12 O Zn4 -","- C77.94 H66 N12 O Zn4 -","- C1247.04 H1056 N192 O16 Zn64 -","16","0.333333","","Davies, Robert P.; Linton, David J.; Snaith, Ronald; Wheatley, Andrew E. H.","Selective oxygen capture in lithium zincate chemistry: the syntheses and solid-state structures of (μ-O)Zn4[N(2-C5H4N)Bz]6 and But(μ3-O)Li3(μ6-O)Zn3[N(2-C5H4N)Me]6 (Bz = benzyl)","Chemical Communications","2000","","18","1819","","10.1039/b005238h","","","0.71069","MoKα","","0.1941","0.0849","","","0.1987","0.2608","","","","","","0.993","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7127903","13.4567","0.0003","13.4567","0.0003","13.4567","0.0003","90","","90","","90","","2436.78","0.09","293","2","293","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C24 K12 Mn4 Na4 O48 -","- C24 K12 Mn4 Na4 O48 -","- C48 K24 Mn8 Na8 O96 -","2","0.0416667","","He, Xiaolong; Zhang, Xinyuan; Ji, Bifa; Yao, Wenjiao; Lightfoot, Philip; Tang, Yongbing","Tilting and twisting in a novel perovzalate, K<sub>3</sub>NaMn(C<sub>2</sub>O<sub>4</sub>)<sub>3</sub>.","Chemical communications (Cambridge, England)","2021","57","20","2567","2570","10.1039/d1cc00085c","","","0.71073","MoKα","","0.0216","0.0209","","","0.0604","0.0608","","","","","","1.156","","","","has coordinates","263647","2021-04-05","14:01:54",""
"7132661","33.06","0.0002","33.06","0.0002","33.06","0.0002","90","","90","","90","","36133.4","0.4","130.15","","130.15","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","","","- C126 H102 N6 S6 -","- C126 H102 N6 S6 -","- C1008 H816 N48 S48 -","8","0.166667","","Yamamoto, Koji; Tsutsui, Kanta; Tanuma, Miho; Ito, Kaname; Wakamatsu, Kan; Yamamoto, Koji; Nakamura, Yosuke","Phenothiazine cyclic hexamers: synthesis, properties, and complexation behavior with C<sub>60</sub>.","Chemical communications (Cambridge, England)","2024","60","16","2220","2223","10.1039/d3cc06206f","","x-ray","0.71073","MoKα","","0.0679","0.0574","","","0.1837","0.1938","","","","","","1.093","","","","has coordinates","290085","2024-03-04","19:49:09",""
"7205917","10.6431","0.0002","10.6431","0.0002","10.6431","0.0002","90","","90","","90","","1205.6","0.04","298","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- O3 Y2 -","- O2.99994 Y1.99997 -","- O47.999 Y31.9995 -","16","0.333333","","Park, Woon Bae; Singh, Satendra Pal; Pyo, Myoungho; Sohn, Kee-Sun","Y6+x/3Si11−yAlyN20+x−yO1−x+y:Re3+ (Re = Ce3+, Tb3+, Sm3+) phosphors identified by solid-state combinatorial chemistry","Journal of Materials Chemistry","2011","21","15","5780","","10.1039/c0jm03538f","powder diffraction","","1.5493","Synchrotron","","","","","","","","","6.3456","","","","","","","","has coordinates","180390","2020-10-21","18:00:00",""
"7207236","18.673","0.003","18.673","0.003","18.673","0.003","90","","90","","90","","6510.9","1.8","118","2","118","2","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- C24 H18 Cu3 F9 N12 Si2 -","- C24 H18 Cu3 F9.04 N12 Si1.5 -","- C192 H144 Cu24 F72.32 N96 Si12 -","8","0.166667","","Maekawa, Masahiko; Tominaga, Toshi; Sugimoto, Kunihisa; Okubo, Takashi; Kuroda-Sowa, Takayoshi; Munakata, Megumu; Kitagawa, Susumu","Framework dimensionality of copper(i) coordination polymers of 4,4′-bipyrimidine controlled by anions and solvents","CrystEngComm","2012","14","4","1345","","10.1039/c1ce06328f","","","0.7107","MoKα","","0.0727","0.0726","","","0.1728","0.1729","","","","","","1.422","","","","has coordinates","180403","2020-10-21","18:00:00",""
"7210195","27.618","0.003","27.618","0.003","27.618","0.003","90","","90","","90","","21066","4","296","2","296","2","","","","","","","","7","I a -3","-I 2b 2c 3","206","","","","- C12 H76 B18 Cu3 N9 O73.5 V12 -","- C12 H45 B18 Cu3 N9 O73.5 V12 -","- C96 H360 B144 Cu24 N72 O588 V96 -","8","0.166667","","Zhou, Jian; Liu, Xing; Chen, Rong; Xiao, Hong-Ping; Hu, Feilong; Zou, Huahong; Zhou, Yun; Liu, Chun; Zhu, Ligang","New 3-D polyoxovanadoborate architectures based on [V12B18O60]16− clusters","CrystEngComm","2013","15","25","5057","","10.1039/c3ce40428e","","","0.71073","MoKα","","0.0901","0.0559","","","0.1488","0.1888","","","","","","1.181","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7219499","52.623","0.003","52.623","0.003","52.623","0.003","90","","90","","90","","145723","14","173","2","173","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C58 H45.33 N2 O36.17 Zn8 -","- C58 H21 N2 O36.1667 Zn8 -","- C2784 H1008 N96 O1736 Zn384 -","48","1","","Bai, Shizhe; Zhang, Weiquan; Ling, Yun; Yang, Feilong; Deng, Mingli; Chen, Zhenxia; Weng, Linhong; Zhou, Yaming","Predicting and creating 7-connected Zn4O vertices for the construction of an exceptional metal‒organic framework with nanoscale cages","CrystEngComm","2015","17","9","1923","","10.1039/C4CE02415J","","","0.71073","MoKα","","0.1423","0.086","","","0.2331","0.3012","","","","","","1.096","","","","has coordinates","180525","2020-10-21","18:00:00",""
"7220441","23.3664","0.0003","23.3664","0.0003","23.3664","0.0003","90","","90","","90","","12757.8","0.3","173","2","173","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C78 H48 O14 P2 Zn3 -","- C78 H48 O14 P2 Zn3 -","- C624 H384 O112 P16 Zn24 -","8","0.166667","","Yang, Yan-Yan; Lin, Zu-Jin; Liang, Jun; Huang, Yuanbiao; Cao, Rong","Coordination polymers constructed from a tripodal phosphoryl carboxylate ligand: synthesis, structures and physical properties","CrystEngComm","2015","17","24","4547","","10.1039/C5CE00430F","","","1.54184","CuKα","","0.0867","0.0703","","","0.2264","0.2576","","","","","","1.065","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7220442","23.7697","0.0004","23.7697","0.0004","23.7697","0.0004","90","","90","","90","","13429.8","0.4","173","2","173","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C78 H48 Cd3 O14 P2 -","- C78 H48 Cd3 O14 P2 -","- C624 H384 Cd24 O112 P16 -","8","0.166667","","Yang, Yan-Yan; Lin, Zu-Jin; Liang, Jun; Huang, Yuanbiao; Cao, Rong","Coordination polymers constructed from a tripodal phosphoryl carboxylate ligand: synthesis, structures and physical properties","CrystEngComm","2015","17","24","4547","","10.1039/C5CE00430F","","","1.54184","CuKα","","0.1314","0.0967","","","0.2967","0.338","","","","","","1.174","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7220443","23.3991","0.0004","23.3991","0.0004","23.3991","0.0004","90","","90","","90","","12811.4","0.4","173","2","173","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C78 H48 Co3 O14 P2 -","- C78 H48 Co3 O14 P2 -","- C624 H384 Co24 O112 P16 -","8","0.166667","","Yang, Yan-Yan; Lin, Zu-Jin; Liang, Jun; Huang, Yuanbiao; Cao, Rong","Coordination polymers constructed from a tripodal phosphoryl carboxylate ligand: synthesis, structures and physical properties","CrystEngComm","2015","17","24","4547","","10.1039/C5CE00430F","","","1.54184","CuKα","","0.1747","0.0892","","","0.27","0.325","","","","","","1.056","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7222775","8.14518","","8.14518","","8.14518","","90","","90","","90","","540.383","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Be3 N2 -","- Be3 N2 -","- Be48 N32 -","16","0.333333","","Reckeweg, O.; Lind, C.; Simon, A.; DiSalvo, F.J.","Rietveld refinement of the crystal structure of alpha-(Be3 N2) and the experimental determination of optical band gaps for Mg3 N2, Ca3 N2 and Ca Mg2 N2","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2003","58","","159","162","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7223895","27.0059","0.0007","27.0059","0.0007","27.0059","0.0007","90","","90","","90","","19695.9","0.9","150","2","150","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C31 H43 La N6 O14 -","- C20 H14 La N2 O10 -","- C480 H336 La24 N48 O240 -","24","0.5","","Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M. Fátima C.; Paul, Anup; Pombeiro, Armando J. L.","Nanoporous lanthanide metal‒organic frameworks as efficient heterogeneous catalysts for the Henry reaction","CrystEngComm","2016","18","8","1337","","10.1039/C5CE01456E","","","0.71073","MoKα","","0.0844","0.0648","","","0.1907","0.223","","","","","","1.049","","","","has coordinates,has disorder","177751","2020-10-21","18:00:00",""
"7223896","26.921","0.002","26.921","0.002","26.921","0.002","90","","90","","90","","19511","3","150","2","150","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C29 H36 Ce N5 O13 -","- C20 H14 Ce N2 O10 -","- C480 H336 Ce24 N48 O240 -","24","0.5","","Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M. Fátima C.; Paul, Anup; Pombeiro, Armando J. L.","Nanoporous lanthanide metal‒organic frameworks as efficient heterogeneous catalysts for the Henry reaction","CrystEngComm","2016","18","8","1337","","10.1039/C5CE01456E","","","0.71073","MoKα","","0.0588","0.0496","","","0.1343","0.1456","","","","","","1.073","","","","has coordinates,has disorder","177751","2020-10-21","18:00:00",""
"7223897","26.681","0.003","26.681","0.003","26.681","0.003","90","","90","","90","","18994","4","150","2","150","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C23 H24 N5 O13 Sm -","- C20 H14 N2 O10 Sm -","- C480 H336 N48 O240 Sm24 -","24","0.5","","Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M. Fátima C.; Paul, Anup; Pombeiro, Armando J. L.","Nanoporous lanthanide metal‒organic frameworks as efficient heterogeneous catalysts for the Henry reaction","CrystEngComm","2016","18","8","1337","","10.1039/C5CE01456E","","","0.71073","MoKα","","0.0741","0.0452","","","0.1152","0.1283","","","","","","1.025","","","","has coordinates,has disorder","177751","2020-10-21","18:00:00",""
"7232612","30.375","0.004","30.375","0.004","30.375","0.004","90","","90","","90","","28025","6","293","2","293","2","","","","","","","","7","I a -3","-I 2b 2c 3","206","","","","- C54 H66 Cd3 N42 O92 P2 W24 -","- C54 H42 Cd3 N42 O86 P2 W24 -","- C432 H336 Cd24 N336 O688 P16 W192 -","8","0.166667","","Wu, Yingying; Li, Xuefei; Liu, Ying; Xiao, Ge; Huang, Yijiao; Li, Yamin; Dang, Dongbin; Bai, Yan","Three novel polyoxometalate-based inorganic‒organic hybrid materials based on 2,6-bis(1,2,4-triazol-1-yl)pyridine","RSC Advances","2019","9","21","11932","","10.1039/C9RA01451A","","","0.71073","MoKα","","0.092","0.092","","","0.1887","0.1887","","","","","","1.232","","","","has coordinates","214664","2020-10-21","18:00:00",""
"7237046","10.9585","0.0005","10.9585","0.0005","10.9585","0.0005","90","","90","","90","","1315.99","0.1","296","2","296","2","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- O8 Te3 Ti -","- O8 Te3 Ti -","- O64 Te24 Ti8 -","8","0.166667","","Lu, Weiqun; Gao, Zeliang; Wu, Qian; Tian, Xiangxin; Sun, Youxuan; Liu, Yang; Tao, Xutang","Tailored fabrication of a prospective acousto‒optic crystal TiTe3O8 endowed with high performance","Journal of Materials Chemistry C","2018","6","10","2443","","10.1039/C7TC05382G","","","0.71073","MoKα","","0.0108","0.0108","","","0.0287","0.0287","","","","","","1.343","","","","has coordinates","236734","2020-10-21","18:00:00",""
"7238588","22.766","0.0006","22.766","0.0006","22.766","0.0006","90","","90","","90","","11799.4","0.5","200","","200","","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- Cl3 Co H18 N6 O12 -","- Cl3 Co N6 O12 -","- Cl96 Co32 N192 O384 -","32","0.666667","","Górska, Natalia; Inaba, Akira; Hirao, Yasukazu; Mikuli, Edward; Hołderna-Natkaniec, Krystyna","Structure, molecular motion, and phase transition of a highly disordered crystal [Co(NH3)6](ClO4)3","RSC Advances","2012","2","10","4283","","10.1039/c2ra01184k","","","0.71075","MoKα","","0.0968","0.0957","","","0.2778","0.2785","","","","","","1.181","","","","has coordinates","244245","2020-10-21","18:00:00",""
"7241462","26.912","0.002","26.912","","26.912","","90","","90","","90","","19491.2","1.4","296","2","296","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","","","","- C16 H19 O15 Pr -","- C16 H6 O15 Pr -","- C384 H144 O360 Pr24 -","24","0.5","","Wang, Jinzeng; Suffren, Yan; Daiguebonne, Carole; Bernot, Kevin; Calvez, Guillaume; Freslon, Stéphane; Guillou, Olivier","Lanthanide-based molecular alloys with hydroxyterephthalate: a versatile system","CrystEngComm","2021","23","1","100","118","10.1039/D0CE00947D","","x-ray","0.71073","MoKα","","0.1372","0.1222","","","0.3309","0.4051","","","","","","1.955","","","","has coordinates","261588","2021-02-04","22:55:25",""
"7246283","11.285","0.003","11.285","","11.285","","90","","90","","90","","1437.2","0.4","273","2","273","2","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- Hf O8 Te3 -","- Hf O8 Te3 -","- Hf8 O64 Te24 -","8","0.166667","","Lv, Junai; Li, Qi; Guan, Xin; Lin, Na; Zhang, Jian; Jia, Zhitai; Tao, Xutang","Shedding light on intrinsic characteristics and optical properties of novel selenite and tellurite crystals ZrSe2O6, HfSe2O6 and HfTe3O8","CrystEngComm","2023","25","11","1675","1682","10.1039/D2CE01627C","","","0.71073","MoKa","","0.0198","0.0182","","","0.0475","0.0481","","","","","","1.206","","","","has coordinates","282331","2023-04-04","10:14:47",""
"7248368","26.013","0.0002","26.013","0.0002","26.013","0.0002","90","","90","","90","","17602.4","0.2","150","","150","","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- Fe H30 Mo12 Na3 O55.5 U -","- Fe Mo12 Na3 O55.5 U -","- Fe16 Mo192 Na48 O888 U16 -","16","0.333333","","Li, Ke; Liu, Yufeng; Yang, Guo-Ping; Zheng, Zhijian; Lin, Xiao-Ling; Zhang, Zhibin; Li, Shujun; Liu, Yunhai; Wei, Yongge","Highly-Stable Silverton-Type UIV-Containing Polyoxomolybdates Frameworks for the Heterogeneous Catalytic Synthesis of Quinazolinones","Green Chemistry","2024","","","","","10.1039/D4GC00877D","","","0.71073","MoKα","","0.0235","0.0218","","","0.0506","0.0513","","","","","","1.128","","","","has coordinates,has disorder","290742","2024-04-02","23:50:48",""
"7248370","25.9609","0.0003","25.9609","0.0003","25.9609","0.0003","90","","90","","90","","17496.8","0.4","150","","150","","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- Co H29.4 Mo12 Na3.6 O55.5 U -","- Co Mo12 Na3.6 O55.5 U -","- Co16 Mo192 Na57.6 O888 U16 -","16","0.333333","","Li, Ke; Liu, Yufeng; Yang, Guo-Ping; Zheng, Zhijian; Lin, Xiao-Ling; Zhang, Zhibin; Li, Shujun; Liu, Yunhai; Wei, Yongge","Highly-Stable Silverton-Type UIV-Containing Polyoxomolybdates Frameworks for the Heterogeneous Catalytic Synthesis of Quinazolinones","Green Chemistry","2024","","","","","10.1039/D4GC00877D","","","0.71073","MoKα","","0.0289","0.0235","","","0.053","0.0549","","","","","","1.131","","","","has coordinates,has disorder","290742","2024-04-02","23:50:49",""
"7248371","25.9532","0.0008","25.9532","0.0008","25.9532","0.0008","90","","90","","90","","17481.3","0.9","100","","100","","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- H29.7 Mo12 Na3.3 Ni0.58 O55.5 U -","- Mo12 Na3.3 Ni0.576 O55.5 U -","- Mo192 Na52.8 Ni9.216 O888 U16 -","16","0.333333","","Li, Ke; Liu, Yufeng; Yang, Guo-Ping; Zheng, Zhijian; Lin, Xiao-Ling; Zhang, Zhibin; Li, Shujun; Liu, Yunhai; Wei, Yongge","Highly-Stable Silverton-Type UIV-Containing Polyoxomolybdates Frameworks for the Heterogeneous Catalytic Synthesis of Quinazolinones","Green Chemistry","2024","","","","","10.1039/D4GC00877D","","x-ray","0.71073","MoKα","","0.0249","0.0231","","","0.0599","0.0608","","","","","","1.126","","","","has coordinates,has disorder","290742","2024-04-02","23:50:49",""
"8100418","11.308","0.001","11.308","0.001","11.308","0.001","90","","90","","90","","1446","0.2","293","2","293","2","","","","","","","","3","I a -3","-I 2b 2c 3","206","Zirconium tritellurate (IV)","","","- O8 Te3 Zr -","- O8 Te3 Zr -","- O64 Te24 Zr8 -","8","0.166667","","Noguera, Olivier; Thomas, Philippe; Masson, Olivier; Champarnaud-Mesjard, Jean-Claude","Refinement of the crystal structure of zirconium tritellurate(IV), ZrTe~3~O~8~","Zeitschrift für Kristallographie - New Crystal Structures","2003","218","3","293","294","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101057","9.5464","0.0006","9.5464","0.0006","9.5464","0.0006","90","","90","","90","","870","0.09","298","2","298","2","","","","","","","","4","I a -3","-I 2b 2c 3","206","","","","- Cu2 Ni O6 Te -","- Cu2.01 Ni0.99 O6 Te -","- Cu16.08 Ni7.92 O48 Te8 -","8","0.166667","","Wedel, Boris; Kimio, Itagaki; Sugiyama, Kazumasa","Crystal structure of dicopper nickel hexaoxotellurate, Cu~2~NiTeO~6~","Zeitschrift für Kristallographie - New Crystal Structures","2001","216","3","323","324","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8103497","9.41","","9.41","","9.41","","90","","90","","90","","833.238","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Dimanganese Trioxide","","- Mn2 O3 -","- Mn2 O3 -","- Mn32 O48 -","16","0.333333","","Klein, H.","Structure solution of oxides from zone axes precession electron diffraction data","Zeitschrift für Kristallographie - Crystalline Materials","2013","228","1","35","42","10.1524/zkri.2012.1568","","","","","","","","","","","","","","","","","","","","","has coordinates","174965","2020-10-21","18:00:00",""
"8104259","10.543","","10.543","","10.543","","90","","90","","90","","1171.91","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Tl2 O3","","- O3 Tl2 -","- O3 Tl2 -","- O48 Tl32 -","16","0.333333","","Papamantellos, P.","Verfeinerung der Tl2 O3 -Struktur mittels Neutronenbeugung","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1968","126","","143","146","","","","","","","","","","","","","","","","","","","","","","has coordinates","167011","2020-10-21","18:00:00",""
"9004537","11.011","","11.011","","11.011","","90","","90","","90","","1335","","","","","","","","","","","","Wendy Open Pit, El Indio-Tambo Mining Property, Chile","5","I a -3","-I 2b 2c 3","206","","","Walfordite","- Fe0.59 Mg0.05 O8 Te3.28 Ti0.08 -","- Fe0.59 Mg0.05 O8 Te3.28 Ti0.08 -","- Fe4.72 Mg0.4 O64 Te26.24 Ti0.64 -","8","0.166667","","Back, M. E.; Grice, J. D.; Gault, R. A.; Criddle, A. J.; Mandarino, J. A.","Walforite, a new tellurite species from the Wendy Open Pit, El Indio-Tambo Mining Property, Chile","The Canadian Mineralogist","1999","37","","1261","1268","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004829","10.965","","10.965","","10.965","","90","","90","","90","","1318.33","","","","","","","","","","","","Grand Central Mine, Tombstone, Arizona","3","I a -3","-I 2b 2c 3","206","","","Winstanleyite","- O8 Te3 Ti -","- O8 Te3 Ti -","- O64 Te24 Ti8 -","8","0.166667","","Bindi, L.; Cipriani, C.","The crystal structure of winstanleyite, TiTe3O8, from the Grand Central Mine, Tombstone, Arizona","The Canadian Mineralogist","2003","41","6","1469","1473","10.2113/gscanmin.41.6.1469","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9007521","9.4146","","9.4146","","9.4146","","90","","90","","90","","834.46","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","Bixbyite","- Fe0.034 Mn1.966 O3 -","- Fe0.034 Mn1.966 O3 -","- Fe0.544 Mn31.456 O48 -","16","0.333333","","Geller, S.","Structures of alpha-Mn203, (MnO.983Fe0.017)203 and (Mn0.37Fe0.63)2O3 and relation to magnetic ordering Sample: (MnO.983Fe0.017)203","Acta Crystallographica, Section B","1971","27","","821","828","10.1107/S0567740871002966","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007522","9.4126","","9.4126","","9.4126","","90","","90","","90","","833.928","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","Bixbyite","- Fe1.26 Mn0.74 O3 -","- Fe1.26 Mn0.74 O3 -","- Fe20.16 Mn11.84 O48 -","16","0.333333","","Geller, S.","Structures of alpha-Mn203, (MnO.983Fe0.017)203 and (Mn0.37Fe0.63)2O3 and relation to magnetic ordering Sample: (Mn0.37Fe0.63)2O3","Acta Crystallographica, Section B","1971","27","","821","828","10.1107/S0567740871002966","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9008068","9.4","","9.4","","9.4","","90","","90","","90","","830.584","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","Bixbyite","- Fe Mn O3 -","- Fe Mn O3 -","- Fe16 Mn16 O48 -","16","0.333333","","Dachs, H.","Die kristallstruktur des bixbyits (Fe,Mn)2O3","Zeitschrift fur Kristallographie","1956","107","","370","395","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008121","9.81","","9.81","","9.81","","90","","90","","90","","944.076","","","","","","","","","","","","Synthetic","2","I a -3","-I 2b 2c 3","206","","","Kangite","- O3 Sc2 -","- O3 Sc2 -","- O48 Sc32 -","16","0.333333","","Geller, S.; Romo, P.; Remeika, J. P.","Refinement of the structure of scandium sesquioxide","Zeitschrift fur Kristallographie","1967","124","","136","142","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9009222","10.5344","","10.5344","","10.5344","","90","","90","","90","","1169.04","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","Avicennite","- O3 Tl2 -","- O3 Tl2 -","- O48 Tl32 -","16","0.333333","","Otto, H. H.; Baltrusch, R.; Brant, H. J.","Further evidence for Tl3+ in Tl-based superconductors from improved bond strength parameters involving new structural data of cubic Tl2O3","Physica C","1993","215","","205","208","10.1016/0921-4534(93)90382-Z","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:30",""
"9009876","10.032","","10.032","","10.032","","90","","90","","90","","1009.63","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- F6 O2 Pt -","- F6 O1.99998 Pt -","- F48 O15.9998 Pt8 -","8","0.166667","","Ibers, J. A.; Hamilton, W. C.","Crystal structure of O2PtF6: A neutron-diffraction study","Journal of Chemical Physics","1966","44","","1748","1752","10.1063/1.1726934","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9011056","6.636","","6.636","","6.636","","90","","90","","90","","292.226","","","","","","","","","","","","Synthetic","1","I a -3","-I 2b 2c 3","206","","","Silicon","- Si -","- Si -","- Si16 -","16","0.333333","","Kasper, J. S.; Richards, S. M.","The crystal structures of new forms of silicon and germanium","Acta Crystallographica","1964","17","","752","755","10.1107/S0365110X64001840","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9016919","9.842","","9.842","","9.842","","90","","90","","90","","953.345","","","","","","","","","","","","Allende meteorite","13","I a -3","-I 2b 2c 3","206","","","Kangite","- Al0.16 Ca0.06 Dy0.01 Er0.01 Fe0.02 Gd0.01 Mg0.11 O3 Sc0.54 Ti0.66 V0.03 Y0.07 Zr0.13 -","- Al2.56 Ca0.96 Dy0.16 Er0.16 Fe0.32 Gd0.16 Mg1.76 O48 Sc8.64 Ti10.56 V0.48 Y1.12 Zr2.08 -","- Al2.56 Ca0.96 Dy0.16 Er0.16 Fe0.32 Gd0.16 Mg1.76 O48 Sc8.64 Ti10.56 V0.48 Y1.12 Zr2.08 -","","","","Ma, C.; Tschauner, O.; Beckett, J. R.; Rossman, G. R.; Liu, W.","Kangite, (Sc,Ti,Al,Zr,Mg,Ca,[_])2O3, a new ultra-refractory scandia mineral from the Allende meteorite: Synchrotron micro-Laue diffraction and electron backscatter diffraction Note: x-coordinate of Sc2, and coordinates of O atoms are changed by personal email with authors May 2013","American Mineralogist","2013","98","","870","878","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:48:16",""