Crystallography Open Database
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Searching space group like 'P -6 c 2'
COD ID ![]() |
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Cell parameters | Cell volume ![]() |
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9016710 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.5605; 6.5605; 9.6574 90; 90; 120 | 359.969 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 4.01 GPa American Mineralogist, 2012, 97, 1749-1763 |
9016221 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.5689; 6.5689; 9.6804 90; 90; 120 | 361.751 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 3.56 GPa American Mineralogist, 2012, 97, 1749-1763 |
9015194 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.5518; 6.5518; 9.6503 90; 90; 120 | 358.751 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 4.28 GPa American Mineralogist, 2012, 97, 1749-1763 |
9015046 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.6031; 6.6031; 9.71 90; 90; 120 | 366.645 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 2.14 GPa American Mineralogist, 2012, 97, 1749-1763 |
9014925 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.6094; 6.6094; 9.7239 90; 90; 120 | 367.871 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 1.12 GPa American Mineralogist, 2012, 97, 1749-1763 |
9014388 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.643; 6.643; 9.766 90; 90; 120 | 373.229 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 0.0001 GPa American Mineralogist, 2012, 97, 1749-1763 |
9009331 | CIF | Ba O9 Si3 Ti0.03 Zr0.97 | P -6 c 2 | 6.742; 6.742; 9.93 90; 90; 120 | 390.893 | Hawthorne, F. C. The crystal chemistry of the benitoite group minerals and structural relations in (Si3O9) ring structures Sample: "late-stage interstitial mineral in aegirine-riebeckite granite", Rockall Island, Scotland Neues Jahrbuch fur Mineralogie, Monatshefte, 1987, 1987, 16-30 |
9009330 | CIF | Ba O9 Si3 Sn0.77 Ti0.23 | P -6 c 2 | 6.7037; 6.7037; 9.824 90; 90; 120 | 382.339 | Hawthorne, F. C. The crystal chemistry of the benitoite group minerals and structural relations in (Si3O9) ring structures Sample: "occurs in small fractures and as scattered grains in recrystallized siliceous limestone at Santa Cruz, Ca" Neues Jahrbuch fur Mineralogie, Monatshefte, 1987, 1987, 16-30 |
9008168 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.641; 6.641; 9.759 90; 90; 120 | 372.737 | Fisher, V. K. Verfeinerung der kristallstruktur von benitoit BaTi[Si3O9] Sample: Dallas Gem Mine, San Benito, Ca Zeitschrift fur Kristallographie, 1969, 129, 222-243 |
9008010 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.6; 6.6; 9.74 90; 90; 120 | 367.432 | Zachariasen, W. H. The crystal structure of benitoite, BaTiSi3O9 Zeitschrift fur Kristallographie, 1930, 74, 139-146 |
9007962 | CIF | Ca K O9 P3 | P -6 c 2 | 6.809; 6.809; 10.376 90; 90; 120 | 416.608 | Sandstrom, M.; Bostrom, D. Calcium potassium cyclo-triphosphate Acta Crystallographica, Section E, 2004, 60, i15-i17 |
7237230 | CIF | C96 H54 Co6 N24 O25 | P -6 c 2 | 19.2411; 19.2411; 23.8936 90; 90; 120 | 7660.8 | Xue, Ying-Ying; Li, Shu-Ni; Jiang, Yu-Cheng; Hu, Man-Cheng; Zhai, Quan-Guo Quest for 9-connected robust metal‒organic framework platforms based on [M3(O/OH)(COO)6(pyridine)3] clusters as excellent gas separation and asymmetric supercapacitor materials Journal of Materials Chemistry A, 2019, 7, 4640 |
7206886 | CIF | Ba Hf O9 Si3 | P -6 c 2 | 6.77318; 6.77318; 10.00456 90; 90; 120 | 397.479 | Wang, De-Yin; Wu, Yun-Chen; Chen, Teng-Ming Synthesis, crystal structure, and photoluminescence of a novel blue-green emitting phosphor: BaHfSi3O9:Eu2+ Journal of Materials Chemistry, 2011, 21, 18261 |
7109720 | CIF | C42 H36 Cl7 Cr3 Cu3 N6 O16 | P -6 c 2 | 13.469; 13.469; 27.51 90; 90; 120 | 4322 | Sameh K. Elsaidi; Mona H. Mohamed; Lukasz Wojtas; Amy J. Cairns; Mohamed Eddaoudi; Michael J. Zaworotko Two-step crystal engineering of porous nets from [Cr/3(mu/3-O)(RCO/2)6] and [Cu/3(mu/3-Cl)(RNH2)/6Cl/6] molecular building blocks Chem.Commun., 2013, 49, 8154 |
7102578 | CIF | C84 H174 Cl6 Cu8 N24 Na2 O54 | P -6 c 2 | 17.4169; 17.4169; 31.739 90; 90; 120 | 8338.1 | Pardo, Emilio; Bernot, Kevin; Julve, Miguel; Lloret, Francesc; Cano, Joan; Ruiz-García, Rafael; Pasán, Jorge; Ruiz-Pérez, Catalina; Ottenwaelder, Xavier; Journaux, Yves Self-assembly and magnetic properties of a double-propeller octanuclear copper(II) complex with a meso-helicate-type metallacryptand core. Chemical communications (Cambridge, England), 2004, 920-921 |
7025296 | CIF | C84 H150 Cl6 Cu6 N24 Na2 Ni2 O54 | P -6 c 2 | 17.426; 17.426; 31.674 90; 90; 120 | 8330 | Pardo, Emilio; Dul, Marie-Claire; Lescouëzec, Rodrigue; Chamoreau, Lise-Marie; Journaux, Yves; Pasán, Jorge; Ruiz-Pérez, Catalina; Julve, Miguel; Lloret, Francesc; Ruiz-García, Rafael; Cano, Joan Variation of the ground spin state in homo- and hetero-octanuclear copper(ii) and nickel(ii) double-star complexes with a meso-helicate-type metallacryptand core Dalton Transactions, 2010, 39, 4786 |
7001823 | CIF | C21 H64 N8 O14 | P -6 c 2 | 8.0397; 8.0397; 33.925 90; 90; 120 | 1899 | Chin, Aileen; Edgar, Mark; Harding, Charles J; McKee, Vickie; Nelson, Jane A novel trisprotonated β-dialdiminate cryptand Dalton Transactions, 2009, 6315-6326 |
4349725 | CIF | Ba9 Sn2.94 Te15 | P -6 c 2 | 10.2403; 10.2403; 20.772 90; 90; 120 | 1886.4 | Zhang, Jun; Su, Rui; Wang, Xiancheng; Li, Wenmin; Zhao, Jianfa; Deng, Zheng; Zhang, Sijia; Feng, Shaomin; Liu, Qingqing; Zhao, Huaizhou; Guan, Pengfei; Jin, Changqing Synthesis, crystal structures, and electronic properties of one dimensional Ba9Sn3(Te1−xSex)15 (x = 0‒1) Inorganic Chemistry Frontiers, 2017, 4, 1337 |
4328285 | CIF | C5 H2.5 Co0.5 Fe0.5 O1.5 S | P -6 c 2 | 12.137; 12.137; 13.995 90; 90; 120 | 1785.4 | Satoru Tsukada; Yusuke Shibata; Ryota Sakamoto; Tetsuya Kambe; Tomoji Ozeki; Hiroshi Nishihara Ir3Co6 and Co3Fe3 Dithiolene Cluster Complexes: Multiple Metal-Metal Bond Formation and Correlation between Structure and Internuclear Electronic Communication Inorganic Chemistry, 2012, 51, 1228-1230 |
4309732 | CIF | C18 H27 I7 N9 U2 | P -6 c 2 | 10.9169; 10.9169; 21.622 90; 90; 120 | 2231.6 | Alejandro E. Enriquez; Brian L. Scott; Mary P. Neu Uranium(III)/(IV) Nitrile Adducts Including UI4(N\τbCPh)4, a Synthetically Useful Uranium(IV) Complex Inorganic Chemistry, 2005, 44, 7403-7413 |
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