# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-07T10:21:11+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'I -4 m 2' 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
"1011075","4.92","","4.92","","11.64","","90","","90","","90","","281.8","","","","","","","","","","","","synthetic","2","I -4 m 2","I -4 -2","119","","Dimercury(I) iodide","Moschelite","- Hg2 I2 -","- Hg2 I2 -","- Hg4 I4 -","2","0.125","","Huggins, M L; Magill, P L","The crystal stuctures of mercuric and mercurous iodides","Journal of the American Chemical Society","1927","49","","2357","2367","10.1021/ja01409a003","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1509091","4.43","","4.43","","5.986","","90","","90","","90","","117.475","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","Silver gallium telluride (0.32/0.56/1)","","- Ag0.317 Ga0.561 Te -","- Ag0.317 Ga0.561 Te -","- Ag0.634 Ga1.122 Te2 -","2","0.125","","Jaulmes, S.; Guittard, M.; Mazurier, A.","Caracterisation et etude structurale d'un nouveau tellurure double d'argent et de gallium Ag0.317 Ga0.561 (vac)0.122 Te","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie 2 (1984-1993)","1984","299","","861","863","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509281","10.243","","10.243","","6.168","","90","","90","","90","","647.141","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","Cs Ag O","","- Ag Cs O -","- Ag Cs O -","- Ag8 Cs8 O8 -","8","0.5","","Losert, W.; Hoppe, R.","Zur Kenntnis der K4 (Ag4 O4) - Verwandtschaft","Zeitschrift fuer Anorganische und Allgemeine Chemie","1985","524","","7","16","10.1002/zaac.19855240502","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509422","9.893","","9.893","","5.445","","90","","90","","90","","532.91","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","K Ag O","","- Ag K O -","- Ag K O -","- Ag8 K8 O8 -","8","0.5","","Hoppe, R.; Klassen, H.","Die K4 (Ag4 O4) - Strukturfamilie","Zeitschrift fuer Anorganische und Allgemeine Chemie","1982","485","","101","114","10.1002/zaac.19824850110","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509473","9.52","","9.52","","4.599","","90","","90","","90","","416.809","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","Na Ag O","","- Ag Na O -","- Ag Na O -","- Ag8 Na8 O8 -","8","0.5","","Losert, W.; Hoppe, R.","Zur Kenntnis der K4 (Ag4 O4) - Verwandtschaft","Zeitschrift fuer Anorganische und Allgemeine Chemie","1985","524","","7","16","10.1002/zaac.19855240502","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509489","10.086","","10.086","","5.792","","90","","90","","90","","589.205","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","Rb Ag O","","- Ag O Rb -","- Ag O Rb -","- Ag8 O8 Rb8 -","8","0.5","","Hoppe, R.; Losert, W.","Zur Kenntnis der K4 (Ag4 O4) - Verwandtschaft","Zeitschrift fuer Anorganische und Allgemeine Chemie","1985","524","","7","16","10.1002/zaac.19855240502","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509558","3.92","","3.92","","15.22","","90","","90","","90","","233.877","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","Ag Tl Te2","","- Ag Te2 Tl -","- Ag Te2 Tl -","- Ag2 Te4 Tl2 -","2","0.125","","Pinsker, Z.G.; Imamov, R.M.","Electron diffraction study of the semiconducting compound Ag Tl Te2","Kristallografiya","1964","9","","743","747","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1521520","16.31799","","16.31799","","38.54199","","90","","90","","90","","10262.8","","","","","","","","","","","","","2","I -4 m 2","I -4 -2","119","","Bi2.938 Nb O7","","- Bi2.9375 Nb -","- Bi2.9375 Nb -","- Bi94 Nb32 -","32","2","","Ling, C.D.","Structural relationships among bismuth-rich phases in the (Bi2 O3)-(Nb2 O5), (Bi2 O3)-(Ta2 O5), (Bi2 O3-Mo O3), and (Bi2 O3)-(W O3) systems","Journal of Solid State Chemistry","1999","148","","380","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1523230","6.278","","6.278","","14.799","","90","","90","","90","","583.277","","","","","","","","","","","","","2","I -4 m 2","I -4 -2","119","","","","- Ga3 K -","- Ga3 K -","- Ga18 K6 -","6","0.375","","Belin, C.; Rong Guoling","Preparation et structure cristalline du compose intermetallique K Ga3","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie 2 (-1983)","1982","294","","1083","1086","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1524224","7.047","","7.047","","16.803","","90","","90","","90","","834.44","","","","","","","","","","","","","2","I -4 m 2","I -4 -2","119","","","","- Cs In3 -","- Cs In3 -","- Cs6 In18 -","6","0.375","","Chuntonov, K.A.; Grin', Yu.; Yatsenko, S.P.; Orlov, A.N.; Yarmolyuk, Ya.P.","Die Kristallstruktur von Cs In3","Journal of the Less-Common Metals","1984","99","","15","21","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1524922","8.904","","8.904","","19.21","","90","","90","","90","","1522.99","","","","","","","","","","","","","2","I -4 m 2","I -4 -2","119","","","","- Cu4 La -","- Cu4 La -","- Cu72 La18 -","18","1.125","","Meyer-Liautaud, F.; Allibert, C.; Moreau, J.M.","New phases in the system La-Cu","Journal of the Less-Common Metals","1985","110","","81","90","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525427","5.229","","5.229","","11.013","","90","","90","","90","","301.122","","","","","","","","","","","","","4","I -4 m 2","I -4 -2","119","","Li2 Ca U F8","","- Ca F8 Li2 U -","- Ca F8 Li2 U -","- Ca2 F16 Li4 U2 -","2","0.125","","Vedrine, A.; Trottier, D.; Cousseins, J.C.; Chevalier, R.","Crystal structure of Li2 Ca U F8","Materials Research Bulletin","1979","14","","583","587","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525490","6.91","","6.91","","16.512","","90","","90","","90","","788.417","","","","","","","","","","","","","2","I -4 m 2","I -4 -2","119","","","","- Cs2 In3 -","- Cs2 In3 -","- Cs8 In12 -","4","0.25","","Yatsenko, S.P.; Chuntonov, K.A.; Grin', Yu.; Orlov, A.N.; Yarmolyuk, Ya.P.","Kristallstruktur von Cs2 In3","Journal of the Less-Common Metals","1985","108","","339","343","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525535","6.393","","6.393","","15.829","","90","","90","","90","","646.938","","","","","","","","","","","","","2","I -4 m 2","I -4 -2","119","","","","- Cs Ga3 -","- Cs Ga3 -","- Cs6 Ga18 -","6","0.375","","van Vucht, J.H.N.","On the crystal structures of some compounds of gallium with potassium, rubidium and cesium","Journal of the Less-Common Metals","1985","108","","163","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526072","22.255","","22.255","","10.386","","90","","90","","90","","5144.03","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","Cu47.18 Si91.22 P144","","- Cu47.18 P144 Si91.22 -","- Cu47.176 P144 Si91.224 -","- Cu47.176 P144 Si91.224 -","1","0.0625","","Mozharivsky, Yu.; Lang, O.; Franzen, H.F.","Modulated crystal structure and electronic properties of semiconductor Cu47 Si91 P144","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","2153","2160","","","","","","","","","","","","","","","","","","","","","","has coordinates","147178","2020-10-21","18:00:00",""
"1526279","5.171","","5.171","","13.371","","90","","90","","90","","357.53","","","","","","","","","","","","","2","I -4 m 2","I -4 -2","119","","Re3 O10","","- O10 Re3 -","- O10 Re3 -","- O20 Re6 -","2","0.125","","Hartmann, T.; Fuess, H.; Miehe, G.; Ehrenberg, H.; Wltschek, G.; Buhrmester, T.; Galy, J.","Preparation and crystal structure of Re3 O10","Journal of Solid State Chemistry","2001","160","","317","321","","","","","","","","","","","","","","","","","","","","","","has coordinates","147422","2020-10-21","18:00:00",""
"1528002","7.208","","7.208","","11.393","","90","","90","","90","","591.926","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","","","- Fe4.4 Ni17.6 Se16 -","- Fe4.4 Ni17.6 Se16 -","- Fe4.4 Ni17.6 Se16 -","1","0.0625","","Rost, E.; Haugsten, K.","The crystal structure of (Fex Ni1-x)22 Se16","Acta Chemica Scandinavica (1-27,1973-42,1988)","1969","23","","1601","1606","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1529096","11.2362","","11.2362","","8.6084","","90","","90","","90","","1086.83","","","","","","","","","","","","","6","I -4 m 2","I -4 -2","119","","Cd (Zr Sr (C2 O4)4) (H2 O)6","","- C8 H12 Cd O22 Sr Zr -","- C8 H8 Cd O22 Sr Zr -","- C16 H16 Cd2 O44 Sr2 Zr2 -","2","0.125","","Audebrand, N.; Bataille, T.; Jeanneau, E.; Raite, S.; Louer, D.","A family of microporous mixed oxalates with isotypic-framework structures based on eight-coordinate metals","Solid State Sciences","2004","6","","579","591","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529099","11.2558","","11.2558","","8.4288","","90","","90","","90","","1067.87","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","Ca2 Zr (C2 O4)4 (H2 O)5.5","","- Ca2 O20 Zr -","- Ca2 O20 Zr -","- Ca4 O40 Zr2 -","2","0.125","","Audebrand, N.; Jeanneau, E.; Louer, D.; Bataille, T.; Raite, S.","A family of microporous mixed oxalates with isotypic-framework structures based on eight-coordinate metals","Solid State Sciences","2004","6","","579","591","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532445","3.974","","3.974","","5.506","","90","","90","","90","","86.954","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","","","- Cu0.24 Ga1.61 Se2 -","- Cu0.24 Ga1.61 Se2 -","- Cu0.24 Ga1.61 Se2 -","1","0.0625","","Zmii, O.F.; Kadykalo, E.M.; Strok, O.M.; Olekseyuk, I.D.","The crystal structure of the Cu0.24 Ga1.61 (vac)0.15 Se2 phase","Ukrains'kii Khimicheskii Zhurnal (Russian Edition)","2001","67","","33","35","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1534051","11.52156","","11.52156","","38.5603","","90","","90","","90","","5118.74","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","","","- Bi94 Nb32 O221 -","- Bi94 Nb32 O221.024 -","- Bi94 Nb32 O221.024 -","1","0.0625","","Ling, C.D.; Johnson, M.","Modelling, refinement and analysis of the ""Type III"" delta-(Bi2 O3)-related superstructure in the (Bi2 O3) - (Nb2 O5) system","Journal of Solid State Chemistry","2004","177","","1838","1846","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1535000","13.8354","","13.8354","","9.8893","","90","","90","","90","","1892.99","","","","","","","","","","","","","5","I -4 m 2","I -4 -2","119","","Rb5 K Sn5 Zn4 S17","","- K Rb5 S17 Sn5 Zn4 -","- K Rb5.04 S17 Sn5 Zn4 -","- K2 Rb10.08 S34 Sn10 Zn8 -","2","0.125","","Manos, M.J.; Iyer, R.G.; Quarez, E.; Liao, J.H.; Kanatzidis, M.G.","{Sn [Zn4 Sn4 S17]}(6-): A robust open framework based on metal-linked penta-supertetrahedral [Zn4 Sn4 S17](10-) clusters with ion-exchange properties","Angew. Chem. Int. ed.","2005","44","","3552","3555","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535581","9.912","","9.912","","5.456","","90","","90","","90","","536.04","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","K Ag O","","- Ag K O -","- Ag K O -","- Ag8 K8 O8 -","8","0.5","","Hoppe, R.","Neues ueber ""Kationen-reiche"" Oxide der Alkalimetalle","Revue de Chimie Minerale","1983","20","","549","575","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535585","9.35","","9.35","","5.44","","90","","90","","90","","475.578","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","K Cu O","","- Cu K O -","- Cu K O -","- Cu8 K8 O8 -","8","0.5","","Hoppe, R.","Neues ueber ""Kationen-reiche"" Oxide der Alkalimetalle","Revue de Chimie Minerale","1983","20","","549","575","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540242","4.386","","4.386","","8.661","","90","","90","","90","","166.612","","","","","","","","","","","","","2","I -4 m 2","I -4 -2","119","","Nb N","","- N0.77 Nb -","- N0.77 Nb -","- N6.16 Nb8 -","8","0.5","","Kim, S.-J.; Franzen, H.F.","A powder X-ray diffraction and Landau theory investigation of the cubic to tetragonal phase transition in Nb N1-x","Journal of the Less-Common Metals","1988","143","","339","343","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540311","20.073","","20.073","","13.403","","90","","90","","90","","5400.41","","","","","","","","","","","","","5","I -4 m 2","I -4 -2","119","","Na1.68 H6.32 (Ga8 Si88 O192)","","- Ga8 H6.32 Na1.68 O192 Si88 -","- Ga7.9968 Na1.68 O192 Si88.0032 -","- Ga7.9968 Na1.68 O192 Si88.0032 -","1","0.0625","","Liu, X.; Liang, J.; Lin, B.; Wei, C.","Study on the structure of GaZSM-11 zeolite","Cuihua Xuebao","1990","11","","196","203","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541697","20.12","","20.12","","13.44","","90","","90","","90","","5440.71","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","Na8 (Al8 Si88 O192) (H2 O)16","","- Al7.9968 O192 Si88.0032 -","- Al7.9968 O192 Si88.0032 -","- Al7.9968 O192 Si88.0032 -","1","0.0625","","Kokotailo, G.T.; Meier, W.M.; Chu, P.A.; Lawton, S.L.","Synthesis and structure of synthetic zeolite ZSM-11","Nature (London)","1978","275","","119","1120","","","","","","","","","","","","","","","","","","","","","","has coordinates","173127","2020-10-21","18:00:00",""
"1541880","21.638","","21.638","","11.209","","90","","90","","90","","5248.09","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","(Ga2.67 Ge1.33 S8) (C6 H14 N2 O)","","- Ga2.668 Ge1.332 S8 -","- Ga2.668 Ge1.332 S8 -","- Ga21.344 Ge10.656 S64 -","8","0.5","","Zheng Nanfeng; Bu Xianhui; Wang Bing; Feng Pingyun","Microporous and photoluminescent chalcogenide zeolite analogs","Science","2002","298","","2366","2369","","","","","","","","","","","","","","","","","","","","","","has coordinates","173439","2020-10-21","18:00:00",""
"1541881","22.153","","22.153","","11.3435","","90","","90","","90","","5566.88","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","(In1.84 Ge2.16 S8) (C6 H14 N2 O)","","- Ge2.12 In1.88 S8 -","- Ge2.12 In1.88 S8 -","- Ge16.96 In15.04 S64 -","8","0.5","","Zheng Nanfeng; Feng Pingyun; Bu Xianhui; Wang Bing","Microporous and photoluminescent chalcogenide zeolite analogs","Science","2002","298","","2366","2369","","","","","","","","","","","","","","","","","","","","","","has coordinates","173440","2020-10-21","18:00:00",""
"1541882","22.169","","22.169","","11.3168","","90","","90","","90","","5561.81","","","","","","","","","","","","","3","I -4 m 2","I -4 -2","119","","(Ga2.4 Sn1.6 S8) (C6 H14 N2 O)","","- Ga2.402 S8 Sn1.598 -","- Ga2.402 S8 Sn1.598 -","- Ga19.216 S64 Sn12.784 -","8","0.5","","Zheng Nanfeng; Bu Xianhui; Feng Pingyun; Wang Bing","Microporous and photoluminescent chalcogenide zeolite analogs","Science","2002","298","","2366","2369","","","","","","","","","","","","","","","","","","","","","","has coordinates","173441","2020-10-21","18:00:00",""
"1571099","7.1046","0.0002","7.1046","0.0002","10.8768","0.0005","90","","90","","90","","549.01","0.03","293","","293","","0.096","","","","","","synthesised in the lab","5","I -4 m 2","I -4 -2","119","CsCuCo","cesium copper hexacyanocobaltate","","- C5.7 Co0.95 Cs0.857 Cu N5.7 -","- C5.7 Co0.95 Cs0.857 Cu N5.7 -","- C11.4 Co1.9 Cs1.714 Cu2 N11.4 -","2","0.125","","Boström, Hanna L B; Cairns, Andrew B.; Chen, Muzi; Daisenberger, Dominik; Ridley, Christopher J.; Funnell, Nicholas P.","The pressure response of Jahn-Teller-distorted Prussian blue analogues.","Chemical science","2024","15","9","3155","3164","10.1039/d3sc06912e","powder diffraction","","0.3757","synchrotron","","","","","","","","","2.37304","0.14728","","","","","","","has coordinates","290046","2024-03-04","02:10:27",""
"4101529","13.8184","0.0004","13.8184","0.0004","10.0456","0.0007","90","","90","","90","","1918.19","0.16","293","2","293","2","","","","","","","","8","I -4 m 2","I -4 -2","119","","","","- Cs H10.84 K N2.71 Rb1.29 S17 Sn5 Zn4 -","- Cs K N2.72 Rb1.292 S17 Sn5 Zn4 -","- Cs2 K2 N5.44 Rb2.584 S34 Sn10 Zn8 -","2","0.125","","Manos, Manolis J; Chrissafis, Konstantinos; Kanatzidis, Mercouri G","Unique pore selectivity for Cs+ and exceptionally high NH4+ exchange capacity of the chalcogenide material K6Sn[Zn4Sn4S17].","Journal of the American Chemical Society","2006","128","27","8875","8883","10.1021/ja061342t","","","0.71073","MoKα","","0.0642","0.0468","","","0.0825","0.0888","","","","","","1.041","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101530","13.829","0.005","13.829","0.005","9.81","0.007","90","","90","","90","","1876","1.5","293","2","293","2","","","","","","","","6","I -4 m 2","I -4 -2","119","","","","- H5.64 K4.59 N1.41 S17 Sn5 Zn4 -","- K4.6 N1.4 S17 Sn5 Zn4 -","- K9.2 N2.8 S34 Sn10 Zn8 -","2","0.125","","Manos, Manolis J; Chrissafis, Konstantinos; Kanatzidis, Mercouri G","Unique pore selectivity for Cs+ and exceptionally high NH4+ exchange capacity of the chalcogenide material K6Sn[Zn4Sn4S17].","Journal of the American Chemical Society","2006","128","27","8875","8883","10.1021/ja061342t","","","0.71073","MoKα","","0.102","0.0685","","","0.1326","0.1634","","","","","","1.078","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101531","13.8142","0.0009","13.8142","0.0009","9.6824","0.0012","90","","90","","90","","1847.7","0.3","293","2","293","2","","","","","","","","6","I -4 m 2","I -4 -2","119","","","","- H4 K5 N S17 Sn5 Zn4 -","- H4 K5 N S17 Sn5 Zn4 -","- H8 K10 N2 S34 Sn10 Zn8 -","2","0.125","","Manos, Manolis J; Chrissafis, Konstantinos; Kanatzidis, Mercouri G","Unique pore selectivity for Cs+ and exceptionally high NH4+ exchange capacity of the chalcogenide material K6Sn[Zn4Sn4S17].","Journal of the American Chemical Society","2006","128","27","8875","8883","10.1021/ja061342t","","","0.71073","MoKα","","0.0719","0.0554","","","0.1239","0.1451","","","","","","1.151","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101532","13.843","0.002","13.843","0.002","9.69","0.003","90","","90","","90","","1856.8","0.7","293","2","293","2","","","","","","","","5","I -4 m 2","I -4 -2","119","","","","- Cs K5 S17 Sn5 Zn4 -","- Cs K5 S17 Sn5 Zn4 -","- Cs2 K10 S34 Sn10 Zn8 -","2","0.125","","Manos, Manolis J; Chrissafis, Konstantinos; Kanatzidis, Mercouri G","Unique pore selectivity for Cs+ and exceptionally high NH4+ exchange capacity of the chalcogenide material K6Sn[Zn4Sn4S17].","Journal of the American Chemical Society","2006","128","27","8875","8883","10.1021/ja061342t","","","0.71073","MoKα","","0.0726","0.0682","","","0.1795","0.1817","","","","","","1.274","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4101533","13.8455","0.0006","13.8455","0.0006","10.0731","0.0009","90","","90","","90","","1931","0.2","293","2","293","2","","","","","","","","6","I -4 m 2","I -4 -2","119","","","","- H20 K N5 S17 Sn5 Zn4 -","- K1.04 N5 S17 Sn5 Zn4 -","- K2.08 N10 S34 Sn10 Zn8 -","2","0.125","","Manos, Manolis J; Chrissafis, Konstantinos; Kanatzidis, Mercouri G","Unique pore selectivity for Cs+ and exceptionally high NH4+ exchange capacity of the chalcogenide material K6Sn[Zn4Sn4S17].","Journal of the American Chemical Society","2006","128","27","8875","8883","10.1021/ja061342t","","","0.71073","MoKα","","0.0272","0.0243","","","0.0786","0.0799","","","","","","1.207","","","","has coordinates","178761","2020-10-21","18:00:00",""
"4124645","20.067","","20.067","","13.411","","90","","90","","90","","5400.4","","","","","","","","","","","","","2","I -4 m 2","I -4 -2","119","","Si O2","","- O2 Si -","- O2 Si -","- O192 Si96 -","96","6","","Fyfe, C.A.; Strobl, H.; Gies, H.; Kokotailo, G.T.; Pasztor, C.; Cox, D.E.","Detailed investigation of the lattice structure of zeolite ZSM-11 by a combination of solid-state NMR and synchroton x-ray diffraction","Journal of the American Chemical Society","1989","111","","2470","2474","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4132805","15.6389","0.0003","15.6389","","13.9429","0.0004","90","","90","","90","","3410.09","0.12","100","2","100","2","","","","","","","","5","I -4 m 2","I -4 -2","119","","","","- C12.5 H10.5 N5.5 O5.5 Zn -","- C11 H7 N5 O5 Zn -","- C88 H56 N40 O40 Zn8 -","8","0.5","","Xu, Li-Li; Zhang, Hai-Feng; Li, Mian; Ng, Seik Weng; Feng, Jiang-He; Mao, Jiang-Gao; Li, Dan","Chiroptical Activity from an Achiral Biological Metal-Organic Framework.","Journal of the American Chemical Society","2018","140","37","11569","11572","10.1021/jacs.8b06725","","","1.54184","CuKα","","0.0536","0.0535","","","0.1449","0.1449","","","","","","1.059","","","","has coordinates,has disorder","242706","2020-10-21","18:00:00",""
"4132807","15.6362","0.0001","15.6362","","13.9515","0.0001","90","","90","","90","","3411.01","0.03","100","2","100","2","","","","","","","","5","I -4 m 2","I -4 -2","119","","","","- C12.5 H10.5 N5.5 O5.5 Zn -","- C11 H7 N5 O5 Zn -","- C88 H56 N40 O40 Zn8 -","8","0.5","","Xu, Li-Li; Zhang, Hai-Feng; Li, Mian; Ng, Seik Weng; Feng, Jiang-He; Mao, Jiang-Gao; Li, Dan","Chiroptical Activity from an Achiral Biological Metal-Organic Framework.","Journal of the American Chemical Society","2018","140","37","11569","11572","10.1021/jacs.8b06725","","","1.54184","CuKα","","0.0279","0.0279","","","0.0792","0.0792","","","","","","1.026","","","","has coordinates,has disorder","242708","2020-10-21","18:00:00",""
"4300965","14.2649","0.0004","14.2649","0.0004","11.3575","0.0005","90","","90","","90","","2311.1","0.1","","","","","","","","","","","","5","I -4 m 2","I -4 -2","119","","","","- H8 Na12 Nb14 O46 Si -","- Nb28 Ne32 O84 Si2 -","- Nb28 Ne32 O84 Si2 -","","","","Bonhomme, François; Larentzos, James P.; Alam, Todd M.; Maginn, Edward J.; Nyman, May","Synthesis, Structural Characterization, and Molecular Modeling of Dodecaniobate Keggin Chain Materials","Inorganic Chemistry","2005","44","6","1774","1785","10.1021/ic048847+","","","","","","","","","","","","","","","","","","","","","has coordinates","277859","2022-09-15","00:05:26",""
"4300966","14.2701","0.0005","14.2701","0.0005","11.2923","0.0007","90","","90","","90","","2299.5","0.2","","","","","","","","","","","","6","I -4 m 2","I -4 -2","119","","","","- H8 Na12 Nb12 O46 Si Ti2 -","- Nb24 Ne32 O84 Si2 Ti4 -","- Nb24 Ne32 O84 Si2 Ti4 -","","","","Bonhomme, François; Larentzos, James P.; Alam, Todd M.; Maginn, Edward J.; Nyman, May","Synthesis, Structural Characterization, and Molecular Modeling of Dodecaniobate Keggin Chain Materials","Inorganic Chemistry","2005","44","6","1774","1785","10.1021/ic048847+","","","","","","","","","","","","","","","","","","","","","has coordinates","277859","2022-09-15","00:05:26",""
"4305260","7.8793","0.0003","7.8793","0.0003","24.9955","0.0015","90","","90","","90","","1551.8","0.13","293","2","293","2","","","","","","","","6","I -4 m 2","I -4 -2","119","(dienH2)Cu2Sn2S6","(C4N3H15)Cu2Sn2S6","","- C4 H15 Cu2 N3 S6 Sn2 -","- C4 H15 Cu2 N3 S6 Sn2 -","- C16 H60 Cu8 N12 S24 Sn8 -","4","0.25","","Nicole Pienack; Angela Puls; Christian Näther; Wolfgang Bensch","The Layered Thiostannate (dienH2)Cu2Sn2S6: a Photoconductive Inorganic-Organic Hybrid Compound","Inorganic Chemistry","2008","47","","9606","9611","10.1021/ic800118z","","","0.71073","MoKα","","0.0471","0.0417","","","0.0979","0.1018","","","","","","1.052","","","","has coordinates","179090","2020-10-21","18:00:00",""
"4320073","13.0322","0.0007","13.0322","0.0007","17.2087","0.0013","90","","90","","90","","2922.7","0.3","90","2","90","2","","","","","","","","5","I -4 m 2","I -4 -2","119","[GeO4Al12(OH)24(H2O)12](SeO4)4.14H2O","","","- Al12 Ge H62 O70 Se4 -","- Al12 Ge O70 Se4 -","- Al24 Ge2 O140 Se8 -","2","0.125","","Alasdair P. Lee; Brian L. Phillips; Marilyn M. Olmstead; William H. Casey","Synthesis and Characterization of the GeO4Al12(OH)24(OH2)128+ Polyoxocation","Inorganic Chemistry","2001","40","","4485","4487","10.1021/ic010146e","","","0.71073","MoKα","","0.0648","0.0627","","","0.1456","0.1466","","","","","","1.299","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4328188","6.09","0.0009","6.09","0.0009","15.45","0.003","90","","90","","90","","573.01","0.16","293","2","293","2","","","","","","","","3","I -4 m 2","I -4 -2","119","","","","- Au0.34 Ga2.66 K -","- Au0.335333 Ga2.66467 K -","- Au2.012 Ga15.988 K6 -","6","0.375","","Volodymyr Smetana; John D. Corbett; Gordon J. Miller","Four Polyanionic Compounds in the K-Au-Ga System: A Case Study in Exploratory Synthesis and of the Art of Structural Analysis","Inorganic Chemistry","2012","51","","1695","1702","10.1021/ic201999u","","","0.71073","MoKα","","0.0295","0.0255","","","0.0479","0.05","","","","","","1.022","","","","has coordinates","179384","2020-10-21","18:00:00",""
"4334474","27.762","0.013","27.762","0.013","36.444","0.011","90","","90","","90","","28088","2","100","2","100","2","","","","","","","","2","I -4 m 2","I -4 -2","119","","","","- In24 Te46 -","- In24 Te46 -","- In96 Te184 -","4","0.25","","Johanna Heine; Silke Santner; Stefanie Dehnen","Synthesis of Complex Polymeric Telluridoindates from KInTe2","Inorganic Chemistry","2013","52","","4424","4430","10.1021/ic302613g","","","0.71073","MoKα","","0.2949","0.0732","","","0.1486","0.1754","","","","","","0.768","","","","has coordinates","179447","2020-10-21","18:00:00",""
"4339489","4.6895","0.0007","4.6895","0.0007","12.629","0.003","90","","90","","90","","277.73","0.09","566","2","566","2","","","","","","","","3","I -4 m 2","I -4 -2","119","","","","- In3 Mg Sr -","- In3 Mg Sr -","- In6 Mg2 Sr2 -","2","0.125","","Li, Bin; Corbett, John D.","Syntheses and structures of new phases AeMxIn(4-x) (Ae = Sr, Ba; M = Mg, Zn): size effects and site preferences in BaAl4-type structures.","Inorganic chemistry","2007","46","21","8812","8818","10.1021/ic701127f","","","0.71073","MoKα","","0.0152","0.0151","","","0.0307","0.0307","","","","","","1.216","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339490","4.7093","0.0003","4.7093","0.0003","12.563","0.0015","90","","90","","90","","278.62","0.04","296","2","296","2","","","","","","","","3","I -4 m 2","I -4 -2","119","","","","- In3.15 Mg0.85 Sr -","- In3.15 Mg0.85 Sr -","- In6.3 Mg1.7 Sr2 -","2","0.125","","Li, Bin; Corbett, John D.","Syntheses and structures of new phases AeMxIn(4-x) (Ae = Sr, Ba; M = Mg, Zn): size effects and site preferences in BaAl4-type structures.","Inorganic chemistry","2007","46","21","8812","8818","10.1021/ic701127f","","","0.71073","MoKα","","0.0227","0.0227","","","0.0546","0.0546","","","","","","1.168","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4345241","17.3699","0.001","17.3699","0.001","19.8944","0.0012","90","","90","","90","","6002.4","0.6","293","2","293","2","","","","","","","","5","I -4 m 2","I -4 -2","119","","","","- C48 H32 Co8 N8 O25 -","- C48 H32 Co8 N8 O25 -","- C96 H64 Co16 N16 O50 -","2","0.125","","Chen, Di-Ming; Zhang, Nan-Nan; Liu, Chun-Sen; Jiang, Zhi-Hao; Wang, Xing-Dong; Du, Miao","A Mixed-Cluster Approach for Building a Highly Porous Cobalt(II) Isonicotinic Acid Framework: Gas Sorption Properties and Computational Analyses","Inorganic Chemistry","2017","","","","","10.1021/acs.inorgchem.6b03170","","x-ray","0.71073","MoKα","","0.086","0.0675","","","0.17","0.1823","","","","","","0.997","","","","has coordinates,has disorder","192371","2020-10-21","18:00:00",""
"4507719","28.1968","0.0013","28.1968","0.0013","18.1399","0.001","90","","90","","90","","14422.3","1.2","293","2","293","2","","","","","","","","4","I -4 m 2","I -4 -2","119","","","","- C40 H26 Cu2 O10 -","- C40 H22 Cu2 O10 -","- C320 H176 Cu16 O80 -","8","0.5","","Cai, Jianfeng; Yu, Jiancan; Xu, Hui; He, Yabing; Duan, Xing; Cui, Yuanjing; Wu, Chuande; Chen, Banglin; Qian, Guodong","A Doubly Interpenetrated Metal‒Organic Framework with Open Metal Sites and Suitable Pore Sizes for Highly Selective Separation of Small Hydrocarbons at Room Temperature","Crystal Growth & Design","2013","13","5","2094","","10.1021/cg400164m","","","0.71073","MoKα","","0.0579","0.0489","","","0.1293","0.1337","","","","","","1.17","","","","has coordinates","179613","2020-10-21","18:00:00",""
"7003119","15.578","0.001","15.578","0.001","17.631","0.002","90","","90","","90","","4278.6","0.6","150","2","150","2","","","","","","","","5","I -4 m 2","I -4 -2","119","","","","- C20 H36 Cu I N4 -","- C20 H36 Cu I N4 -","- C120 H216 Cu6 I6 N24 -","6","0.375","","Bowmaker, Graham A.; Hanna, John V.; Hahn, F. Ekkehardt; Lipton, Andrew S.; Oldham, Carolyn E.; Skelton, Brian W.; Smith, Mark E.; White, Allan H.","Structural and spectroscopic studies of some copper(i) halide tert-butyl isocyanide adducts","Dalton Transactions","2008","","13","1710","1720","10.1039/b712815k","","","0.71073","MoKα","","0.0376","0.0242","","0.032","0.059","0.066","","","1.269","","","1.042","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7003121","15.2887","0.0005","15.2887","0.0005","5.6096","0.0004","90","","90","","90","","1311.21","0.11","100","2","100","2","","","","","","","","5","I -4 m 2","I -4 -2","119","","","","- C20 H36 Br Cu N4 -","- C20 H36 Br Cu N4 -","- C40 H72 Br2 Cu2 N8 -","2","0.125","","Bowmaker, Graham A.; Hanna, John V.; Hahn, F. Ekkehardt; Lipton, Andrew S.; Oldham, Carolyn E.; Skelton, Brian W.; Smith, Mark E.; White, Allan H.","Structural and spectroscopic studies of some copper(i) halide tert-butyl isocyanide adducts","Dalton Transactions","2008","","13","1710","1720","10.1039/b712815k","","","0.71073","MoKα","","0.0494","0.0301","","","0.044","0.0457","","","","","","0.942","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7030418","3.6953","0.001","3.6953","0.001","5.225","0.0014","90","","90","","90","","71.35","0.03","293","2","293","2","","","","","","","","3","I -4 m 2","I -4 -2","119","","","","- Cu0.56 P2 Si1.44 -","- Cu0.552 P2 Si1.448 -","- Cu0.552 P2 Si1.448 -","1","0.0625","","Wang, Peng; Ahmadpour, Faraz; Kolodiazhnyi, Taras; Kracher, Alfred; Cranswick, Lachlan M. D.; Mozharivskyj, Yurij","Composition, structure, bonding and thermoelectric properties of ""CuT2P3"" and ""CuT4P3"", members of the T(1-x)(CuP3)x series with T being Si and Ge.","Dalton transactions (Cambridge, England : 2003)","2010","39","4","1105","1112","10.1039/b914555a","","","0.71073","MoKα","","0.0173","0.0118","","","0.0186","0.0192","","","","","","0.971","","","","has coordinates","180010","2020-10-21","18:00:00",""
"7059088","17.4654","0.0018","17.4654","0.0018","19.854","0.003","90","","90","","90","","6056.3","1.3","293","2","293","2","","","","","","","","5","I -4 m 2","I -4 -2","119","","","","- C48 H32 Co8 N32 O17 -","- C48 H32 Co8 N32 O17 -","- C96 H64 Co16 N64 O34 -","2","0.125","","Chen, Xi; Li, Zhao; Wei, Rong-jia; Li, Bao; Zhang, Tian-le; Tao, Jun","Template controlled synthesis of cluster-based porous coordination polymers: crystal structure, magnetism and adsorption","New Journal of Chemistry","2015","39","9","7333","","10.1039/C5NJ01417D","","","0.71073","MoKα","","0.1252","0.1072","","","0.2425","0.2581","","","","","","1.206","","","","has coordinates","233459","2020-10-21","18:00:00",""
"7109145","39.9678","0.0016","39.9678","0.0016","26.249","0.002","90","","90","","90","","41931","4","293","2","293","2","","","","","","","","5","I -4 m 2","I -4 -2","119","","","","- H19 La2 Mn O47 V13 -","- La2 Mn O47 V13 -","- La32 Mn16 O752 V208 -","16","1","","Ding Liu; Ying Lu; Hua-Qiao Tan; Wei-Lin Chen; Zhi-Ming Zhang; Yang-Guang Li; En-Bo Wang","Polyoxometalate-based purely inorganic porous frameworks with selective adsorption and oxidative catalysis functionalities","Chem.Commun.","2013","49","","3673","","10.1039/c3cc40990b","","","0.71073","MoKα","","0.1233","0.0784","","","0.1819","0.2042","","","","","","1.122","","","","has coordinates","180195","2020-10-21","18:00:00",""
"7121165","14.198","0.005","14.198","0.005","12.297","0.005","90","0.005","90","0.005","90","0.005","2478.9","1.6","293","2","293","2","","","","","","","","7","I -4 m 2","I -4 -2","119","","","","- C4 H12 Ag10 N16 O44 Si W12 -","- C4 H4 Ag10 N16 O44 Si W12 -","- C8 H8 Ag20 N32 O88 Si2 W24 -","2","0.125","","Li, Shaobin; Zhang, Li; Lan, Yaqian; O'Halloran, Kevin P; Ma, Huiyuan; Pang, Haijun","Polyoxometalate-encapsulated twenty-nuclear silver-tetrazole nanocage frameworks as highly active electrocatalysts for the hydrogen evolution reaction.","Chemical communications (Cambridge, England)","2018","54","16","1964","1967","10.1039/c7cc09223g","","","0.71069","MoKα","","0.0385","0.0367","","","0.0961","0.0971","","","","","","1.098","","","","has coordinates","228287","2020-10-21","18:00:00",""
"7121166","14.182","0.005","14.182","0.005","12.331","0.005","90","0.005","90","0.005","90","0.005","2480.1","1.6","293","2","293","2","","","","","","","","7","I -4 m 2","I -4 -2","119","","","","- C4 H12 Ag10 N16 O44 P W12 -","- C4 H4 Ag10 N16 O44 P W12 -","- C8 H8 Ag20 N32 O88 P2 W24 -","2","0.125","","Li, Shaobin; Zhang, Li; Lan, Yaqian; O'Halloran, Kevin P; Ma, Huiyuan; Pang, Haijun","Polyoxometalate-encapsulated twenty-nuclear silver-tetrazole nanocage frameworks as highly active electrocatalysts for the hydrogen evolution reaction.","Chemical communications (Cambridge, England)","2018","54","16","1964","1967","10.1039/c7cc09223g","","","0.71069","MoKα","","0.0451","0.0441","","","0.1219","0.1228","","","","","","0.819","","","","has coordinates","228287","2020-10-21","18:00:00",""
"7131246","15.4337","0.0003","15.4337","0.0003","10.8282","0.0004","90","","90","","90","","2579.27","0.12","173","2","173","2","","","","","","","","5","I -4 m 2","I -4 -2","119","","","","- C8 H24 Cl20 Si11 Sn4 -","- C8.004 H24 Cl19.996 Si10.998 Sn4.002 -","- C16.008 H48 Cl39.992 Si21.996 Sn8.004 -","2","0.125","","Köstler, Benedikt; Gilmer, Jannik; Bolte, Michael; Virovets, Alexander; Lerner, Hans-Wolfram; Albert, Philipp; Fantuzzi, Felipe; Wagner, Matthias","Group IV heteroadamantanes: synthesis of Si<sub>6</sub>Sn<sub>4</sub> and site-selective derivatization of Si<sub>6</sub>Ge<sub>4</sub>.","Chemical communications (Cambridge, England)","2023","59","16","2295","2298","10.1039/d2cc06697a","","","0.71073","MoKα","","0.0314","0.0301","","","0.0677","0.0684","","","","","","1.187","","","","has coordinates,has disorder","283047","2023-05-05","00:12:34",""
"8103749","4.02335","","4.02335","","21.5638","","90","","90","","90","","349.061","","","","","","","","","","","","","4","I -4 m 2","I -4 -2","119","","Li5 (O H)2 Br3","","- Br3 H2 Li5 O2 -","- Br3 Li5 O2 -","- Br6 Li10 O4 -","2","0.125","","Friese, K.; Hoennerscheid, A.; Jansen, M.","Crystal structure determination of systematically intergrown compounds: Li5 (O H)2 Br3 and Li2 (O H) Br","Zeitschrift fuer Kristallographie (149,1979-)","2003","218","","536","541","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9001237","7.042","","7.042","","11.133","","90","","90","","90","","552.083","","","","","","","","","","","","","4","I -4 m 2","I -4 -2","119","","","BaCuSi2O6","- Ba Cu O6 Si2 -","- Ba Cu O6 Si2 -","- Ba4 Cu4 O24 Si8 -","4","0.25","","Finger, L. W.; Hazen, R. M.; Hemley, R. J.","BaCuSi2O6: a new cyclosilicate with four-membered tetrahedral rings","American Mineralogist","1989","74","","952","955","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41",""
"9001404","9.9266","","9.9266","","10.3031","","90","","90","","90","","1015.24","","","","","","","","","","","","Goble, Oregon","6","I -4 m 2","I -4 -2","119","","","Garronite","- Al1.5 Ca0.704 H18 Na0.2 O11.02 Si2.5 -","- Al1.5 Ca0.704 H6.04 Na0.2 O11.02 Si2.5 -","- Al6 Ca2.816 H24.16 Na0.8 O44.08 Si10 -","4","0.25","","Artioli, G.","The crystal structure of garronite sample from Goble, Oregon","American Mineralogist","1992","77","","189","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:08",""
"9001405","9.8712","","9.8712","","10.2987","","90","","90","","90","","1003.51","","","","","","","","","","","","Fara Vicentina, Italy","5","I -4 m 2","I -4 -2","119","","","Garronite","- Al0.75 Ca0.436 H4.63 O5.57 Si1.25 -","- Al0.75 Ca0.436 H3.14 O5.57 Si1.25 -","- Al6 Ca3.488 H25.12 O44.56 Si10 -","8","0.5","","Artioli, G.","The crystal structure of garronite sample from Fara Vicentina, Italy","American Mineralogist","1992","77","","189","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:12",""
"9011220","10.461","","10.461","","8.813","","90","","90","","90","","964.429","","","","","","","","","","","","Ettringer Feld lava flow, Bellerberg volcano, Mayen, Eifel, Germany","4","I -4 m 2","I -4 -2","119","","","Jasmundite","- Ca11 O18 S Si4 -","- Ca11 O18 S Si4 -","- Ca22 O36 S2 Si8 -","2","0.125","","Dent Glasser, L. S.; Lee, C. K.","The structure of jasmundite, Ca22(SiO4)8O4S2 Locality: Ettringer Feld lava flow, Bellerberg volcano, Mayen, Eifel, Germany","Acta Crystallographica, Section B","1981","37","","803","806","10.1107/S0567740881004366","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""