# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-16T20:44:02+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'I 4 3 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
"1008022","6.221","0.005","6.221","0.005","6.221","0.005","90","","90","","90","","240.8","","","","","","","","","","","","","2","I 4 3 2","I 4 2 3","211","","MOLYBDENUM FLUORIDE","","- F6 Mo -","- F6 Mo -","- F12 Mo2 -","2","0.0416667","","Levy, J H; Sanger, P L; Taylor, J C; Wilson, P W","The structures of fluorides. XI. Cubic harmonic analysis of the neutron diffraction pattern of the body-centred cubic phase of Mo F~6~ at 266 K","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1065","1067","10.1107/S0567740875004505","","","","","","0.103","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1515552","30.1892","0.0002","30.1892","0.0002","30.1892","0.0002","90","","90","","90","","27514.1","0.3","296","2","296","2","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C32 H28 Cu2 O14 -","- C32 H4 Cu2 O14 -","- C192 H24 Cu12 O84 -","6","0.125","","Jeong, Kyung Seok; Go, Yong Bok; Shin, Sung Min; Lee, Suk Joong; Kim, Jaheon; Yaghi, Omar M.; Jeong, Nakcheol","Asymmetric catalytic reactions by NbO-type chiral metal‒organic frameworks","Chemical Science","2011","2","5","877","","10.1039/c0sc00582g","","","1.54178","CuKα","","0.1328","0.0613","","","0.1891","0.2227","","","","","","0.741","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1537751","6.186","","6.186","","6.186","","90","","90","","90","","236.717","","","","","","","","","","","","","2","I 4 3 2","I 4 2 3","211","","","","- Hg4 Pt -","- Hg4 Pt -","- Hg8 Pt2 -","2","0.0416667","","Bauer, E.; Nowotny, H.; Stempfl, A.","Roentgenographische Untersuchungen im System: Platin-Quecksilber","Monatshefte fuer Chemie (-108,1977)","1953","84","","211","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1568928","36.6848","0.0004","36.6848","0.0004","36.6848","0.0004","90","","90","","90","","49369.5","0.9","293","2","293","2","","","","","","","","5","I 4 3 2","I 4 2 3","211","","","","- C94 H100 Al8 N24 O38 -","- C94 H108 Al8 N24 O36 -","- C1128 H1296 Al96 N288 O432 -","12","0.25","","Luo, Dan; Xiao, Han; Zhang, Min-Yi; Li, Shang-Da; He, Liang; Lv, Hong; Li, Chun-Sen; Lin, Qi-Pu; Fang, Wei-Hui; Zhang, Jian","Accurate binding of porous aluminum molecular ring catalysts with the substrate.","Chemical science","2023","14","20","5396","5404","10.1039/d3sc01260c","","x-ray","1.3405","GaKα","","0.07","0.0589","","","0.1402","0.1468","","","","","","1.051","","","","has coordinates,has disorder","284230","2023-06-05","04:04:45",""
"1568931","36.617","0.0003","36.617","0.0003","36.617","0.0003","90","","90","","90","","49096.2","0.7","99.99","0.1","99.99","0.1","","","","","","","","5","I 4 3 2","I 4 2 3","211","","","","- C88 H88 Al8 N24 O36 -","- C88 H96 Al8 N24 O36 -","- C1056 H1152 Al96 N288 O432 -","12","0.25","","Luo, Dan; Xiao, Han; Zhang, Min-Yi; Li, Shang-Da; He, Liang; Lv, Hong; Li, Chun-Sen; Lin, Qi-Pu; Fang, Wei-Hui; Zhang, Jian","Accurate binding of porous aluminum molecular ring catalysts with the substrate.","Chemical science","2023","14","20","5396","5404","10.1039/d3sc01260c","","x-ray","1.54184","CuKα","","0.057","0.0521","","","0.1355","0.1392","","","","","","1.009","","","","has coordinates,has disorder","284230","2023-06-05","04:04:46",""
"1570025","44.7093","0.0005","44.7093","0.0005","44.7093","0.0005","90","","90","","90","","89370.4","1.7","100","0.1","100","0.1","","","","","","","","6","I 4 3 2","I 4 2 3","211","","","","- C43.5 H38 Co3 N3 O15 S6 -","- C35.5 H10 Co3 N O15 S6 -","- C852 H240 Co72 N24 O360 S144 -","24","0.5","","Barsukova, Marina; Sapianik, Aleksandr; Guillerm, Vincent; Shkurenko, Aleksander; Shaikh, Aslam C.; Parvatkar, Prakash; Bhatt, Prashant M.; Bonneau, Mickaele; Alhaji, Abdulhadi; Shekhah, Osama; Balestra, Salvador R. G.; Semino, Rocio; Maurin, Guillaume; Eddaoudi, Mohamed","Face-directed assembly of tailored isoreticular MOFs using centring structure-directing agents","Nature Synthesis","2023","","","1","","10.1038/s44160-023-00401-8","","","1.54178","CuKα","","0.0525","0.038","","","0.105","0.1131","","","","","","1.026","","","","has coordinates,has disorder","286614","2023-10-02","17:51:36",""
"1570691","2.3094","","2.3094","","2.3094","","90","","90","","90","","12.317","","","","","","","","","","","","","3","I 4 3 2","I 4 2 3","211","","","","- C12 N4 O3 -","- C12 N4 O3 -","- C24 N8 O6 -","2","0.0416667","","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","10:21:05",""
"2300554","6.2001","","6.2001","","6.2001","","90","","90","","90","","238.34","","","","","","","","","","","","","2","I 4 3 2","I 4 2 3","211","","","","- Hg4 Pt -","- Hg4 Pt -","- Hg8 Pt2 -","2","0.0416667","","Lahiri, S.K.; Angilello, J.; Natan, M.","Precise lattice parameter determination of Pt Hg4","Journal of Applied Crystallography","1982","15","","100","101","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4124801","12.6563","0.0004","12.6563","0.0004","12.6563","0.0004","90","","90","","90","","2027.31","0.11","121.65","0.1","121.65","0.1","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 Gd3 O9.99 -","- C H7.02 Gd3 O9.99 -","- C8 H56.16 Gd24 O79.92 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0394","0.0387","","","0.0868","0.0872","","","","","","1.274","","","","has coordinates","173448","2020-10-21","18:00:00",""
"4124802","12.59","0.0003","12.59","0.0003","12.59","0.0003","90","","90","","90","","1995.62","0.08","121.1","0.2","121.1","0.2","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 O9.99 Tb3 -","- C H7.02 O9.99 Tb3 -","- C8 H56.16 O79.92 Tb24 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0358","0.032","","","0.0883","0.0924","","","","","","1.167","","","","has coordinates","173448","2020-10-21","18:00:00",""
"4124803","12.5189","0.0003","12.5189","0.0003","12.5189","0.0003","90","","90","","90","","1962","0.08","121.3","0.14","121.3","0.14","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 Dy3 O9.99 -","- C H7.02 Dy3 O9.99 -","- C8 H56.16 Dy24 O79.92 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0382","0.0328","","","0.0862","0.0923","","","","","","1.101","","","","has coordinates","173448","2020-10-21","18:00:00",""
"4124804","12.6606","0.0004","12.6606","0.0004","12.6606","0.0004","90","","90","","90","","2029.38","0.11","130","2","130","","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 Gd3 O9.99 -","- C H6.99 Gd3 O9.99 -","- C8 H55.92 Gd24 O79.92 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0436","0.0418","","","0.0937","0.0948","","","","","","1.203","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4124805","12.669","0.0007","12.669","0.0007","12.669","0.0007","90","","90","","90","","2033.42","0.19","130","2","130","","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 Gd3 O9.99 -","- C H6.96 Gd3 O9.99 -","- C8 H55.68 Gd24 O79.92 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0726","0.0695","","","0.1562","0.1576","","","","","","1.272","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4124806","12.6589","0.0004","12.6589","0.0004","12.6589","0.0004","90","","90","","90","","2028.56","0.11","130","2","130","","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 Gd3 O9.99 -","- C H6.96 Gd3 O9.99 -","- C8 H55.68 Gd24 O79.92 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0441","0.0435","","","0.0965","0.0969","","","","","","1.217","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4124807","12.6541","0.0005","12.6541","0.0005","12.6541","0.0005","90","","90","","90","","2026.25","0.14","130","2","130","","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 Gd3 O9.99 -","- C H6.96 Gd3 O9.99 -","- C8 H55.68 Gd24 O79.92 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0806","0.0773","","","0.1445","0.1467","","","","","","1.013","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4124808","12.6596","0.0004","12.6596","0.0004","12.6596","0.0004","90","","90","","90","","2028.9","0.11","130","2","130","","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 Gd3 O9.99 -","- C H6.96 Gd3 O9.99 -","- C8 H55.68 Gd24 O79.92 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0487","0.0473","","","0.1037","0.1042","","","","","","1.208","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4124809","12.6597","0.0005","12.6597","0.0005","12.6597","0.0005","90","","90","","90","","2028.94","0.14","130","2","130","","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 Gd3 O9.99 -","- C H6.96 Gd3 O9.99 -","- C8 H55.68 Gd24 O79.92 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0456","0.0442","","","0.1039","0.1044","","","","","","1.124","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4124810","12.4967","0.0004","12.4967","0.0004","12.4967","0.0004","90","","90","","90","","1951.58","0.11","293","2","293","2","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 Dy3 O9.99 -","- C H7.02 Dy3 O9.99 -","- C8 H56.16 Dy24 O79.92 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.044","0.0368","","","0.0953","0.0997","","","","","","1.086","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4124811","12.494","0.0002","12.494","0.0002","12.494","0.0002","90","","90","","90","","1950.31","0.05","293","2","293","2","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 Dy3 O9.99 -","- C H7.02 Dy3 O9.99 -","- C8 H56.16 Dy24 O79.92 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0401","0.0351","","","0.0916","0.0944","","","","","","1.109","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4124812","12.4967","0.0004","12.4967","0.0004","12.4967","0.0004","90","","90","","90","","1951.58","0.11","293","2","293","2","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 Dy3 O9.99 -","- C H7.02 Dy3 O9.99 -","- C8 H56.16 Dy24 O79.92 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0453","0.0379","","","0.0969","0.1018","","","","","","1.069","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4124813","12.5137","0.0003","12.5137","0.0003","12.5137","0.0003","90","","90","","90","","1959.55","0.08","121.95","0.1","121.95","0.1","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 O9.99 Tb3 -","- C H6.96 O9.99 Tb3 -","- C8 H55.68 O79.92 Tb24 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.041","0.0371","","","0.0983","0.1014","","","","","","1.145","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4124814","12.4988","0.0004","12.4988","0.0004","12.4988","0.0004","90","","90","","90","","1952.56","0.11","121.75","0.1","121.75","0.1","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 O9.99 Tb3 -","- C H6.96 O9.99 Tb3 -","- C8 H55.68 O79.92 Tb24 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0404","0.0339","","","0.0877","0.0921","","","","","","1.124","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4124815","12.5234","0.0003","12.5234","0.0003","12.5234","0.0003","90","","90","","90","","1964.11","0.08","121.95","0.1","121.95","0.1","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C H6.99 O9.99 Tb3 -","- C H6.96 O9.99 Tb3 -","- C8 H55.68 O79.92 Tb24 -","8","0.166667","","Dong, Jie; Cui, Ping; Shi, Peng-Fei; Cheng, Peng; Zhao, Bin","Ultrastrong Alkali-Resisting Lanthanide-Zeolites Assembled by [Ln60] Nanocages.","Journal of the American Chemical Society","2015","137","51","15988","15991","10.1021/jacs.5b10000","","","0.71073","MoKα","","0.0458","0.0392","","","0.098","0.1039","","","","","","1.109","","","","has coordinates","173449","2020-10-21","18:00:00",""
"4133957","31.0134","0.0014","31.0134","0.0014","31.0134","0.0014","90","","90","","90","","29830","2","100","2","100.07","","","","","","","","","4","I 4 3 2","I 4 2 3","211","","","","- C48 H80 K2 O40 -","- C48 H80 K2 O40 -","- C576 H960 K24 O480 -","12","0.25","","Shen, Dengke; Cooper, James A.; Li, Peng; Guo, Qing-Hui; Cai, Kang; Wang, Xingjie; Wu, Huang; Chen, Hongliang; Zhang, Long; Jiao, Yang; Qiu, Yunyan; Stern, Charlotte L.; Liu, Zhichang; Sue, Andrew C.-H.; Yang, Ying-Wei; Alsubaie, Fehaid M.; Farha, Omar K.; Stoddart, J. Fraser","Organic Counteranion Co-assembly Strategy for the Formation of γ-Cyclodextrin-Containing Hybrid Frameworks.","Journal of the American Chemical Society","2020","142","4","2042","2050","10.1021/jacs.9b12527","","","0.71073","MoKα","","0.1369","0.1085","","","0.3079","0.341","","","","","","1.347","","","","has coordinates","247525","2020-10-21","18:00:00",""
"4323777","19.671","0.001","19.671","0.001","19.671","0.001","90","","90","","90","","7611.7","0.7","293","2","293","2","","","","","","","","4","I 4 3 2","I 4 2 3","211","","tetrakis-(diphenylformamidinate)diplatinate(II)","","- C52 H44 N8 Pt2 -","- C56 N4 Pt2 -","- C336 N24 Pt12 -","6","0.125","","F. Albert Cotton; John H. Matonic; Carlos A. Murillo","Synthesis and Structural Studies of Platinum Complexes Containing Monodentate, Bridging, and Chelating Formamidine Ligands","Inorganic Chemistry","1996","35","","498","503","10.1021/ic950741e","","","1.54184","CuKα","","0.0695","0.05","","0.194","0.1375","","","","1.155","1.203","1.203","","","","","has coordinates,has disorder","179340","2020-10-21","18:00:00",""
"4503521","28.239","0.019","28.239","0.019","28.239","0.019","90","","90","","90","","22519","3","200","","200","","","","","","","","","7","I 4 3 2","I 4 2 3","211","","[Cu6(OH)6(TPMBA-4)8](BF4)3(OH)3-85(H2O)","","- C216 H515 B3 Cu6 F12 N48 O118 -","- C216 H192 B3 Cu6 F12.36 N48 O118 -","- C432 H384 B6 Cu12 F24.72 N96 O236 -","2","0.0416667","","Wang, Yan; Okamura, Taka-aki; Sun, Wei-Yin; Ueyama, Norikazu","Large (H2O)56(OH)6and (H2O)20Clusters inside a Nanometer-Sized M6L8Cage Constructed by Five-Coordinated Copper(II) and Flexible Carboxamide-Containing Tripodal Ligand","Crystal Growth & Design","2008","8","3","802","","10.1021/cg701242z","","","0.71075","MoKα","","0.1812","0.1573","","","0.4066","0.4236","","","","","","1.67","","","","has coordinates","179569","2020-10-21","18:00:00",""
"4507523","22.375","0.002","22.375","0.002","22.375","0.002","90","","90","","90","","11201.8","1.7","100","2","100","2","","","","","","","","5","I 4 3 2","I 4 2 3","211","","","","- C30 H23 In N4 S3 -","- C30 H23 In N4 S3 -","- C360 H276 In12 N48 S36 -","12","0.25","","Heine, Johanna; Hołyńska, Małgorzata; Reuter, Marco; Haas, Benedikt; Chatterjee, Sangam; Koch, Martin; Gries, Katharina I.; Volz, Kerstin; Dehnen, Stefanie","In(SAr)3As a Building Block for 3D and Helical Coordination Polymers","Crystal Growth & Design","2013","13","3","1252","","10.1021/cg301724v","","","0.71073","MoKα","","0.0881","0.0863","","","0.2173","0.2199","","","","","","1.016","","","","has coordinates,has disorder","179611","2020-10-21","18:00:00",""
"7100003","29.5764","0.0013","29.5764","0.0013","29.5764","0.0013","90","","90","","90","","25872","2","150","2","150","2","","","","","","","","7","I 4 3 2","I 4 2 3","211","","","","- C60 H77.5 F4 N6 Na Ni4 O13.25 -","- C60 H77 F4 N8 Na1.02 Ni4 O13.25 -","- C720 H924 F48 N96 Na12.24 Ni48 O159 -","12","0.25","","R. Winpenny; Guillem. Aromi; Aidan Bell; S. J. Teat; Wolfgang Wernsdorfer","Synthesis and Characterisation of a {Ni8} Single Molecule Magnet and A Related Cage","Chemical Communications","2005","","","","","10.1039/b500581g","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","287753","2023-11-23","09:34:44",""
"7103828","25.796","0.005","25.796","0.005","25.796","0.005","90","","90","","90","","17166","6","220","2","220","2","","","","","","","","7","I 4 3 2","I 4 2 3","211","","","","- C34 H65 B4 F16 N9 Ni6 S8 -","- C34 H64 B4 F16 N9 Ni6 S8 -","- C408 H768 B48 F192 N108 Ni72 S96 -","12","0.25","","Amoroso, Angelo J.; Chung, Simon S. M.; Spencer, Douglas J. E.; Danks, Jonathan P.; Glenny, Mark W.; Blake, Alexander J.; Cooke, Paul A.; Wilson, Claire; Schröder, Martin","Pinwheel motifs: formation of unusual homo- and hetero-nuclear aggregates via bridging thiolates","Chemical Communications (Cambridge, United Kingdom)","2003","","16","2020","2021","10.1039/b303851c","","","0.71073","MoKα","","0.103","0.066","","","0.113","0.129","","","","","","1.13","","","","has coordinates,has disorder","210434","2020-10-21","18:00:00",""
"7120271","31.0197","0.0011","31.0197","0.0011","31.0197","0.0011","90","","90","","90","","29847.8","1.8","100","2","100","","","","","","","","","5","I 4 3 2","I 4 2 3","211","","","","- C48 H81 N O39 Rb2 -","- C48 H81 N O39 Rb2 -","- C576 H972 N12 O468 Rb24 -","12","0.25","","Hartlieb, Karel J.; Peters, Aaron William; Wang, Timothy C.; Deria, Pravas; Farha, Omar; Hupp, J. T.; Stoddart, J. Fraser","Functionalised cyclodextrin-based metal-organic frameworks","Chem. Commun.","2017","","","","","10.1039/C7CC03345A","","","1.54178","CuKα","","0.0637","0.0586","","","0.1967","0.204","","","","","","1.082","","","","has coordinates,has disorder","197786","2020-10-21","18:00:00",""
"7210999","33.0001","0.0004","33.0001","0.0004","33.0001","0.0004","90","","90","","90","","35937.3","0.8","293","2","293","2","","","","","","","","5","I 4 3 2","I 4 2 3","211","","","","- C330 H534 N51 O75 Tb3 -","- C132 H72 O27 Tb3 -","- C528 H288 O108 Tb12 -","4","0.0833333","","He, Yabing; Furukawa, Hiroyasu; Wu, Chuande; O'Keeffe, Michael; Chen, Banglin","A mesoporous lanthanide‒organic framework constructed from a dendritic hexacarboxylate with cages of 2.4 nm","CrystEngComm","2013","15","45","9328","","10.1039/c3ce41062e","","","0.71073","MoKα","","0.1777","0.0698","","","0.1495","0.1675","","","","","","1.052","","","","has coordinates","180440","2020-10-21","18:00:00",""
"7220163","28.9058","0.0004","28.9058","0.0004","28.9058","0.0004","90","","90","","90","","24152.1","0.6","296","2","296","2","","","","","","","","7","I 4 3 2","I 4 2 3","211","","","","- C84 H158 Cu3 N24 O170 P4 W36 -","- C84 H84 Cu3 N24 O142 P4 W36 -","- C336 H336 Cu12 N96 O568 P16 W144 -","4","0.0833333","","Wang, Xiuli; Chang, Zhihan; Lin, Hongyan; Xu, Chuang; Luan, Jian; Liu, Guocheng; Tian, Aixiang","A novel polyoxometalate templated microporous metal‒organic framework with electrochemical properties","RSC Adv.","2015","","","","","10.1039/C5RA06204G","","","0.71073","MoKα","","0.0235","0.0229","","","0.0591","0.0594","","","","","","1.029","","","","has coordinates,has disorder","135739","2020-10-21","18:00:00",""
"7227776","31.3469","0.0011","31.3469","0.0011","31.3469","0.0011","90","","90","","90","","30802.3","1.9","295","","295","","","","160000","","","","","4","I 4 3 2","I 4 2 3","211","γ-cyclodextrin-metal-organic framework","catena-((μ8-γ-Cyclodextrin)-di-potassium dihydroxide)","","- C48 H82 K2 O42 -","- C48 H80 K2 O42 -","- C576 H960 K24 O504 -","12","0.25","","Patyk-Kaźmierczak, Ewa; Warren, Mark R.; Allan, David R.; Katrusiak, Andrzej","Pressure inverse solubility and polymorphism of an edible γ-cyclodextrin-based metal-organic framework.","Physical chemistry chemical physics : PCCP","2017","19","13","9086","9091","10.1039/c7cp00593h","","x-ray","0.6889","synchrotron","","0.0794","0.0745","","","0.1998","0.2092","","","","","","1.13","","","","has coordinates","204138","2020-10-21","18:00:00",""
"7227777","31.3031","0.0011","31.3031","0.0011","31.3031","0.0011","90","","90","","90","","30673.4","1.9","295","","295","","","","250000","","","","","4","I 4 3 2","I 4 2 3","211","γ-cyclodextrin-metal-organic framework","catena-((μ8-γ-Cyclodextrin)-di-potassium dihydroxide)","","- C48 H82 K2 O42 -","- C48 H80 K2 O42 -","- C576 H960 K24 O504 -","12","0.25","","Patyk-Kaźmierczak, Ewa; Warren, Mark R.; Allan, David R.; Katrusiak, Andrzej","Pressure inverse solubility and polymorphism of an edible γ-cyclodextrin-based metal-organic framework.","Physical chemistry chemical physics : PCCP","2017","19","13","9086","9091","10.1039/c7cp00593h","","x-ray","0.6889","synchrotron","","0.1071","0.0955","","","0.2583","0.2807","","","","","","1.189","","","","has coordinates","204138","2020-10-21","18:00:00",""
"7227778","31.2695","0.0018","31.2695","0.0018","31.2695","0.0018","90","","90","","90","","30575","3","295","","295","","","","330000","","","","","4","I 4 3 2","I 4 2 3","211","γ-cyclodextrin-metal-organic framework","catena-((μ8-γ-Cyclodextrin)-di-potassium dihydroxide)","","- C48 H82 K2 O42 -","- C48 H80 K2 O42 -","- C576 H960 K24 O504 -","12","0.25","","Patyk-Kaźmierczak, Ewa; Warren, Mark R.; Allan, David R.; Katrusiak, Andrzej","Pressure inverse solubility and polymorphism of an edible γ-cyclodextrin-based metal-organic framework.","Physical chemistry chemical physics : PCCP","2017","19","13","9086","9091","10.1039/c7cp00593h","","x-ray","0.6889","synchrotron","","0.1019","0.0814","","","0.2122","0.2317","","","","","","1.035","","","","has coordinates","204138","2020-10-21","18:00:00",""
"7227779","31.238","0.002","31.238","0.002","31.238","0.002","90","","90","","90","","30482","3","295","","295","","","","410000","","","","","4","I 4 3 2","I 4 2 3","211","γ-cyclodextrin-metal-organic framework","catena-((μ8-γ-Cyclodextrin)-di-potassium dihydroxide)","","- C48 H82 K2 O42 -","- C48 H80 K2 O42 -","- C576 H960 K24 O504 -","12","0.25","","Patyk-Kaźmierczak, Ewa; Warren, Mark R.; Allan, David R.; Katrusiak, Andrzej","Pressure inverse solubility and polymorphism of an edible γ-cyclodextrin-based metal-organic framework.","Physical chemistry chemical physics : PCCP","2017","19","13","9086","9091","10.1039/c7cp00593h","","x-ray","0.6889","synchrotron","","0.1248","0.0922","","","0.2328","0.2494","","","","","","0.96","","","","has coordinates","204138","2020-10-21","18:00:00",""
"7227780","31.223","0.003","31.223","0.003","31.223","0.003","90","","90","","90","","30439","5","295","","295","","","","490000","","","","","4","I 4 3 2","I 4 2 3","211","γ-cyclodextrin-metal-organic framework","catena-((μ8-γ-Cyclodextrin)-di-potassium dihydroxide)","","- C48 H82 K2 O42 -","- C48 H80 K2 O42 -","- C576 H960 K24 O504 -","12","0.25","","Patyk-Kaźmierczak, Ewa; Warren, Mark R.; Allan, David R.; Katrusiak, Andrzej","Pressure inverse solubility and polymorphism of an edible γ-cyclodextrin-based metal-organic framework.","Physical chemistry chemical physics : PCCP","2017","19","13","9086","9091","10.1039/c7cp00593h","","x-ray","0.6889","synchrotron","","0.2266","0.067","","","0.1871","0.2693","","","","","","0.94","","","","has coordinates","204138","2020-10-21","18:00:00",""
"7227781","31.179","0.011","31.179","0.011","31.179","0.011","90","","90","","90","","30310","19","295","","295","","","","570000","","","","","4","I 4 3 2","I 4 2 3","211","γ-cyclodextrin-metal-organic framework","catena-((μ8-γ-Cyclodextrin)-di-potassium dihydroxide)","","- C48 H82 K2 O42 -","- C48 H80 K2 O42 -","- C576 H960 K24 O504 -","12","0.25","","Patyk-Kaźmierczak, Ewa; Warren, Mark R.; Allan, David R.; Katrusiak, Andrzej","Pressure inverse solubility and polymorphism of an edible γ-cyclodextrin-based metal-organic framework.","Physical chemistry chemical physics : PCCP","2017","19","13","9086","9091","10.1039/c7cp00593h","","x-ray","0.71073","MoKα","","0.0699","0.064","","","0.1342","0.1406","","","","","","0.944","","","","has coordinates","204138","2020-10-21","18:00:00",""
"7227782","30.988","0.003","30.988","0.003","30.988","0.003","90","","90","","90","","29756","5","295","","295","","","","860000","","","","","4","I 4 3 2","I 4 2 3","211","γ-cyclodextrin-metal-organic framework","catena-((μ8-γ-Cyclodextrin)-di-potassium dihydroxide)","","- C48 H82 K2 O42 -","- C48 H80 K2 O42 -","- C576 H960 K24 O504 -","12","0.25","","Patyk-Kaźmierczak, Ewa; Warren, Mark R.; Allan, David R.; Katrusiak, Andrzej","Pressure inverse solubility and polymorphism of an edible γ-cyclodextrin-based metal-organic framework.","Physical chemistry chemical physics : PCCP","2017","19","13","9086","9091","10.1039/c7cp00593h","","x-ray","0.71073","MoKα","","0.0863","0.0863","","","0.2187","0.2187","","","","","","1.126","","","","has coordinates","204138","2020-10-21","18:00:00",""
"7227783","30.968","0.006","30.968","0.006","30.968","0.006","90","","90","","90","","29699","10","295","","295","","","","990000","","","","","4","I 4 3 2","I 4 2 3","211","γ-cyclodextrin-metal-organic framework","catena-((μ8-γ-Cyclodextrin)-di-potassium dihydroxide)","","- C48 H82 K2 O42 -","- C48 H80 K2 O42 -","- C576 H960 K24 O504 -","12","0.25","","Patyk-Kaźmierczak, Ewa; Warren, Mark R.; Allan, David R.; Katrusiak, Andrzej","Pressure inverse solubility and polymorphism of an edible γ-cyclodextrin-based metal-organic framework.","Physical chemistry chemical physics : PCCP","2017","19","13","9086","9091","10.1039/c7cp00593h","","x-ray","0.71073","MoKα","","0.0869","0.0865","","","0.2315","0.2326","","","","","","1.174","","","","has coordinates","204138","2020-10-21","18:00:00",""
"7227784","30.898","0.003","30.898","0.003","30.898","0.003","90","","90","","90","","29498","5","295","","295","","","","1360000","","","","","4","I 4 3 2","I 4 2 3","211","γ-cyclodextrin-metal-organic framework","catena-((μ8-γ-Cyclodextrin)-di-potassium dihydroxide)","","- C48 H82 K2 O42 -","- C48 H80 K2 O42 -","- C576 H960 K24 O504 -","12","0.25","","Patyk-Kaźmierczak, Ewa; Warren, Mark R.; Allan, David R.; Katrusiak, Andrzej","Pressure inverse solubility and polymorphism of an edible γ-cyclodextrin-based metal-organic framework.","Physical chemistry chemical physics : PCCP","2017","19","13","9086","9091","10.1039/c7cp00593h","","x-ray","0.71073","MoKα","","0.0924","0.0907","","","0.2341","0.235","","","","","","1.283","","","","has coordinates","204138","2020-10-21","18:00:00",""
"7227789","31.2093","0.0016","31.2093","0.0016","31.2093","0.0016","90","","90","","90","","30398","3","269.99","0.1","269.99","0.1","","","","","","","","4","I 4 3 2","I 4 2 3","211","γ-cyclodextrin-metal-organic framework","catena-((μ8-γ-Cyclodextrin)-di-potassium dihydroxide)","","- C48 H82 K2 O42 -","- C48 H80 K2 O42 -","- C576 H960 K24 O504 -","12","0.25","","Patyk-Kaźmierczak, Ewa; Warren, Mark R.; Allan, David R.; Katrusiak, Andrzej","Pressure inverse solubility and polymorphism of an edible γ-cyclodextrin-based metal-organic framework.","Physical chemistry chemical physics : PCCP","2017","19","13","9086","9091","10.1039/c7cp00593h","","x-ray","0.71073","MoKα","","0.0652","0.0594","","","0.1473","0.1534","","","","","","1.086","","","","has coordinates","204138","2020-10-21","18:00:00",""
"7227790","31.2093","0.0007","31.2093","0.0007","31.2093","0.0007","90","","90","","90","","30398.5","1.2","295.01","0.1","295.01","0.1","","","","","","","","4","I 4 3 2","I 4 2 3","211","γ-cyclodextrin-metal-organic framework","catena-((μ8-γ-Cyclodextrin)-di-potassium dihydroxide)","","- C48 H82 K2 O42 -","- C48 H80 K2 O42 -","- C576 H960 K24 O504 -","12","0.25","","Patyk-Kaźmierczak, Ewa; Warren, Mark R.; Allan, David R.; Katrusiak, Andrzej","Pressure inverse solubility and polymorphism of an edible γ-cyclodextrin-based metal-organic framework.","Physical chemistry chemical physics : PCCP","2017","19","13","9086","9091","10.1039/c7cp00593h","","x-ray","0.71073","MoKα","","0.0522","0.0485","","","0.1296","0.1326","","","","","","1.092","","","","has coordinates","204138","2020-10-21","18:00:00",""
"7228543","27.973","0.001","27.973","0.001","27.973","0.001","90","","90","","90","","21888.6","1.4","293","2","293","2","","","","","","","","6","I 4 3 2","I 4 2 3","211","","","","- C68 H79.5 Cd3 K6 N16 O39.75 -","- C54 H24 Cd3 K6 N12 O33.75 -","- C432 H192 Cd24 K48 N96 O270 -","8","0.166667","","Xu, Xiao-Wu; Tian, Chong-Bin; Du, Shaowu","Synthesis, structure and luminescent properties of two Cd(II)/M(I) (M = K, Rb) interpenetrated heterometallic frameworks based on giant double-walled cages","CrystEngComm","2017","","","","","10.1039/C7CE00803A","","","0.71073","MoKα","","0.0426","0.0415","","","0.1083","0.1094","","","","","","1.031","","","","has coordinates","198149","2020-10-21","18:00:00",""
"7228544","28.0152","0.0016","28.0152","0.0016","28.0152","0.0016","90","","90","","90","","21988","2","293","2","293","2","","","","","","","","6","I 4 3 2","I 4 2 3","211","","","","- C68 H79.5 Cd3 N16 O39.75 Rb6 -","- C54 H24 Cd3 N12 O33.75 Rb6 -","- C432 H192 Cd24 N96 O270 Rb48 -","8","0.166667","","Xu, Xiao-Wu; Tian, Chong-Bin; Du, Shaowu","Synthesis, structure and luminescent properties of two Cd(II)/M(I) (M = K, Rb) interpenetrated heterometallic frameworks based on giant double-walled cages","CrystEngComm","2017","","","","","10.1039/C7CE00803A","","","0.71073","MoKα","","0.0592","0.0567","","","0.1596","0.1621","","","","","","1.033","","","","has coordinates","198149","2020-10-21","18:00:00",""
"7237210","15.1119","0.0002","15.1119","0.0002","15.1119","0.0002","90","","90","","90","","3451.1","0.08","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","","","","- C5.34 H16.02 Al3.95 N1.34 O16.94 P2.56 Si1.49 -","- C5.3408 H16.0224 Al3.9512 N1.3352 O16.944 P2.56 Si1.4888 -","- C32.0448 H96.1344 Al23.7072 N8.0112 O101.664 P15.36 Si8.9328 -","6","0.125","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.0271","3.501","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7237211","15.1697","0.0001","15.1697","0.0001","15.1697","0.0001","90","","90","","90","","3490.85","0.04","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","DNL-6-DEA","","","- C5.33 H15.92 Al3.95 N1.33 O18.08 P2.7 Si1.35 -","- C5.3344 H15.9192 Al3.95 N1.3336 O18.08 P2.7 Si1.35 -","- C32.0064 H95.5152 Al23.7 N8.0016 O108.48 P16.2 Si8.1 -","6","0.125","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.011","1.489","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7237212","15.163","0.0001","15.163","0.0001","15.163","0.0001","90","","90","","90","","3486.22","0.04","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","","","","- C13.16 H37.26 Al7.43 N2.47 O32.98 P5.33 Si3.23 -","- C14.8032 H39.1072 Al7.4336 N2.4672 O32.9813 P5.3336 Si3.2328 -","- C44.4096 H117.322 Al22.3008 N7.4016 O98.944 P16.0008 Si9.6984 -","3","0.0625","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.0166","2.078","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7237213","15.1588","0.0001","15.1588","0.0001","15.1588","0.0001","90","","90","","90","","3483.33","0.04","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","","","","- C6.17 H17.22 Al3.73 N1.23 O16 P2.45 Si1.82 -","- C6.168 H17.2224 Al3.7332 N1.2336 O16 P2.45 Si1.8168 -","- C37.008 H103.334 Al22.3992 N7.4016 O96 P14.7 Si10.9008 -","6","0.125","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.0506","4.119","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7237214","15.1545","0.0001","15.1545","0.0001","15.1545","0.0001","90","","90","","90","","3480.37","0.04","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","","","","- C5.58 H15.42 Al3.85 N1.12 O18.74 P2.95 Si1.2 -","- C5.584 H15.4184 Al3.85 N1.1168 O18.736 P2.95 Si1.2 -","- C33.504 H92.5104 Al23.1 N6.7008 O112.416 P17.7 Si7.2 -","6","0.125","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.0206","2.468","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7237215","15.1671","0.0001","15.1671","0.0001","15.1671","0.0001","90","","90","","90","","3489.05","0.04","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","","","","- C5.33 H15.24 Al3.77 N1.33 O18.26 P2.53 Si1.7 -","- C5.3344 H15.9032 Al3.7668 N1.3336 O18.256 P2.5332 Si1.7 -","- C32.0064 H95.4192 Al22.6008 N8.0016 O109.536 P15.1992 Si10.2 -","6","0.125","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.0208","1.686","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7237216","15.1935","0.0002","15.1935","0.0002","15.1935","0.0002","90","","90","","90","","3507.3","0.08","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","DNL-6-DMEDA","","","- C5.07 H21.64 Al3.32 N2.9 O20.81 P1.77 Si2.92 -","- C5.7984 H21.6352 Al3.3168 N2.8992 O20.8107 P1.7668 Si2.9164 -","- C34.7904 H129.811 Al19.9008 N17.3952 O124.864 P10.6008 Si17.4984 -","6","0.125","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.0227","2.667","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7237217","15.1454","0.0001","15.1454","0.0001","15.1454","0.0001","90","","90","","90","","3474.1","0.04","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","","","","- C5.92 H16.2 Al3.82 N1.18 O17.02 P3 Si1.18 -","- C5.916 H16.1984 Al3.8168 N1.1832 O17.0168 P3 Si1.1832 -","- C35.496 H97.1904 Al22.9008 N7.0992 O102.101 P18 Si7.0992 -","6","0.125","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.0174","1.46","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7237218","15.1568","0.0001","15.1568","0.0001","15.1568","0.0001","90","","90","","90","","3481.95","0.04","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","","","","- C6.08 H17.04 Al3.57 N1.22 O17.31 P2.38 Si2.05 -","- C6.084 H17.0352 Al3.5668 N1.2168 O17.3107 P2.3832 Si2.05 -","- C36.504 H102.211 Al21.4008 N7.3008 O103.864 P14.2992 Si12.3 -","6","0.125","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.0211","1.347","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7237220","15.1543","0.0001","15.1543","0.0001","15.1543","0.0001","90","","90","","90","","3480.23","0.04","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","DNL-6-EBA","","","- C6.2 H16.4 Al3.7 N1.03 O18.2 P2.77 Si1.53 -","- C6.2016 H16.404 Al3.7 N1.0336 O18.196 P2.7668 Si1.5332 -","- C37.2096 H98.424 Al22.2 N6.2016 O109.176 P16.6008 Si9.1992 -","6","0.125","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.0348","3.0377","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7237221","15.1503","0.0001","15.1503","0.0001","15.1503","0.0001","90","","90","","90","","3477.47","0.04","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","DNL-6-ECyA","","","- C14.4 H32.3 Al7.03 N1.8 O32 P5.33 Si3.63 -","- C14.4 H32.2992 Al7.0336 N1.8 O32 P5.3336 Si3.6328 -","- C43.2 H96.8976 Al21.1008 N5.4 O96 P16.0008 Si10.8984 -","3","0.0625","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.0321","2.005","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7237222","15.17","0.0002","15.17","0.0002","15.17","0.0002","90","","90","","90","","3491.06","0.08","25","","25","","","","","","","","","7","I 4 3 2","I 4 2 3","211","","","","- C4.6 H14.87 Al3.77 N1.53 O18.84 P2.7 Si1.53 -","- C4.6008 H14.8688 Al3.7668 N1.5336 O18.84 P2.7 Si1.5332 -","- C27.6048 H89.2128 Al22.6008 N9.2016 O113.04 P16.2 Si9.1992 -","6","0.125","","Yan, Nana; Wang, Lei; Liu, Xiaona; Wu, Pengfei; Sun, Tantan; Xu, Shutao; Han, Jingfeng; Guo, Peng; Tian, Peng; Liu, Zhongmin","A novel approach for facilitating the targeted synthesis of silicoaluminophosphates","Journal of Materials Chemistry A","2018","6","47","24186","","10.1039/C8TA08134D","powder diffraction","x-ray","1.5406","CuKa1","","","","","","","","","0.0445","4.172","","","","","","","has coordinates","237491","2020-10-21","18:00:00",""
"7709491","32.091","0.0003","32.091","0.0003","32.091","0.0004","90","","90","","90","","33048.3","0.6","172.99","0.1","172.99","0.1","","","","","","","","5","I 4 3 2","I 4 2 3","211","","","","- C66 H86 N8 O56 Ti18 -","- C66 H86 N8 O56 Ti18 -","- C396 H516 N48 O336 Ti108 -","6","0.125","","Gao, Chang; Liu, Caiyun; Said, Amir; Niu, Huihui; Wang, Dexin; Wang, Guo; Tung, Chen-Ho; Wang, Yifeng","Syntheses, structures and ligand binding modes of titanium-oxide complexes of 2-picolinate","Dalton Transactions","2022","","","","","10.1039/D1DT04170C","","x-ray","1.54178","CuKα","","0.1433","0.0904","","","0.2498","0.3016","","","","","","1.041","","","","has coordinates,has disorder","272980","2022-02-15","23:53:37",""
"7709834","39.5746","0.0014","39.5746","0.0014","39.5746","0.0014","90","","90","","90","","61980","4","273","2","273","2","","","","","","","","6","I 4 3 2","I 4 2 3","211","","","","- C20 H14 Cu5.5 K2.25 O33.38 Pr -","- C20 H14 Cu5.5 K2.216 O35.614 Pr -","- C960 H672 Cu264 K106.368 O1709.47 Pr48 -","48","1","","Xu, Xiongli; He, Yuan; Meng, Wei; Yao, Lu; Liu, Liangliang; Xu, Feng; Zhao, Chujun","Chiral Wheel Anions of Copper(II)-Early Lanthanides(III) with High Optical-Limiting Properties","Dalton Transactions","2022","","","","","10.1039/D2DT00117A","","","0.71073","MoKα","","0.0627","0.06","","","0.1696","0.1735","","","","","","1.068","","","","has coordinates,has disorder","273952","2022-03-24","23:57:49",""
"7709835","39.543","0.008","39.543","0.008","39.543","0.008","90","","90","","90","","61831","2","273","2","273","2","","","","","","","","6","I 4 3 2","I 4 2 3","211","","","","- C60 H42 Cu16.5 K6.75 O100.12 Pr3 -","- C60 H42 Cu16.5 K6.693 O106.422 Pr3 -","- C960 H672 Cu264 K107.088 O1702.75 Pr48 -","16","0.333333","","Xu, Xiongli; He, Yuan; Meng, Wei; Yao, Lu; Liu, Liangliang; Xu, Feng; Zhao, Chujun","Chiral Wheel Anions of Copper(II)-Early Lanthanides(III) with High Optical-Limiting Properties","Dalton Transactions","2022","","","","","10.1039/D2DT00117A","","","0.71073","MoKα","","0.065","0.0527","","","0.1407","0.1523","","","","","","1.059","","","","has coordinates,has disorder","273952","2022-03-24","23:57:49",""
"7709836","39.498","0.002","39.498","0.002","39.498","0.002","90","","90","","90","","61621","5","273","2","273","2","","","","","","","","6","I 4 3 2","I 4 2 3","211","","","","- C80 H52 Cu22 K9 Nd4 O133 -","- C80 H52 Cu22 K9 Nd4 O140.42 -","- C960 H624 Cu264 K108 Nd48 O1685.04 -","12","0.25","","Xu, Xiongli; He, Yuan; Meng, Wei; Yao, Lu; Liu, Liangliang; Xu, Feng; Zhao, Chujun","Chiral Wheel Anions of Copper(II)-Early Lanthanides(III) with High Optical-Limiting Properties","Dalton Transactions","2022","","","","","10.1039/D2DT00117A","","","0.71073","MoKα","","0.0438","0.0424","","","0.12","0.1213","","","","","","1.086","","","","has coordinates,has disorder","273952","2022-03-24","23:57:49",""
"9009560","8.817","","8.817","","8.817","","90","","90","","90","","685.429","","","","1243.15","","","","","","","","","5","I 4 3 2","I 4 2 3","211","","","Tsaregorodtsevite","- C8 Al N O12 Si5 -","- C8 Al1.00002 N O12 Si4.99998 -","- C16 Al2.00004 N2 O24 Si9.99996 -","2","0.0416667","","Sokolova, E. V.; Rybakov, V. B.; Pautov, L. A.; Pushcharovsky D Yu","Structural changes in tsaregorodtsevite Note: T = 970 C","Doklady Akademii Nauk SSSR","1993","332","","309","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""