# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-05T08:50:53+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'F 2 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
"1010581","5.84","0.006","5.84","0.006","5.84","0.006","90","","90","","90","","199.2","","","","","","","","","","","","","2","F 2 3","F 2 2 3","196","","Copper(I) selenide - $-alpha","","- Cu2 Se -","- Cu2.0004 Se -","- Cu8.0016 Se4 -","4","0.0833333","","Rahlfs, P","Ueber die kubischen Hochtemperaturmodifikationen der Sulfide und Telluride des Silbers und des einwertigen Kupfers","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1936","31","","157","194","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1511660","12.154","","12.154","","12.154","","90","","90","","90","","1795.39","","","","","","","","","","","","","4","F 2 3","F 2 2 3","196","","Li4 (B7 O12 Cl)","","- B7 Cl Li4 O12 -","- B7 Cl Li4 O12 -","- B56 Cl8 Li32 O96 -","8","0.166667","","Levasseur, A.; Lloyd, D.J.; Hagenmuller, P.; Fouassier, C.","Determination structurale de la boracite Li4 B7 O12 Cl","Journal of Solid State Chemistry","1973","8","","318","324","10.1016/S0022-4596(73)80028-3","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1515517","29.669","0.0003","29.669","0.0003","29.669","0.0003","90","","90","","90","","26116.1","0.5","150","2","150","2","","","","","","","","6","F 2 3","F 2 2 3","196","","","","- C47 H49 Cl10.667 Fe4 N9 O4 -","- C47 H43 Cl10.668 Fe4 N9 O4 -","- C564 H516 Cl128.016 Fe48 N108 O48 -","12","0.25","","Glasson, Christopher R. K.; Clegg, Jack K.; McMurtrie, John C.; Meehan, George V.; Lindoy, Leonard F.; Motti, Cherie A.; Moubaraki, Boujemaa; Murray, Keith S.; Cashion, John D.","Unprecedented encapsulation of a [FeIIICl4]− anion in a cationic [FeII4L6]8+ tetrahedral cage derived from 5,5′′′-dimethyl-2,2′:5′,5′′:2′′,2′′′-quaterpyridine","Chemical Science","2011","2","3","540","","10.1039/c0sc00523a","","","0.71073","MoKα","","0.0578","0.0482","","","0.1299","0.1456","","","","","","1.187","","","","has coordinates,has disorder","192777","2020-10-21","18:00:00",""
"1523131","20.08","","20.08","","20.08","","90","","90","","90","","8096.38","","","","","","","","","","","","","2","F 2 3","F 2 2 3","196","","","","- Li22 Pb5 -","- Li22 Pb5 -","- Li352 Pb80 -","16","0.333333","","Zalkin, A.; Ramsey, W.J.","Intermetallic compounds between lithium and lead. IV. The crystal structure of Li22 Pb5","Journal of Physical Chemistry","1958","62","","689","693","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1530960","12.136","","12.136","","12.136","","90","","90","","90","","1787.42","","","","","","","","","","","","","4","F 2 3","F 2 2 3","196","","Li5 B7 O12.5 Cl","","- B7 Cl Li5 O12.5 -","- B7 Cl Li5 O12.5 -","- B56 Cl8 Li40 O100 -","8","0.166667","","Vlasse, M.; Levasseur, A.; Hagenmuller, P.","Crystal structure of Li5 B7 O12.5 Cl at 296 and 425 k","Solid State Ionics","1981","2","","33","37","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532588","24.6336","","24.6336","","24.6336","","90","","90","","90","","14948","","","","","","","","","","","","","5","F 2 3","F 2 2 3","196","","Rb100.64 K30.92 (Al96 Si96 O384)","","- Al96 K30.92 O384 Rb100.64 Si96 -","- Al96 K30.904 O384 Rb100.656 Si96 -","- Al96 K30.904 O384 Rb100.656 Si96 -","1","0.0208333","","Ikeda, T.; Kodaira, T.","Crystal structure annd magnetic properties of rubidium clusters in zeolite LTA","Studies in Surface Science and Catalysis","2001","135","","3416","3423","","","","","","","","","","","","","","","","","","","","","","has coordinates","158525","2020-10-21","18:00:00",""
"1538121","19.78","","19.78","","19.78","","90","","90","","90","","7738.89","","","","","","","","","","","","","2","F 2 3","F 2 2 3","196","","","","- Li22 Si5 -","- Li22 Si5 -","- Li352 Si80 -","16","0.333333","","Gladyshevskii, E.I.; Oleksiv, G.I.; Kripyakevich, P.I.","New examples of the structural type Li22 Pb5","Kristallografiya","1964","9","","338","341","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538123","18.75","","18.75","","18.75","","90","","90","","90","","6591.8","","","","","","","","","","","","","2","F 2 3","F 2 2 3","196","","","","- Li22 Si5 -","- Li22 Si5 -","- Li352 Si80 -","16","0.333333","","Gladyshevskii, E.I.; Oleksiv, G.I.; Kripyakevich, P.I.","New examples of the structural type Li22 Pb5","Soviet Physics, Crystallography (= Kristallografiya)","1964","9","","269","271","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539120","7.176","","7.176","","7.176","","90","","90","","90","","369.528","","","","","","","","","","","","","3","F 2 3","F 2 2 3","196","","Zn (S O4)","","- O4 S Zn -","- O4 S Zn -","- O16 S4 Zn4 -","4","0.0833333","","Spiess, M.; Gruehn, R.","H-Zn S O4, das erste Sulfat mit einer kubischen H-Cristobalit-Struktur","Naturwissenschaften","1978","65","","594","594","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1546344","13.3832","0.0006","13.3832","0.0006","13.3832","0.0006","90","","90","","90","","2397.07","0.19","","","293","","","","","","","","","6","F 2 3","F 2 2 3","196","","","","- C28 H45 Al20 N O96 P20 -","- C27.888 H51.792 Al20 N3.984 O80 P20 -","- C27.888 H51.792 Al20 N3.984 O80 P20 -","1","0.0208333","","Bennett, J. Michael; Kirchner, Richard M.","The structure of as-synthesized AlPO4-16 determined by a new framework modeling method and Rietveld refonement of synchrotron powder diffraction data","Zeolites","1991","11","","502","506","10.1016/S0144-2449(05)80125-3","powder diffraction","x-ray","1.32365","","","","","","","","","0.106","","","","","","","","","has coordinates","197919","2020-10-21","18:00:00",""
"1549251","24.3478","0.0005","24.3478","0.0005","24.3478","0.0005","90","","90","","90","","14433.7","0.5","100","2","100.15","","","","","","","","","4","F 2 3","F 2 2 3","196","","","","- C106 H96 Cl40 N24 -","- C106 H96 Cl39.9792 N24 -","- C424 H384 Cl159.917 N96 -","4","0.0833333","","McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew","Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage","Faraday Discussions","2018","","","","","10.1039/C8FD00031J","","x-ray","0.71073","MoKα","","0.0551","0.0468","","","0.1329","0.1428","","","","","","1.046","","","","has coordinates","207358","2020-10-21","18:00:00",""
"1559070","42.9589","0.0006","42.9589","0.0006","42.9589","0.0006","90","","90","","90","","79279.2","1.9","150","2","150","2","","","","","","","","7","F 2 3","F 2 2 3","196","","","","- C640 H644 B24 Cd12 F96 N188 O4 -","- C480 H396 Cd12 N108 O4 -","- C1920 H1584 Cd48 N432 O16 -","4","0.0833333","","Argent, Stephen P.; Jackson, Fiona C.; Chan, Ho Man; Meyrick, Sam; Taylor, Christopher G. P.; Ronson, Tanya K.; Rourke, Jonathan P.; Ward, Michael D.","A family of diastereomeric dodecanuclear coordination cages based on inversion of chirality of individual triangular cyclic helicate faces","Chemical Science","2020","","","","","10.1039/D0SC04347H","","x-ray","1.54184","CuKα","","0.1246","0.1104","","","0.2944","0.3288","","","","","","1.791","","","","has coordinates","256370","2020-10-21","18:00:00",""
"1569617","26.2487","0.0004","26.2487","0.0004","26.2487","0.0004","90","","90","","90","","18085.2","0.5","106","9","106","9","","","","","","","","8","F 2 3","F 2 2 3","196","","","","- C92 H108 Cu12 Mo10 N5 O116 P V2 -","- C91.9984 H107.994 Cu12 Mo9.9996 N4.9996 O116.001 P V2.0004 -","- C367.994 H431.976 Cu48 Mo39.9984 N19.9984 O464.003 P4 V8.0016 -","4","0.0833333","","Lu, Xinlin; Cheng, Ting; Geletii, Yurii V.; Bacsa, John; Hill, Craig L.","Reactivity and stability synergism directed by the electron transfer between polyoxometalates and metal–organic frameworks","Catalysis Science & Technology","2023","13","17","5094","5103","10.1039/D3CY00569K","","x-ray","1.54184","CuKα","","0.0619","0.0552","","","0.1605","0.1682","","","","","","1.074","","","","has coordinates,has disorder","286020","2023-09-05","18:45:22",""
"2001973","20.897","0.002","20.897","0.002","20.897","0.002","90","","90","","90","","9125.4","1.5","","","","","","","","","","","","6","F 2 3","F 2 2 3","","","","","- C48 H96 Br12 Cu O24 Tl6 -","- C48 Br12 Cu O24 Tl6 -","- C192 Br48 Cu4 O96 Tl24 -","4","0.0833333","HH0592","Kahwa, I. A.; Miller, D.; Mitchel, M.; Fronczek, F. R.","Structure of the thallium-rich complex [(Tl18-crown-6)~4~CuBr~4~][TlBr~4~]~2~","Acta Crystallographica Section C","1993","49","2","320","321","10.1107/S0108270192007054","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2017639","16.197","0.001","16.197","0.001","16.197","0.001","90","","90","","90","","4249.2","0.5","295","","295","","","","","","","","","6","F 2 3","F 2 2 3","196","","aluminium barium lanthanum ruthenium strontium oxide","","- Al13.92 Ba8 La26.32 O167.04 Ru18.08 Sr53.68 -","- Al13.984 Ba8 La26.424 O167.04 Ru18.016 Sr53.576 -","- Al13.984 Ba8 La26.424 O167.04 Ru18.016 Sr53.576 -","1","0.0208333","FA3216","Zúñiga, F. J.; García-García, F. J.; Hoelzel, M.; Reller, A.","Al~14~Ba~8~La~26.3~Ru~18~Sr~53.7~O~167~: a variant of cubic perovskite with isolated RuO~6~ units","Acta Crystallographica Section C","2010","66","5","i50","i54","10.1107/S0108270110013879","","","0.71069","MoKα","","0.0529","0.0433","","","0.0867","0.0904","","","","","","1.51","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2017640","16.197","0.001","16.197","0.001","16.197","0.001","90","","90","","90","","4249.2","0.5","298","","298","","","","","","","","","6","F 2 3","F 2 2 3","196","","aluminium barium lanthanum ruthenium strontium oxide","","- Al13.984 Ba8 La26.424 O167.193 Ru18.02 Sr53.64 -","- Al14.096 Ba8 La26.736 O167.04 Ru17.904 Sr53.264 -","- Al14.096 Ba8 La26.736 O167.04 Ru17.904 Sr53.264 -","1","0.0208333","FA3216","Zúñiga, F. J.; García-García, F. J.; Hoelzel, M.; Reller, A.","Al~14~Ba~8~La~26.3~Ru~18~Sr~53.7~O~167~: a variant of cubic perovskite with isolated RuO~6~ units","Acta Crystallographica Section C","2010","66","5","i50","i54","10.1107/S0108270110013879","powder diffraction","neutron","1.548","neutron","","","","","","","","","","4.65","","","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2102499","5.8164","0.0003","5.8164","0.0003","5.8164","0.0003","90","","90","","90","","196.772","0.018","","","293","2","","","","","","","","2","F 2 3","","","","","","- Cu2 Se -","- Cu8.24 Se4 -","- Cu8.24 Se4 -","","","AV5007","Machado, K. D.; de Lima, J. C.; Grandi, T. A.; Campos, C. E. M.; Maurmann, C. E.; Gasperini, A. A. M.; Souza, S. M.; Pimenta, A. F.","Structural study of Cu~2{-~<i>x</i>}Se alloys produced by mechanical alloying","Acta Crystallographica Section B","2004","60","3","282","286","10.1107/S0108768104007475","","","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2312408","12.9839","0.0001","12.9839","0.0001","12.9839","0.0001","90","","90","","90","","2188.85","0.03","297","2","297","2","","","","","","","","5","F 2 3","F 2 2 3","196","Lithium aluminoboracite","Lithium aluminoboracite","","- Al3 B4 Cl Li4 O12 -","- Al3 B4 Cl Li4 O12 -","- Al24 B32 Cl8 Li32 O96 -","8","0.166667","WM5704","Yoshino, Sho; Arima, Hidechika; Ishijima, Masanao; Kajihara, Koichi","Crystal structures of the alkali aluminoboracites <i>A</i><sub>4</sub>B<sub>4</sub>Al<sub>3</sub>O<sub>12</sub>Cl (<i>A</i> = Li, Na).","Acta crystallographica. Section E, Crystallographic communications","2024","80","Pt 2","169","173","10.1107/S2056989024000501","","","1.54178","CuKα","","0.036","0.0322","","","0.0775","0.0814","","","","","","1.171","","","","has coordinates","290317","2024-03-05","20:28:12",""
"2312410","13.5904","0.0001","13.5904","0.0001","13.5904","0.0001","90","","90","","90","","2510.13","0.03","294","2","294","2","","","","","","","","5","F 2 3","F 2 2 3","196","Sodium aluminoboracite","Sodium aluminoboracite","","- Al3 B4 Cl0.92 Na3.92 O12 -","- Al3 B4 Cl0.921 Na3.922 O12 -","- Al24 B32 Cl7.368 Na31.376 O96 -","8","0.166667","WM5704","Yoshino, Sho; Arima, Hidechika; Ishijima, Masanao; Kajihara, Koichi","Crystal structures of the alkali aluminoboracites <i>A</i><sub>4</sub>B<sub>4</sub>Al<sub>3</sub>O<sub>12</sub>Cl (<i>A</i> = Li, Na).","Acta crystallographica. Section E, Crystallographic communications","2024","80","Pt 2","169","173","10.1107/S2056989024000501","","","1.54178","CuKα","","0.0295","0.0244","","","0.0621","0.0658","","","","","","1.119","","","","has coordinates","290317","2024-03-05","20:28:12",""
"3000330","14.8468","0.0006","14.8468","0.0006","14.8468","0.0006","90","","90","","90","","3272.6","0.2","298","2","298","2","","","","","","","","4","F 2 3","F 2 2 3","","","","","- Al10 Ca14 O35 Zn6 -","","","","","","Kahlenberg, Volker; Krüger, Hannes","High-temperature behavior and structural studies on Ca14Al10Zn6O35","To be published in Zeitschrift fuer Kristallographie","","","","","","","","x-ray","0.71073","MoKα","","0.015","0.0149","","","0.042","0.0422","","","","","","1.184","","","","","272918","2022-02-11","06:04:24","2023-01-11"
"3000331","14.8555","0.0005","14.8555","0.0005","14.8555","0.0005","90","","90","","90","","3278.4","0.19","373","2","373","2","","","","","","","","4","F 2 3","F 2 2 3","","","","","- Al10 Ca14 O35 Zn6 -","","","","","","Kahlenberg, Volker; Krüger, Hannes","High-temperature behavior and structural studies on Ca14Al10Zn6O35","To be published in Zeitschrift fuer Kristallographie","","","","","","","","x-ray","0.71073","MoKα","","0.0168","0.0164","","","0.0442","0.0448","","","","","","1.178","","","","","272919","2022-02-11","06:10:17","2023-01-11"
"3000332","14.867","0.0005","14.867","0.0005","14.867","0.0005","90","","90","","90","","3286.02","0.19","473","2","473","2","","","","","","","","4","F 2 3","F 2 2 3","","","","","- Al10 Ca14 O35 Zn6 -","","","","","","Kahlenberg, Volker; Krüger, Hannes","High-temperature behavior and structural studies on Ca14Al10Zn6O35","To be published in Zeitschrift fuer Kristallographie","","","","","","","","x-ray","0.71073","MoKα","","0.0173","0.0171","","","0.0449","0.0451","","","","","","1.169","","","","","272920","2022-02-11","06:12:09","2023-01-11"
"3000333","14.8807","0.0006","14.8807","0.0006","14.8807","0.0006","90","","90","","90","","3295.1","0.2","573","2","573","2","","","","","","","","4","F 2 3","F 2 2 3","","","","","- Al10 Ca14 O35 Zn6 -","","","","","","Kahlenberg, Volker; Krüger, Hannes","High-temperature behavior and structural studies on Ca14Al10Zn6O35","To be published in Zeitschrift fuer Kristallographie","","","","","","","","x-ray","0.71073","MoKα","","0.0181","0.0178","","","0.0474","0.0477","","","","","","1.181","","","","","272921","2022-02-11","06:14:19","2023-01-11"
"3000334","14.8953","0.0006","14.8953","0.0006","14.8953","0.0006","90","","90","","90","","3304.8","0.2","673","2","673","2","","","","","","","","4","F 2 3","F 2 2 3","","","","","- Al10 Ca14 O35 Zn6 -","","","","","","Kahlenberg, Volker; Krüger, Hannes","High-temperature behavior and structural studies on Ca14Al10Zn6O35","To be published in Zeitschrift fuer Kristallographie","","","","","","","","x-ray","0.71073","MoKα","","0.0178","0.0175","","","0.0455","0.0457","","","","","","1.116","","","","","272922","2022-02-11","06:16:03","2023-01-11"
"3000335","14.9114","0.0006","14.9114","0.0006","14.9114","0.0006","90","","90","","90","","3315.5","0.2","773","2","773","2","","","","","","","","4","F 2 3","F 2 2 3","","","","","- Al10 Ca14 O35 Zn6 -","","","","","","Kahlenberg, Volker; Krüger, Hannes","High-temperature behavior and structural studies on Ca14Al10Zn6O35","To be published in Zeitschrift fuer Kristallographie","","","","","","","","x-ray","0.71073","MoKα","","0.0191","0.0187","","","0.0492","0.05","","","","","","1.119","","","","","272923","2022-02-11","06:17:30","2023-01-11"
"3000336","14.9278","0.0006","14.9278","0.0006","14.9278","0.0006","90","","90","","90","","3326.5","0.2","873","2","873","2","","","","","","","","4","F 2 3","F 2 2 3","","","","","- Al10 Ca14 O35 Zn6 -","","","","","","Kahlenberg, Volker; Krüger, Hannes","High-temperature behavior and structural studies on Ca14Al10Zn6O35","To be published in Zeitschrift fuer Kristallographie","","","","","","","","x-ray","0.71073","MoKα","","0.0209","0.0194","","","0.0512","0.0546","","","","","","1.216","","","","","272924","2022-02-11","06:19:45","2023-01-11"
"3000337","14.9454","0.0006","14.9454","0.0006","14.9454","0.0006","90","","90","","90","","3338.3","0.2","973","2","973","2","","","","","","","","4","F 2 3","F 2 2 3","","","","","- Al10 Ca14 O35 Zn6 -","","","","","","Kahlenberg, Volker; Krüger, Hannes","High-temperature behavior and structural studies on Ca14Al10Zn6O35","To be published in Zeitschrift fuer Kristallographie","","","","","","","","x-ray","0.71073","MoKα","","0.0223","0.0213","","","0.0537","0.0545","","","","","","1.25","","","","","272925","2022-02-11","06:21:09","2023-01-11"
"3000338","14.9834","0.0016","14.9834","0.0016","14.9834","0.0016","90","","90","","90","","3363.8","0.6","1063","2","1063","2","","","","","","","","4","F 2 3","F 2 2 3","","","","","- Al10 Ca14 O35 Zn6 -","","","","","","Kahlenberg, Volker; Krüger, Hannes","High-temperature behavior and structural studies on Ca14Al10Zn6O35","To be published in Zeitschrift fuer Kristallographie","","","","","","","","x-ray","0.71073","MoKα","","0.0242","0.0226","","","0.0567","0.0585","","","","","","1.194","","","","","272926","2022-02-11","06:22:48","2023-01-11"
"4115451","32.664","0.004","32.664","0.004","32.664","0.004","90","","90","","90","","34850","7","200","2","200","2","","","","","","","","7","F 2 3","F 2 2 3","196","","","","- C300 H304 Cd25 Cl4 O6 P4 Se41 -","- C276 Cd25 Cl4 O6 P4 Se41 -","- C1104 Cd100 Cl16 O24 P16 Se164 -","4","0.0833333","","V. N. Soloviev; A. Eichhöfer; D. Fenske; U. Banin","Size-Dependent Optical Spectroscopy of a Homologous Series of CdSe Cluster Molecules","Journal of the American Chemical Society","2001","123","","2354","2364","10.1021/ja003598j","","","0.71073","MoKα","","0.0645","0.0476","","","0.1311","0.1447","","","","","","1.013","","","","has coordinates","178925","2020-10-21","18:00:00",""
"4117867","38.741","0.0002","38.741","0.0002","38.741","0.0002","90","","90","","90","","58145","0.5","100","2","100","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C276 Ir6 N24 O32 Zr6 -","- C276 Ir6 N24 O32 Zr6 -","- C1104 Ir24 N96 O128 Zr24 -","4","0.0833333","","Cheng Wang; Kathryn E. deKrafft; Wenbin Lin","Pt Nanoparticles @ Photoactive Metal-Organic Frameworks: Efficient Hydrogen Evolution via Synergistic Photoexcitation and Electron Injection","Journal of the American Chemical Society","2012","134","","7211","7214","10.1021/ja300539p","","","1.54178","CuKα","","0.2796","0.2135","","","0.3675","0.3909","","","","","","2.168","","","","has coordinates","178949","2020-10-21","18:00:00",""
"4121581","46.116","0.002","46.116","0.002","46.116","0.002","90","","90","","90","","98074","7","298","2","298","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C372 H244 O32 P12 Zr6 -","- C372 O32 P12 Zr6 -","- C1488 O128 P48 Zr24 -","4","0.0833333","","Falkowski, Joseph M.; Sawano, Takahiro; Zhang, Teng; Tsun, Galen; Chen, Yuan; Lockard, Jenny V.; Lin, Wenbin","Privileged phosphine-based metal-organic frameworks for broad-scope asymmetric catalysis.","Journal of the American Chemical Society","2014","136","14","5213","5216","10.1021/ja500090y","","","1.54178","CuKα","","0.1383","0.1026","","","0.2456","0.2594","","","","","","1.375","","","","has coordinates","179017","2020-10-21","18:00:00",""
"4122711","20.0944","0.0014","20.0944","0.0014","20.0944","0.0014","90","","90","","90","","8113.8","1","173","2","173","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C2 H N O1.17 Zn0.67 -","- C2 H N O1.16667 Zn0.666667 -","- C96 H48 N48 O56 Zn32 -","48","1","","Tu, Binbin; Pang, Qingqing; Wu, Doufeng; Song, Yuna; Weng, Linhong; Li, Qiaowei","Ordered Vacancies and Their Chemistry in Metal-Organic Frameworks.","Journal of the American Chemical Society","2014","136","41","14465","","10.1021/ja5063423","","","0.71073","MoKα","","0.0748","0.0552","","","0.1627","0.1703","","","","","","1.077","","","","has coordinates","179029","2020-10-21","18:00:00",""
"4122717","20.1448","0.0001","20.1448","0.0001","20.1448","0.0001","90","","90","","90","","8175.02","0.07","173","2","173","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C2 H N O1.17 Zn0.67 -","- C2 H N O1.16667 Zn0.666667 -","- C96 H48 N48 O56 Zn32 -","48","1","","Tu, Binbin; Pang, Qingqing; Wu, Doufeng; Song, Yuna; Weng, Linhong; Li, Qiaowei","Ordered Vacancies and Their Chemistry in Metal-Organic Frameworks.","Journal of the American Chemical Society","2014","136","41","14465","","10.1021/ja5063423","","","1.54178","CuKα","","0.0787","0.0748","","","0.1855","0.1873","","","","","","1.183","","","","has coordinates","179029","2020-10-21","18:00:00",""
"4122718","20.1107","0.0001","20.1107","0.0001","20.1107","0.0001","90","","90","","90","","8133.58","0.07","173","2","173","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C2 H N O1.17 Zn0.67 -","- C2 H N O1.16667 Zn0.666667 -","- C96 H48 N48 O56 Zn32 -","48","1","","Tu, Binbin; Pang, Qingqing; Wu, Doufeng; Song, Yuna; Weng, Linhong; Li, Qiaowei","Ordered Vacancies and Their Chemistry in Metal-Organic Frameworks.","Journal of the American Chemical Society","2014","136","41","14465","","10.1021/ja5063423","","","1.54178","CuKα","","0.0847","0.0766","","","0.2041","0.2094","","","","","","1.166","","","","has coordinates","179029","2020-10-21","18:00:00",""
"4122719","20.1232","0.0001","20.1232","0.0001","20.1232","0.0001","90","","90","","90","","8148.75","0.07","173","2","173","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C2 H N O1.17 Zn0.67 -","- C2 H N O1.16667 Zn0.666667 -","- C96 H48 N48 O56 Zn32 -","48","1","","Tu, Binbin; Pang, Qingqing; Wu, Doufeng; Song, Yuna; Weng, Linhong; Li, Qiaowei","Ordered Vacancies and Their Chemistry in Metal-Organic Frameworks.","Journal of the American Chemical Society","2014","136","41","14465","","10.1021/ja5063423","","","1.54178","CuKα","","0.0863","0.0769","","","0.1937","0.1995","","","","","","1.178","","","","has coordinates","179029","2020-10-21","18:00:00",""
"4122720","20.1198","0.0005","20.1198","0.0005","20.1198","0.0005","90","","90","","90","","8144.6","0.4","173","2","173","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C2 H N O1.17 Zn0.67 -","- C2 H N O1.16667 Zn0.666667 -","- C96 H48 N48 O56 Zn32 -","48","1","","Tu, Binbin; Pang, Qingqing; Wu, Doufeng; Song, Yuna; Weng, Linhong; Li, Qiaowei","Ordered Vacancies and Their Chemistry in Metal-Organic Frameworks.","Journal of the American Chemical Society","2014","136","41","14465","","10.1021/ja5063423","","","1.54178","CuKα","","0.0569","0.0468","","","0.1312","0.1358","","","","","","1.002","","","","has coordinates","179029","2020-10-21","18:00:00",""
"4126871","33.0134","0.0004","33.0134","0.0004","33.0134","0.0004","90","","90","","90","","35980.8","0.8","100","2","100","2","","","","","","","","7","F 2 3","F 2 2 3","196","","","","- C216 H224 B Co20 F4 N72 O16 -","- C216 H223.999 B Co20 F4 N72 O16 -","- C864 H895.997 B4 Co80 F16 N288 O64 -","4","0.0833333","","Luo, Dong; Wang, Xue-Zhi; Yang, Chen; Zhou, Xiao-Ping; Li, Dan","Self-Assembly of Chiral Metal-Organic Tetartoid.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b11285","","","1.54184","CuKα","","0.0823","0.0792","","","0.2237","0.2276","","","","","","1.136","","","","has coordinates","204365","2020-10-21","18:00:00",""
"4126872","32.9797","0.0003","32.9797","0.0003","32.9797","0.0003","90","","90","","90","","35870.7","0.6","100","2","100","2","","","","","","","","7","F 2 3","F 2 2 3","196","","","","- C216 H224 B Co20 F4 N72 O16 -","- C216 H223.999 B Co20 F4 N72 O16 -","- C864 H895.997 B4 Co80 F16 N288 O64 -","4","0.0833333","","Luo, Dong; Wang, Xue-Zhi; Yang, Chen; Zhou, Xiao-Ping; Li, Dan","Self-Assembly of Chiral Metal-Organic Tetartoid.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b11285","","","1.54184","CuKα","","0.0535","0.0514","","","0.1385","0.1417","","","","","","1.045","","","","has coordinates","204365","2020-10-21","18:00:00",""
"4126873","32.855","0.0003","32.855","0.0003","32.855","0.0003","90","","90","","90","","35465.4","0.6","100","2","100","2","","","","","","","","7","F 2 3","F 2 2 3","196","","","","- C240 H272 B Co20 F4 N72 O16 -","- C240 H271.999 B Co20 F4 N72 O16 -","- C960 H1088 B4 Co80 F16 N288 O64 -","4","0.0833333","","Luo, Dong; Wang, Xue-Zhi; Yang, Chen; Zhou, Xiao-Ping; Li, Dan","Self-Assembly of Chiral Metal-Organic Tetartoid.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b11285","","","1.54184","CuKα","","0.0506","0.0469","","","0.1381","0.1406","","","","","","1.083","","","","has coordinates","204365","2020-10-21","18:00:00",""
"4126874","33.0237","0.0003","33.0237","0.0003","33.0237","0.0003","90","","90","","90","","36014.5","0.6","100","2","100","2","","","","","","","","7","F 2 3","F 2 2 3","196","","","","- C240 H272 B Co20 F4 N72 O16 -","- C240 H271.999 B Co20 F4 N72 O16 -","- C960 H1088 B4 Co80 F16 N288 O64 -","4","0.0833333","","Luo, Dong; Wang, Xue-Zhi; Yang, Chen; Zhou, Xiao-Ping; Li, Dan","Self-Assembly of Chiral Metal-Organic Tetartoid.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b11285","","","1.54184","CuKα","","0.0745","0.0687","","","0.1938","0.2026","","","","","","1.057","","","","has coordinates","204365","2020-10-21","18:00:00",""
"4126875","33.0388","0.0004","33.0388","0.0004","33.0388","0.0004","90","","90","","90","","36063.9","0.8","100","2","100","2","","","","","","","","6","F 2 3","F 2 2 3","196","","","","- C216 H224 Cl Co20 N72 O20 -","- C216 H223.999 Cl Co20 N72 O20 -","- C864 H895.997 Cl4 Co80 N288 O80 -","4","0.0833333","","Luo, Dong; Wang, Xue-Zhi; Yang, Chen; Zhou, Xiao-Ping; Li, Dan","Self-Assembly of Chiral Metal-Organic Tetartoid.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b11285","","","1.54184","CuKα","","0.0994","0.0746","","","0.207","0.2241","","","","","","1.055","","","","has coordinates","204365","2020-10-21","18:00:00",""
"4126876","32.9647","0.0004","32.9647","0.0004","32.9647","0.0004","90","","90","","90","","35821.8","0.8","100","2","100","2","","","","","","","","6","F 2 3","F 2 2 3","196","","","","- C216 H224 Cl Co20 N72 O20 -","- C216 H223.999 Cl Co20 N72 O20 -","- C864 H895.997 Cl4 Co80 N288 O80 -","4","0.0833333","","Luo, Dong; Wang, Xue-Zhi; Yang, Chen; Zhou, Xiao-Ping; Li, Dan","Self-Assembly of Chiral Metal-Organic Tetartoid.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b11285","","","1.54184","CuKα","","0.0985","0.0902","","","0.2671","0.2856","","","","","","1.254","","","","has coordinates","204365","2020-10-21","18:00:00",""
"4126877","33.0274","0.0004","33.0274","0.0004","33.0274","0.0004","90","","90","","90","","36026.6","0.8","100","2","100","2","","","","","","","","7","F 2 3","F 2 2 3","196","","","","- C216 H224 Co20 F42 N72 O16 P7 -","- C216 H223.999 Co20 F42 N72 O16 P7 -","- C864 H895.997 Co80 F168 N288 O64 P28 -","4","0.0833333","","Luo, Dong; Wang, Xue-Zhi; Yang, Chen; Zhou, Xiao-Ping; Li, Dan","Self-Assembly of Chiral Metal-Organic Tetartoid.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b11285","","","1.54184","CuKα","","0.0783","0.0689","","","0.1987","0.2121","","","","","","1.045","","","","has coordinates","204365","2020-10-21","18:00:00",""
"4126878","32.9732","0.0002","32.9732","0.0002","32.9732","0.0002","90","","90","","90","","35849.5","0.4","100","2","100","2","","","","","","","","7","F 2 3","F 2 2 3","196","","","","- C216 H224 Co20 F42 N72 O16 P7 -","- C216 H223.999 Co20 F42 N72 O16 P7 -","- C864 H895.997 Co80 F168 N288 O64 P28 -","4","0.0833333","","Luo, Dong; Wang, Xue-Zhi; Yang, Chen; Zhou, Xiao-Ping; Li, Dan","Self-Assembly of Chiral Metal-Organic Tetartoid.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b11285","","","1.54178","CuKα","","0.1684","0.1568","","","0.4104","0.4236","","","","","","1.793","","","","has coordinates","204365","2020-10-21","18:00:00",""
"4126879","32.9727","0.0003","32.9727","0.0003","32.9727","0.0003","90","","90","","90","","35847.9","0.6","100","2","100","2","","","","","","","","7","F 2 3","F 2 2 3","196","","","","- C217 H224 Co20 F3 N72 O19 S -","- C217 H223.999 Co20 F3 N72 O19 S -","- C868 H895.997 Co80 F12 N288 O76 S4 -","4","0.0833333","","Luo, Dong; Wang, Xue-Zhi; Yang, Chen; Zhou, Xiao-Ping; Li, Dan","Self-Assembly of Chiral Metal-Organic Tetartoid.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b11285","","","1.54184","CuKα","","0.0707","0.0611","","","0.1672","0.1748","","","","","","1.06","","","","has coordinates,has disorder","204365","2020-10-21","18:00:00",""
"4126880","32.9477","0.0003","32.9477","0.0003","32.9477","0.0003","90","","90","","90","","35766.4","0.6","100","2","100","2","","","","","","","","7","F 2 3","F 2 2 3","196","","","","- C217 H224 Co20 F3 N72 O19 S -","- C217 H223.999 Co20 F3 N72 O19 S -","- C868 H895.997 Co80 F12 N288 O76 S4 -","4","0.0833333","","Luo, Dong; Wang, Xue-Zhi; Yang, Chen; Zhou, Xiao-Ping; Li, Dan","Self-Assembly of Chiral Metal-Organic Tetartoid.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b11285","","","1.54184","CuKα","","0.0791","0.0741","","","0.2089","0.2162","","","","","","1.08","","","","has coordinates,has disorder","204365","2020-10-21","18:00:00",""
"4344100","38.0279","0.0007","38.0279","0.0007","38.0279","0.0007","90","","90","","90","","54993","1.8","200","2","200","2","","","","","","","","8","F 2 3","F 2 2 3","196","","","","- C72 H84 Au4 Co2 N6 O18 P4 S4 -","- C72 H84 Au4 Co2 N6 O17.9998 P4 S4 -","- C1728 H2016 Au96 Co48 N144 O431.995 P96 S96 -","24","0.5","","Yoshinari, Nobuto; Li, Chan; Lee, Raeeun; Kuwamura, Naoto; Igashira-Kamiyama, Asako; Konno, Takumi","Chiral Scrambling and Independent Crystallization of d4, l4, and d2l2 Isomers of an Au(I)4Co(III)2 Hexanuclear Complex with Mixed Penicillaminate and Bis(diphenylphosphino)ethane.","Inorganic chemistry","2015","54","18","8881","8883","10.1021/acs.inorgchem.5b01549","","","0.71075","MoKα","","0.0558","0.0495","","","0.0862","0.088","","","","","","1.071","","","","has coordinates","160485","2020-10-21","18:00:00",""
"4505654","10.4959","0.0006","10.4959","0.0006","10.4959","0.0006","90","","90","","90","","1156.27","0.11","93","2","93","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- Ge H3 N O8 Sn6 -","- Ge H3 N O8 Sn6 -","- Ge4 H12 N4 O32 Sn24 -","4","0.0833333","","Purdy, Andrew P.; Case, Sean; George, Clifford","Ammonothermal Crystal Growth of Germanium and Its Alloys: Synthesis of a Hollow Metallic Crystal","Crystal Growth & Design","2003","3","2","121","","10.1021/cg025590m","","","0.71073","MoKα","","0.055","0.0535","","","0.1291","0.1299","","","","","","1.148","","","","has coordinates","176467","2020-10-21","18:00:00",""
"7101832","31.215","0.004","31.215","0.004","31.215","0.004","90","","90","","90","","30417","6","100","2","100","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C255 H263 Ag24 P17 S33 -","- C251.88 H255.72 Ag24 P17 S32 -","- C1007.52 H1022.88 Ag96 P68 S128 -","4","0.0833333","","Rothenberger, Alexander; Shafaei-Fallah, Maryam; Shi, Weifeng","A recipe for new organometallic polymers and oligomers? Synthesis and structure of an oligo- and a polymeric arrangement of P-S anions.","Chemical communications (Cambridge, England)","2007","","15","1499","1501","10.1039/b617177j","","","0.71073","MoKα","","0.0403","0.036","","","0.1053","0.1068","","","","","","1.122","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7112744","23.3565","0.0006","23.3565","0.0006","23.3565","0.0006","90","","90","","90","","12741.6","0.6","200","2","200","2","","","","","","","","6","F 2 3","F 2 2 3","196","","","","- C13.5 H14.5 Cl2 Co2.5 N4.5 O6.5 -","- C13.5 H14.52 Cl2 Co2.5 N4.5 O6.51 -","- C216 H232.32 Cl32 Co40 N72 O104.16 -","16","0.333333","","Rebecca J. Holmberg; Marika Kay; Ilia Korobkov; Eugene Kadantsev; Peter G. Boyd; Tomoko Aharen; Serge Desgreniers; Tom K. Woo; Muralee Murugesu","An unprecedented CoII cuboctahedron as the secondary building unit in a Co-based metal-organic framework","Chem.Commun.","2014","50","","5333","","10.1039/C3CC46396F","","","0.71073","MoKα","","0.0632","0.0512","","","0.1138","0.1182","","","","","","1.046","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7114736","21.241","0.002","21.241","0.002","21.241","0.002","90","","90","","90","","9583.5","1.6","293","2","293","2","","","","","","","","7","F 2 3","F 2 2 3","196","","","","- C48 H96 Cl8 Fe5 K4 O24 S4 -","- C48 H96 Cl8 Fe5 K4 O24 S4 -","- C192 H384 Cl32 Fe20 K16 O96 S16 -","4","0.0833333","","Willems, Johannes B.; Köckerling, Martin","Synthesis and structure of an unprecedented high-symmetry [Fe4S4Cl4] cubane-type unit in supramolecular [K4(FeCl4)(C12H24O6)4][Fe4S4Cl4]","Chemical Communications","2001","","15","1380","","10.1039/b103871k","","","0.71073","MoKα","","","0.0645","","","","0.175","","","","","","0.958","","","","has coordinates","190534","2020-10-21","18:00:00",""
"7115905","34.172","0.005","34.172","0.005","34.172","0.005","90","","90","","90","","39904","10","293","2","293","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C21 H15 Cu3 N3 O30.75 -","- C21 H15 Cu3 N3 O30.75 -","- C672 H480 Cu96 N96 O984 -","32","0.666667","","Ivan Burneo; Kyriakos C. Stylianou; Inhar Imaz; Daniel Maspoch","The influence of the enantiomeric ratio of an organic ligand on the structure and chirality of metal-organic frameworks","Chem.Commun.","2014","50","","13829","","10.1039/C4cc06190J","","","0.71069","MoKα","","0.092","0.0828","","","0.277","0.2926","","","","","","1.323","","","","has coordinates","180273","2020-10-21","18:00:00",""
"7115906","34.182","0.003","34.182","0.003","34.182","0.003","90","","90","","90","","39939","6","293","2","293","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C21 H15 Cu3 N3 O30.75 -","- C21 H15 Cu3 N3 O30.75 -","- C672 H480 Cu96 N96 O984 -","32","0.666667","","Ivan Burneo; Kyriakos C. Stylianou; Inhar Imaz; Daniel Maspoch","The influence of the enantiomeric ratio of an organic ligand on the structure and chirality of metal-organic frameworks","Chem.Commun.","2014","50","","13829","","10.1039/C4cc06190J","","","0.71069","MoKα","","0.0897","0.0836","","","0.267","0.2775","","","","","","1.196","","","","has coordinates","180273","2020-10-21","18:00:00",""
"7121183","28.288","","28.288","","28.288","","90","","90","","90","","22636.4","","100","2","100","2","","","","","","","","6","F 2 3","F 2 2 3","196","","","","- C108 H108 N12 O28 P4 Pd12 -","- C108 H108 N12 O28 P4 Pd12 -","- C432 H432 N48 O112 P16 Pd48 -","4","0.0833333","","Rajasekar, Prabhakaran; Pandey, Swechchha; Paithankar, Harshad; Chugh, Jeetender; Steiner, Alexander; Boomishankar, Ramamoorthy","Imido-P(v) trianion supported enantiopure neutral tetrahedral Pd(ii) cages.","Chemical communications (Cambridge, England)","2018","54","15","1873","1876","10.1039/c8cc00207j","","","0.71073","MoKα","","0.0609","0.0361","","","0.0802","0.0917","","","","","","1.015","","","","has coordinates","228431","2020-10-21","18:00:00",""
"7121184","28.046","","28.046","","28.046","","90","","90","","90","","22060.4","","100","2","100","2","","","","","","","","6","F 2 3","F 2 2 3","196","","CHIRAL CAGE","","- C108 H108 N12 O28 P4 Pd12 -","- C108 H108 N12 O28 P4 Pd12 -","- C432 H432 N48 O112 P16 Pd48 -","4","0.0833333","","Rajasekar, Prabhakaran; Pandey, Swechchha; Paithankar, Harshad; Chugh, Jeetender; Steiner, Alexander; Boomishankar, Ramamoorthy","Imido-P(v) trianion supported enantiopure neutral tetrahedral Pd(ii) cages.","Chemical communications (Cambridge, England)","2018","54","15","1873","1876","10.1039/c8cc00207j","","","0.71073","MoKα","","0.0847","0.0416","","","0.1053","0.1316","","","","","","1.046","","","","has coordinates","228431","2020-10-21","18:00:00",""
"7122760","54.053","0.004","54.053","0.004","54.053","0.004","90","","90","","90","","157928","2","173","2","173","2","","","","","","","","6","F 2 3","F 2 2 3","196","","","","- C594 H612 Cl16 Fe12 N108 O64 -","- C594 H612 Cl16 Fe12 N108 O64 -","- C4752 H4896 Cl128 Fe96 N864 O512 -","8","0.166667","","Zhang, Hai-Xia; Yan, Xiaodong; Chen, Yu-Xin; Zhang, Shu-Heng; Li, Tao; Han, Wang-Kang; Bao, Ling-Yu; Shen, Rui; Gu, Zhi-Guo","Zeolite supramolecular framework with LTA topology based on tetrahedral metal-organic cage","Chemical Communications","2018","","","","","10.1039/C8CC08965E","","","0.71073","MoKα","","0.2604","0.1504","","","0.3522","0.4014","","","","","","1.03","","","","has coordinates","212736","2020-10-21","18:00:00",""
"7207495","38.4167","0.0008","38.4167","0.0008","38.4167","0.0008","90","","90","","90","","56697","2","200","2","200","2","","","","","","","","9","F 2 3","F 2 2 3","196","","","","- C72 H89.33 Au4 Cl2 Co2 N4 O20.67 P4 S4 -","- C72 H84 Au4 Cl1.99933 Co2 N4 O20.6666 P4 S4 -","- C1728 H2016 Au96 Cl47.984 Co48 N96 O495.999 P96 S96 -","24","0.5","","Lee, Raeeun; Igashira-Kamiyama, Asako; Motoyoshi, Hiroki; Konno, Takumi","Aggregation of chiral hexanuclear complex-cations into cationic metallosupramolecules with concomitant aggregation of inorganic counter-anions into anionic clusters","CrystEngComm","2012","14","6","1936","","10.1039/c2ce06539h","","","0.71075","MoKα","","0.0664","0.0537","","","0.1341","0.1441","","","","","","0.976","","","","has coordinates,has disorder","180405","2020-10-21","18:00:00",""
"7207496","38.0216","0.0006","38.0216","0.0006","38.0216","0.0006","90","","90","","90","","54965.6","1.5","200","2","200","2","","","","","","","","9","F 2 3","F 2 2 3","196","","","","- C72 H106 Au4 Cl2 Co2 N4 O19 P4 S4 -","- C72 H84 Au4 Cl2 Co2 N4 O19 P4 S4 -","- C1728 H2016 Au96 Cl48 Co48 N96 O456 P96 S96 -","24","0.5","","Lee, Raeeun; Igashira-Kamiyama, Asako; Motoyoshi, Hiroki; Konno, Takumi","Aggregation of chiral hexanuclear complex-cations into cationic metallosupramolecules with concomitant aggregation of inorganic counter-anions into anionic clusters","CrystEngComm","2012","14","6","1936","","10.1039/c2ce06539h","","","0.71075","MoKα","","0.0536","0.0468","","","0.1338","0.1392","","","","","","0.991","","","","has coordinates,has disorder","180405","2020-10-21","18:00:00",""
"7209289","20.479","0.007","20.479","0.007","20.479","0.007","90","","90","","90","","8589","5","296","2","296","2","","","","","","","","6","F 2 3","F 2 2 3","196","","","","- B6 Cl2 H10 Na13 O47 P11 -","- B6 Cl2 Na13 O47 P11 -","- B48 Cl16 Na104 O376 P88 -","8","0.166667","","Feng, Yuquan; Li, Min; Shi, Hengzhen; Huang, Qunzeng; Qiu, Dongfang","A novel chlorine-containing borophosphate based on (4,3)-connected 3-D borophosphate anion [B6P11O42(OH)2]13− with unique B : P ratio and 22-tetrahedral cages","CrystEngComm","2013","15","11","2048","","10.1039/c3ce26918c","","","0.71073","MoKα","","0.0541","0.0504","","","0.1171","0.1187","","","","","","1.061","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7214439","25.3961","0.0009","25.3961","0.0009","25.3961","0.0009","90","","90","","90","","16379.5","1","173","2","173","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C32 H35 Cd N9 O6 -","- C27 H22 Cd N7 O -","- C432 H352 Cd16 N112 O16 -","16","0.333333","","Yuan, Shuai; Deng, Yong-Kai; Xuan, Wei-Min; Wang, Xing-Po; Wang, Su-Na; Dou, Jian-Min; Sun, Di","Spontaneous chiral resolution of a 3D (3,12)-connected MOF with an unprecedented ttt topology consisting of cubic [Cd4(μ3-OH)4] clusters and propeller-like ligands","CrystEngComm","2014","16","19","3829","","10.1039/c4ce00028e","","","0.71073","MoKα","","0.0955","0.0689","","","0.1884","0.2091","","","","","","0.809","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7214440","25.704","0.003","25.704","0.003","25.704","0.003","90","","90","","90","","16983","3","120","2","120","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C32 H35 Cd N9 O6 -","- C27 H22 Cd N7 O -","- C432 H352 Cd16 N112 O16 -","16","0.333333","","Yuan, Shuai; Deng, Yong-Kai; Xuan, Wei-Min; Wang, Xing-Po; Wang, Su-Na; Dou, Jian-Min; Sun, Di","Spontaneous chiral resolution of a 3D (3,12)-connected MOF with an unprecedented ttt topology consisting of cubic [Cd4(μ3-OH)4] clusters and propeller-like ligands","CrystEngComm","2014","16","19","3829","","10.1039/c4ce00028e","","","0.71073","MoKα","","0.0811","0.0529","","","0.1259","0.1337","","","","","","0.836","","","","has coordinates","180475","2020-10-21","18:00:00",""
"7228322","24.1722","0.001","24.1722","0.001","24.1722","0.001","90","","90","","90","","14123.7","1","100","","100","","","","","","","","","4","F 2 3","F 2 2 3","196","","","","- C133.5 H176.84 N24 O11.92 -","- C133.5 H120 N24 O11.916 -","- C534 H480 N96 O47.664 -","4","0.0833333","","Tothadi, Srinu; Little, Marc A.; Hasell, Tom; Briggs, Michael E.; Chong, Samantha Y.; Liu, Ming; Cooper, Andrew I.","Modular assembly of porous organic cage crystals: isoreticular quasiracemates and ternary co-crystal","CrystEngComm","2017","","","","","10.1039/C7CE00783C","","x-ray","0.7749","","","0.1038","0.0941","","","0.2252","0.2475","","","","","","2.259","","","","has coordinates,has disorder","197010","2020-10-21","18:00:00",""
"7228323","24.586","0.003","24.586","0.003","24.586","0.003","90","","90","","90","","14862","3","400","2","400","2","","","","","","","","3","F 2 3","F 2 2 3","196","","","","- C126 H156 N24 -","- C126 H156 N24 -","- C504 H624 N96 -","4","0.0833333","","Tothadi, Srinu; Little, Marc A.; Hasell, Tom; Briggs, Michael E.; Chong, Samantha Y.; Liu, Ming; Cooper, Andrew I.","Modular assembly of porous organic cage crystals: isoreticular quasiracemates and ternary co-crystal","CrystEngComm","2017","","","","","10.1039/C7CE00783C","","x-ray","0.71073","MoKα","","0.0708","0.0491","","","0.1444","0.1655","","","","","","1.059","","","","has coordinates","197010","2020-10-21","18:00:00",""
"7703498","31.733","0.005","31.733","0.005","31.733","0.005","90","","90","","90","","31955","9","293","","293","","","","","","","","","3","F 2 3","F 2 2 3","196","","","CAU-42","- C288 Al24 O114 -","- C288 Al24 O114 -","- C576 Al48 O228 -","2","0.0416667","","Leubner, S.; Bengtsson, V. E. G.; Inge, A. K.; Wahiduzzaman, M.; Steinke, F.; Jaworski, A.; Xu, H.; Halis, S.; Rönfeldt, P; Reinsch, H.; Maurin, G.; Zou, X.; Stock, N.","Hexahydroxytriphenylene for the synthesis of group 13 MOFs - a new inorganic building unit in a β-cristobalite type structure.","Dalton transactions (Cambridge, England : 2003)","2020","49","10","3088","3092","10.1039/d0dt00235f","powder diffraction","","1.5406","CuKα1","","","","","","","","","0.0276","1.7612","","","","","","","has coordinates","250281","2020-10-21","18:00:00",""
"8000029","21.3922","0.0005","21.3922","0.0005","21.3922","0.0005","90","","90","","90","","9789.7","0.4","296.2","","296.2","","","","","","","","","7","F 2 3","F 2 2 3","196","bis{bis(L-prolinato)cobaltl(III)}tetrakis{bis(L-prolinato)cobaltl(II)} barium(II) perchlorate","","","- C60 H96 Ba Cl4 Co6 N12 O40 -","- C60 H96 Ba Cl4 Co6 N12 O40 -","- C240 H384 Ba4 Cl16 Co24 N48 O160 -","4","0.0833333","","Takashi Komiyama; Satoshi Igarashi; Yoshimasa Hoshino; Yasuhiko Yukawa","Changing Mixed-valence State of Hexacobalt Cluster by Substituting Central Metal Ion and by Electrochemical Reduction ‒ Different Mixed-valence States of [M{Co(prolinato)2}6]4+ (M =Ba2+ and La3+)","Chemistry Letters","2005","34","3","300","","10.1246/cl.2005.300","","","0.7107","MoKα","","","0.0468","","","","0.0682","","","","","","1.05","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000030","21.3387","0.0005","21.3387","0.0005","21.3387","0.0005","90","","90","","90","","9716.4","0.4","296.2","","296.2","","","","","","","","","7","F 2 3","F 2 2 3","196","{bis(L-prolinato)cobaltl(III)}pentakis{bis(L-prolinato)cobaltl(II)} Lanthanum(III) perchlorate","","","- C60 H96 Cl4 Co6 La N12 O40 -","- C60 H96 Cl4 Co6 La N12 O40 -","- C240 H384 Cl16 Co24 La4 N48 O160 -","4","0.0833333","","Takashi Komiyama; Satoshi Igarashi; Yoshimasa Hoshino; Yasuhiko Yukawa","Changing Mixed-valence State of Hexacobalt Cluster by Substituting Central Metal Ion and by Electrochemical Reduction ‒ Different Mixed-valence States of [M{Co(prolinato)2}6]4+ (M =Ba2+ and La3+)","Chemistry Letters","2005","34","3","300","","10.1246/cl.2005.300","","","0.7107","MoKα","","","0.0494","","","","0.0714","","","","","","0.918","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000031","21.6417","0.0004","21.6417","0.0004","21.6417","0.0004","90","","90","","90","","10136.2","0.3","296.2","","296.2","","","","","","","","","7","F 2 3","F 2 2 3","196","hexakis{bis(L-prolinato)cobalt(II)}barium(II) tetramethylammonium perchlorate","","","- C68 H120 Ba Cl4 Co6 N14 O40 -","- C68 H120 Ba Cl4 Co6 N14 O40 -","- C272 H480 Ba4 Cl16 Co24 N56 O160 -","4","0.0833333","","Takashi Komiyama; Satoshi Igarashi; Yoshimasa Hoshino; Yasuhiko Yukawa","Changing Mixed-valence State of Hexacobalt Cluster by Substituting Central Metal Ion and by Electrochemical Reduction ‒ Different Mixed-valence States of [M{Co(prolinato)2}6]4+ (M =Ba2+ and La3+)","Chemistry Letters","2005","34","3","300","","10.1246/cl.2005.300","","","0.7107","MoKα","","","0.0485","","","","0.0639","","","","","","0.883","","","","has coordinates","198637","2020-10-21","18:00:00",""
"8000032","21.338","0.001","21.338","0.001","21.338","0.001","90","","90","","90","","9714.8","0.8","296.2","","296.2","","","","","","","","","7","F 2 3","F 2 2 3","196","hexakis{bis(L-prolinato)cobalt(II)}lanthanum(III) tetramethylammonium perchlorate","","","- C64 H108 Cl4 Co6 La N13 O40 -","- C64 H108 Cl4 Co6 La N13 O40 -","- C256 H432 Cl16 Co24 La4 N52 O160 -","4","0.0833333","","Takashi Komiyama; Satoshi Igarashi; Yoshimasa Hoshino; Yasuhiko Yukawa","Changing Mixed-valence State of Hexacobalt Cluster by Substituting Central Metal Ion and by Electrochemical Reduction ‒ Different Mixed-valence States of [M{Co(prolinato)2}6]4+ (M =Ba2+ and La3+)","Chemistry Letters","2005","34","3","300","","10.1246/cl.2005.300","","","0.7107","MoKα","","","0.043","","","","0.0572","","","","","","0.921","","","","has coordinates","198637","2020-10-21","18:00:00",""
"8000210","24.63409","","24.63409","","24.63409","","90","","90","","90","","14948.9","","","","","","","","","","","","","4","F 2 3","F 2 2 3","196","","K128.08 (Si96.96 Al95.04 O384)","","- Al95.04 K128.08 O384 Si96.96 -","- Al95.04 K128.08 O384 Si96.96 -","- Al95.04 K128.08 O384 Si96.96 -","1","0.0208333","","Ikeda, T.; Kodaira, T.; Ohshima, K.; Izumi, F.; Kamiyama, T.","Neutron powder diffraction study of potassium clusters in zeolite K-LTA","Chemical Physics Letters","2000","318","","93","101","","","","","","","","","","","","","","","","","","","","","","has coordinates","140886","2020-10-21","18:00:00",""
"9000045","5.47","","5.47","","5.47","","90","","90","","90","","163.667","","","","","","","","","","","","","3","F 2 3","F 2 2 3","196","","","Bornite","- Cu5 Fe S4 -","- Cu5 Fe S4 -","- Cu5 Fe S4 -","1","0.0208333","","Tunell, G.; Adams, C. E.","On the symmetry and crystal structure of bornite","American Mineralogist","1949","34","","824","829","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9004772","15.463","","15.463","","15.463","","90","","90","","90","","3697.27","","","","","","","","","","","","Johanngeorgenstadt, Saxony, Germany","7","F 2 3","F 2 2 3","196","","","","- C8 H22 Cl1.5 Cu12 K2.5 Na O40 -","- C8 H22 Cl1.5 Cu12 K2.5 Na O40 -","- C32 H88 Cl6 Cu48 K10 Na4 O160 -","4","0.0833333","","Sokolova E V; Hawthorne F C; Roberts A C","The crystal structure of an anthropogenic Cu-K-Na-hydro-hyddroxyl-carbonate-chloride from Johanngeorgenstadt, Saxony, Germany Locality: Johanngeorgenstadt, Saxony, Germany","The Canadian Mineralogist","2003","41","","926","936","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9012228","10.277","","10.277","","10.277","","90","","90","","90","","1085.42","","","","","","","","","","","","cinnabar mine, Tripuhy, Ouro Preto, Minas Gerias, Brazil","9","F 2 3","F 2 2 3","196","","","Lewisite","- Al0.06 Ca1.04 Fe0.19 H0.91 Mn0.07 Na0.01 O6.91 Sb1.64 Ti0.76 -","- Al0.06 Ca1.04 Fe0.19 Mn0.07 Na0.01 O6.91 Sb1.6398 Ti0.76 -","- Al0.48 Ca8.32 Fe1.52 Mn0.56 Na0.08 O55.28 Sb13.1184 Ti6.08 -","8","0.166667","","Rouse, R. C.; Dunn, P. J.; Peacor, D. R.; Wang, L.","Structural studies of the natural antimonian pyrochlores I. Mixed valency, cation site splitting, and symmetry reduction in lewisite Sample: F23 refinement","Journal of Solid State Chemistry","1998","141","","562","569","10.1006/jssc.1998.8019","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""