Search results

Formula: - H8 Mg O9 Se2 -
Comments: Boldt, K.; Engelen, B.; Panthoefer, M.; Mueller, H.; Unterderweide, K. Mg (H Se O3)2 . 3(H2 O) : crystal structure, rotational and orientational disorder of 'free' (H Se O3)(-) ions and low temperature phase transition Journal of Molecular Structure 475 (1999) 35-41
Space group: P -6 2 c
Cell volume: 808.687
Cell parameters: 9.434; 9.434; 10.492; 90; 90; 120;

COD ID: 1521129

Formula: - Al D0.303 Ni Tb -
Comments: Hauback, B.C.; Fjellvag, H.; Palhaugen, L.; Yartys', V.A.; Yvon, K. Crystal and magnetic structure of Tb Ni Al - based deuterides, Tb Ni Al D0.3 and Tb Ni Al D1.04, studied by neutron diffraction and synchrotron radiation Journal of Alloys Compd. 293 (1999) 178-184
Space group: P -6 2 c
Cell volume: 334.355
Cell parameters: 7.0433; 7.0433; 7.7826; 90; 90; 120;

COD ID: 1521635
CIF file	Formula: - F3 La3 O9 Si3 - Comments: Mueller-Bunz, H.; Schleid, T. La3 F3 (Si3 O9): das erste Fluoridsilicat aus dem ternaeren System La F3 / La2 O3 / Si O2 Zeitschrift fuer Anorganische und Allgemeine Chemie 625 (1999) 1377-1383 Space group: P -6 2 c Cell volume: 473.379 Cell parameters: 7.0832; 7.0832; 10.8948; 90; 90; 120;

COD ID: 1523635
CIF file	Formula: - Ga Mg2 - Comments: Frank, K.; Schubert, K. Kristallstrukturen von Mg2 Ga und Mg2 Tl Journal of the Less-Common Metals 20 (1970) 215-221 Space group: P -6 2 c Cell volume: 362.627 Cell parameters: 7.794; 7.794; 6.893; 90; 90; 120;

COD ID: 1527418
CIF file	Formula: - Co5.56 Er8 Ga10.44 - Comments: Gladyshevskii, R.E.; Cenzual, K.; Parthe, E. Er2 Rh Si3 and R2 Co Ga3 (R= Y, Tb, Dy, Ho, Er, Tm, Yb) with Lu2 Co Ga3 type structure: new members of the Al B2 structure family Journal of Alloys Compd. 189 (1992) 221-228 Space group: P -6 2 c Cell volume: 442.545 Cell parameters: 8.607; 8.607; 6.898; 90; 90; 120;

COD ID: 1527419
CIF file	Formula: - Co Ga3 Lu2 - Comments: Gladyshevskii, R.E.; Cenzual, K.; Parthe, E. Er2 Rh Si3 and R2 Co Ga3 (R= Y, Tb, Dy, Ho, Er, Tm, Yb) with Lu2 Co Ga3 type structure: new members of the Al B2 structure family Journal of Alloys Compd. 189 (1992) 221-228 Space group: P -6 2 c Cell volume: 443.039 Cell parameters: 8.659; 8.659; 6.823; 90; 90; 120;

COD ID: 1527482
CIF file	Formula: - Ba3 O7.11 Pt2.07 - Comments: Haradem, P.S.; Chamberland, B.L.; Gleizes, A.; Katz, L. A structural model for barium platinum oxide, Ba3 Pt2 O7 Journal of Solid State Chemistry 21 (1977) 217-223 Space group: P -6 2 c Cell volume: 764.318 Cell parameters: 10.108; 10.108; 8.638; 90; 90; 120;

COD ID: 1528115
CIF file	Formula: - Ce2 Rh Si3 - Comments: Szytula, A.; Leciejewicz, J.; Maletka, K. Neutron diffraction study of Ce2 Rh Si3, Nd2 Rh Si3 and Th2 Rh Si3 Journal of Magnetism and Magnetic Materials 118 (1993) 302-306 Space group: P -6 2 c Cell volume: 498.875 Cell parameters: 8.262; 8.262; 8.439; 90; 90; 120;

COD ID: 1530015
CIF file	Formula: - Nb S2 - Comments: Graf, H.A.; Lerf, A.; Schoellhorn, R. A crystal structure investigation of the hydrated layered chalcogenides Kx (H2 O)y Nb S2 and Kx (H2 O)y Ta S2 Journal of the Less-Common Metals 55 (1977) 213-220 Space group: P -6 2 c Cell volume: 174.358 Cell parameters: 3.35; 3.35; 17.94; 90; 90; 120;

COD ID: 1530016
CIF file	Formula: - S2 Ta - Comments: Graf, H.A.; Schoellhorn, R.; Lerf, A. A crystal structure investigation of the hydrated layered chalcogenides Kx (H2 O)y Nb S2 and Kx (H2 O)y Ta S2 Journal of the Less-Common Metals 55 (1977) 213-220 Space group: P -6 2 c Cell volume: 175.217 Cell parameters: 3.336; 3.336; 18.18; 90; 90; 120;

COD ID: 1533027
CIF file	Formula: - Ba5 Na2 O14 Ru3 - Comments: Quarez, E.; Mentre, O. Electrosynthesis, structural transitions and characterization of the new 10H-(Ba5 Ru3 Na2 O14) Solid State Sciences 5 (2003) 1105-1116 Space group: P -6 2 c Cell volume: 742.093 Cell parameters: 5.9261; 5.9261; 24.4; 90; 90; 120;

COD ID: 1533648
CIF file	Formula: - Ho2 Rh Si3 - Comments: Bazela, W.; Wawrzynska, E.; Szytula, A.; Penc, B.; Zygmunt, A.; Stuesser, N. Magnetic structures of R2 Rh Si3 (R = Ho, Er) compounds Journal of Alloys Compd. 360 (2003) 76-80 Space group: P -6 2 c Cell volume: 441.891 Cell parameters: 8.086; 8.086; 7.804; 90; 90; 120;

COD ID: 1533655
CIF file	Formula: - Er2 Rh Si3 - Comments: Bazela, W.; Wawrzynska, E.; Penc, B.; Zygmunt, A.; Stuesser, N.; Szytula, A. Magnetic structures of R2 Rh Si3 (R = Ho, Er) compounds Journal of Alloys Compd. 360 (2003) 76-80 Space group: P -6 2 c Cell volume: 437.853 Cell parameters: 8.078; 8.078; 7.748; 90; 90; 120;

COD ID: 1534808
CIF file	Formula: - Pt11 Si5 Sm8 - Comments: Barakatova, Zh.M.; Aksel'rud, L.G.; Seropegin, Yu.D.; Bodak, O.I. Crystal structure of Sm8 Pt11 Si5 Kristallografiya 40 (1995) 370-372 Space group: P -6 2 c Cell volume: 466.087 Cell parameters: 8.715; 8.715; 7.086; 90; 90; 120;

COD ID: 1537071
CIF file	Formula: - C Cl18 W6 - Comments: Zheng, Y.-Q.; Grin', Yu.; von Schnering, H.G.; Chang, J.-H.; Engelhardt, G.; Heckmann, G. The carbon-centered triprismo-hexatungsten chlorides C W6 Cl16 and C W6 Cl18 Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 1256-1264 Space group: P -6 2 c Cell volume: 1206.88 Cell parameters: 8.923; 8.923; 17.503; 90; 90; 120;

COD ID: 1538513
CIF file	Formula: - I10 Pb Tl6 - Comments: Rabenau, A.; Schulz, H.; Stoeger, W. A polyiodide with regular I4(2-) chains: Tl6 Pb I10 Naturwissenschaften 63 (1976) 245-245 Space group: P -6 2 c Cell volume: 1306.12 Cell parameters: 10.561; 10.561; 13.522; 90; 90; 120;

COD ID: 1539817
CIF file	Formula: - Co0.08 Fe0.92 S - Comments: Collin, G.; Gardette, M.F.; Comes, R. The Fe1-x Cox S system (X<0.25); transition and the high temperature phase Journal of Physics and Chemistry of Solids 48 (1987) 791-802 Space group: P -6 2 c Cell volume: 358.695 Cell parameters: 5.959; 5.959; 11.664; 90; 90; 120;

COD ID: 1539927
CIF file	Formula: - Cs3 F9 Fe2 - Comments: Wall, F.; Pausewang, G.; Babel, D. Die Kristallstruktur von Cs2 Fe2 F9 : Ein Zweikerniger Fluorokomplex Journal of the Less-Common Metals 25 (1971) 257-270 Space group: P -6 2 c Cell volume: 516.704 Cell parameters: 6.345; 6.345; 14.82; 90; 90; 120;

COD ID: 1540752
CIF file	Formula: - Ag H9 N4 O3 - Comments: Zachwieja, U.; Jacobs, H. Kolumnarstrukturen bei Tri- und Diamminnitraten, (M (N H3)3) (N O3) und (M (N H3)2) (N O3) des einwertigen Kupfers und Silbers Zeitschrift fuer Anorganische und Allgemeine Chemie 571 (1989) 37-50 Space group: P -6 2 c Cell volume: 328.315 Cell parameters: 8.057; 8.057; 5.84; 90; 90; 120;

COD ID: 1541985

Formula: - C3 H6 Ag Cu N5 S3 -
Comments: Huang, J.-L.; Li, J.M.; Lu, J.-X. The crystal chemistry of thiocyanate-ligated compounds of transition metals. I. The crystal structure of di-ammine complex of copper(II) silver(I) trithiocyanate Cu (N H3)2 Ag (S C N)3 Acta Chimica Sinica (see: Hua Hsueh Hsueh Pao) 32 (1966) 162-168
Space group: P -6 2 c
Cell volume: 543.311
Cell parameters: 9.22; 9.22; 7.38; 90; 90; 120;

COD ID: 1543194

Formula: - C106 H210 Gd7 N8 O45 -
Comments: Pineda, Eufemio Moreno; Lorusso, Giulia; Zangana, Karzan H.; Palacios, Elias; Schnack, Jürgen; Evangelisti, Marco; Winpenny, Richard E. P.; McInnes, Eric J. L. Observation of the influence of dipolar and spin frustration effects on the magnetocaloric properties of a trigonal prismatic {Gd7} molecular nanomagnet Chem. Sci. 7(8) (2016) 4891
Space group: P -6 2 c
Cell volume: 7771.9
Cell parameters: 16.9152; 16.9152; 31.3646; 90; 90; 120;

COD ID: 1548855

Formula: - C225 H333 Al9 N18 O18 -
Comments: Pang, Xuan; Duan, Ranlong; Li, Xiang; Hu, Chenyang; Wang, Xianhong; Chen, Xuesi Breaking the Paradox between Catalytic Activity and Stereoselectivity: rac-Lactide Polymerization by Trinuclear Salen‒Al Complexes Macromolecules 51(3) (2018) 906
Space group: P -6 2 c
Cell volume: 13869
Cell parameters: 19.559; 19.559; 41.863; 90; 90; 120;

COD ID: 1551167
CIF file	Formula: - C41 H40 O16 - Comments: Zhou, Yue; Kan, Liang; Eubank, Jarrod F.; Li, Guanghua; Zhang, Lirong; Liu, Yunling Self-assembly of two robust 3D supramolecular organic frameworks from a geometrically non-planar molecule for high gas selectivity performance Chemical Science (2019) Space group: P -6 2 c Cell volume: 7467.5 Cell parameters: 22.67; 22.67; 16.778; 90; 90; 120;

COD ID: 1551368

Formula: - C188 H168 Co4 F24 N34 O24 S8 -
Comments: Imogen A. Riddell; Maarten M. J. Smulders; Jack K. Clegg; Yana R. Hristova; Boris Breiner; John D. Thoburn; Jonathan R. Nitschke Anion-induced reconstitution of a self-assembling system to express a chloride-binding Co10L15 pentagonal prism Nature Chemistry 4 (2012) 751-756
Space group: P -6 2 c
Cell volume: 21985.5
Cell parameters: 24.7578; 24.7578; 41.4172; 90; 90; 120;

COD ID: 1563653
CIF file	Formula: - Cu5 O30 Ta11 - Comments: Palasyuk, Olena; Palasyuk, Andriy; Maggard, Paul A. Syntheses, optical properties and electronic structures of copper(I) tantalates: Cu5Ta11O30 and Cu3Ta7O19 Journal of Solid State Chemistry 183(4) (2010) 814-822 Space group: P -6 2 c Cell volume: 1091.26 Cell parameters: 6.2252; 6.2252; 32.5155; 90; 90; 120;

COD ID: 1564912

Formula: - C33 H33 B F4 Fe3 N3 O16 -
Comments: Bara, Dominic; Meekel, Emily G.; Pakamorė, Ignas; Wilson, Claire; Ling, Sanliang; Forgan, Ross S. Exploring and expanding the Fe-terephthalate metal-organic framework phase space by coordination and oxidation modulation. Materials horizons 8(12) (2021) 3377-3386
Space group: P -6 2 c
Cell volume: 2539.3
Cell parameters: 12.6391; 12.6391; 18.3551; 90; 90; 120;

COD ID: 2002691
CIF file	Formula: - Ba3 Hg O11 Pt4 - Comments: Hansen, Th; Mueller-Buschbaum, Hk Ein Beitrag ueber Ba3 Pt4 Hg O11: das erste Erdalkalimetall- Oxoplatinat(II,V)/Oxomercurat Zeitschrift fuer Anorganische und Allgemeine Chemie 620 (1994) 1471-1475 Space group: P -6 2 c Cell volume: 545.5 Cell parameters: 6.021; 6.021; 17.37398; 90; 90; 120;

COD ID: 2003439
CIF file Original IUCr paper	Formula: - K3 Nb3 O13 Si2 - Comments: Jaulmes, S.; Launay, S.; Mahé, P.; Quarton, M. Silicatoniobate de Potassium, K~3~Nb~3~O~6~Si~2~O~7~ Acta Crystallographica Section C 51(5) (1995) 794-796 Space group: P -6 2 c Cell volume: 564.58 Cell parameters: 9.012; 9.012; 8.027; 90; 90; 120;

COD ID: 2007207
CIF file Original IUCr paper	Formula: - C12 H28 Eu La O23 - Comments: Baggio, Ricardo; Garland, Maria Teresa; Perec, Mireille Triaquatris(μ-oxydiacetato)europium(III)lanthanum(III) Pentahydrate Acta Crystallographica Section C 54(5) (1998) 591-594 Space group: P -6 2 c Cell volume: 1323.5 Cell parameters: 9.295; 9.295; 17.689; 90; 90; 120;

COD ID: 2007711
CIF file Original IUCr paper	Formula: - Ag5 K S3 - Comments: Emirdag, Mehtap; Schimek, George L.; Kolis, Joseph W. KAg~5~S~3~ Acta Crystallographica Section C 54(10) (1998) 1376-1378 Space group: P -6 2 c Cell volume: 1197.8 Cell parameters: 13.196; 13.196; 7.943; 90; 90; 120;

COD ID: 2010690

Formula: - C12 H28 O23 Pr2 -
Comments: Baggio, Ricardo; Perec, Mireille; Garland, Maria Teresa Triaquatris(μ-oxydiacetato)dipraseodymium(III) pentahydrate and hexaaquatris(μ-oxydiacetato)dineodymium(III) oxydiacetic acid solvate dihydrate Acta Crystallographica Section C 56(3) (2000) 312-315
Space group: P -6 2 c
Cell volume: 1327.7
Cell parameters: 9.4003; 9.4003; 17.35; 90; 90; 120;

COD ID: 2013740

Formula: - C3 H Na O11.5 Rb3 U -
Comments: Hughes Kubatko, Karrie-Ann; Burns, Peter C. The Rb analogue of grimselite, Rb~6~Na~2~[(UO~2~)(CO~3~)~3~]~2~(H~2~O) Acta Crystallographica Section C 60(3) (2004) i25-i26
Space group: P -6 2 c
Cell volume: 643.99
Cell parameters: 9.4316; 9.4316; 8.3595; 90; 90; 120;

COD ID: 2019524

Formula: - Al1.88 B1.76 Eu0.1 N8.12 Si2.36 Sr1.9 -
Comments: Funahashi, Shiro; Michiue, Yuichi; Takeda, Takashi; Xie, Rong-Jun; Hirosaki, Naoto Substitutional disorder in Sr~2{-~y}Eu~y~B~2{-~2x}Si~2+3x~Al~2{-~x}N~8+x~ (x ≃0.12, y ≃0.10) Acta Crystallographica Section C 70(5) (2014) 452-454
Space group: P -6 2 c
Cell volume: 195.049
Cell parameters: 4.7988; 4.7988; 9.7802; 90; 90; 120;

COD ID: 2021638

Formula: - La18 O57 W10 -
Comments: Novikova, Nataliya E.; Sorokin, Timofei A.; Antipin, Alexander M.; Bolotina, Nadezhda B.; Alekseeva, Olga A.; Sorokina, Nataliya I.; Voronkova, Valentina I. Characteristic features of polytypism in compounds with the La~18~W~10~O~57~-type structure Acta Crystallographica Section C 75(6) (2019)
Space group: P -6 2 c
Cell volume: 2306.5
Cell parameters: 9.0318; 9.0318; 32.6499; 90; 90; 120;

COD ID: 2106976
CIF file	Formula: - Be3 O4 Sr - Comments: Harris, L.A.; Yakel, H.L.jr. The Crystal Structure of Sr Be3 O4 Acta Crystallographica B (24,1968-38,1982) 25 (1969) 1647-1651 Space group: P -6 2 c Cell volume: 163.366 Cell parameters: 4.5961; 4.5961; 8.93; 90; 90; 120;

COD ID: 2209513

Formula: - C30 H33 Br2 Fe N6 O4.5 -
Comments: Heilmann, Julia; Lerner, Hans-Wolfram; Bolte, Michael Tris(2,2'-bipyridyl)iron(II) dibromide 4.5-hydrate Acta Crystallographica Section E 62(7) (2006) m1477-m1478
Space group: P -6 2 c
Cell volume: 3233.6
Cell parameters: 13.1386; 13.1386; 21.63; 90; 90; 120;

COD ID: 2212460

Formula: - C9 H21 I N3 Na O3 -
Comments: Chessa, Simona; Wright, Joseph A. Redetermination of catena-poly[[sodium(I)-tri-μ-dimethylformamide-κ^6^O:O] iodide] at 140 K Acta Crystallographica Section E 63(3) (2007) m787-m789
Space group: P -6 2 c
Cell volume: 770.81
Cell parameters: 11.8038; 11.8038; 6.3881; 90; 90; 120;

COD ID: 2230974

Formula: - Ca3 H12 Mn O17 S2 -
Comments: Barkley, Madison C.; Yang, Hexiong; Evans, Stanley H.; Downs, Robert T.; Origlieri, Marcus J. Redetermination of despujolsite, Ca~3~Mn^4+^(SO~4~)~2~(OH)~6~.3H~2~O Acta Crystallographica, Section E 67(9) (2011) i47-i48
Space group: P -6 2 c
Cell volume: 682.81
Cell parameters: 8.5405; 8.5405; 10.8094; 90; 90; 120;

COD ID: 2240468

Formula: - Ge11.87 Ni18.06 -
Comments: Kars, Mohammed; Herrero, Adrian Gómez; Roisnel, Thierry; Rebbah, Allaoua; Otero-Diáz, L. Carlos Structure cristalline du composé intermétallique Ni~18~Ge~12~ Acta Crystallographica Section E 71(3) (2015) 318-320
Space group: P -6 2 c
Cell volume: 382.5
Cell parameters: 6.6585; 6.6585; 9.962; 90; 90; 120;

COD ID: 4000947
CIF file	Formula: - Ba6 O13.5 Ta3 - Comments: Ling, Chris D.; Avdeev, Maxim; Kharton, Vladislav V.; Yaremchenko, Aleksey A.; Macquart, René B.; Hoelzel, Markus Structures, Phase Transitions, Hydration, and Ionic Conductivity of Ba4Ta2O9 Chemistry of Materials 22(2) (2010) 532 Space group: P -6 2 c Cell volume: 773.79 Cell parameters: 10.26904; 10.26904; 8.4729; 90; 90; 120;

COD ID: 4001052

Formula: - Ba6 Nb3 O13.5 -
Comments: Ling, Chris D.; Avdeev, Maxim; Kutteh, Ramzi; Kharton, Vladislav V.; Yaremchenko, Aleksey A.; Fialkova, Svitlana; Sharma, Neeraj; Macquart, René B; Hoelzel, Markus; Gutmann, Matthias Structures, Phase Transitions, Hydration, and Ionic Conductivity of Ba4Nb2O9 Chemistry of Materials 21(16) (2009) 3853
Space group: P -6 2 c
Cell volume: 800.31
Cell parameters: 10.3829; 10.3829; 8.5722; 90; 90; 120;

COD ID: 4001450
CIF file	Formula: - C8 H30 Al4 Ge6 N6 O20 - Comments: Shi, Lei; Christensen, Kirsten E.; Jansson, Kjell; Sun, Junliang; Zou, Xiaodong Synthesis and Characterization of an Aluminogermanate SU-46 with a Zeolite Structure Chemistry of Materials 19(24) (2007) 5973 Space group: P -6 2 c Cell volume: 722.9 Cell parameters: 7.524; 7.524; 14.746; 90; 90; 120;

COD ID: 4002170

Formula: - Cu3.2 O30 Ta11 -
Comments: Sullivan, Ian; Sahoo, Prangya P.; Fuoco, Lindsay; Hewitt, Andrew S.; Stuart, Sean; Dougherty, Daniel; Maggard, Paul A. Cu-Deficiency in thep-Type Semiconductor Cu5‒xTa11O30: Impact on Its Crystalline Structure, Surfaces, and Photoelectrochemical Properties Chemistry of Materials 26(23) (2014) 6711
Space group: P -6 2 c
Cell volume: 1084.86
Cell parameters: 6.2359; 6.2359; 32.2139; 90; 90; 120;

COD ID: 4003609
CIF file	Formula: - C66 H57 Cl2 F3 O20 Zr6 - Comments: Gosselin, Eric J.; Decker, Gerald E.; McNichols, Brett W.; Baumann, James E.; Yap, Glenn P. A.; Sellinger, Alan; Bloch, Eric D. Ligand-Based Phase Control in Porous Zirconium Coordination Cages Chemistry of Materials (2020) Space group: P -6 2 c Cell volume: 5135.3 Cell parameters: 16.4279; 16.4279; 21.9721; 90; 90; 120;

COD ID: 4030716

Formula: - O9 Ru2 Sr4 -
Comments: Dussarrat, C.; Fompeyrine, J.; Darriet, J. Sr4Ru2O9: A structural model resulting from the stacking of [Sr3O9] and [Sr3O6] mixed layers. Structural relationships to related perovskite-type structures European Journal of Solid State and Inorganic Chemistry 32 (1995) 3-14
Space group: P -6 2 c
Cell volume: 652.5
Cell parameters: 9.642; 9.642; 8.104; 90; 90; 120;

COD ID: 4030938
CIF file	Formula: - O4 Rh2 Sr - Comments: Hector, A. L.; Levason, W.; Weller, M. T. Structure of β-SrRh~2~O~4~ from X-ray and neutron powder diffraction European Journal of Solid State and Inorganic Chemistry 35(10-11) (1998) 679-687 Space group: P -6 2 c Cell volume: 92.598 Cell parameters: 3.0626; 3.0626; 11.3996; 90; 90; 120;

COD ID: 4038945
CIF file HKL data	Formula: - C20 H14 O6 - Comments: Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Triptycene 1,2-Quinones and Quinols: Permeable Crystalline Redox-Active Molecular Solids. The Journal of organic chemistry 83(24) (2018) 15426-15437 Space group: P -6 2 c Cell volume: 1676.01 Cell parameters: 13.3732; 13.3732; 10.8212; 90; 90; 120;

COD ID: 4085240

Formula: - C6 H60 B66 Cs5.96 Hg3 I6 -
Comments: Himmelspach, Alexander; Warneke, Jonas; Schäfer, Marius; Hailmann, Michael; Finze, Maik Salts of the Dianions [Hg(12-X-closo-1-CB11H10)2]2‒(X = I, C≡CH, C≡CFc, C≡CSiiPr3): Synthesis and Spectroscopic and Structural Characterization Organometallics 34(2) (2015) 462
Space group: P -6 2 c
Cell volume: 6420.7
Cell parameters: 25.36; 25.36; 11.528; 90; 90; 120;

COD ID: 4110344
CIF file	Formula: - C60 H44 Cd7 N18 Na4 O31 - Comments: Wen-Guan Lu; Cheng-Yong Su; Tong-Bu Lu; Long Jiang; Jia-Mei Chen Two Stable 3D Metal-Organic Frameworks Constructed by Nanoscale Cages via Sharing the Single-Layer Walls Journal of the American Chemical Society 128 (2006) 34-35 Space group: P -6 2 c Cell volume: 3806.6 Cell parameters: 14.2165; 14.2165; 21.748; 90; 90; 120;

COD ID: 4110345
CIF file	Formula: - C46 H54 Cd7 K3 N13 O30 - Comments: Wen-Guan Lu; Cheng-Yong Su; Tong-Bu Lu; Long Jiang; Jia-Mei Chen Two Stable 3D Metal-Organic Frameworks Constructed by Nanoscale Cages via Sharing the Single-Layer Walls Journal of the American Chemical Society 128 (2006) 34-35 Space group: P -6 2 c Cell volume: 3807.7 Cell parameters: 14.3027; 14.3027; 21.493; 90; 90; 120;

COD ID: 4119354

Formula: - C200.5 H210.75 F24 N30.25 Ni4 O30 S8 -
Comments: Imogen A. Riddell; Yana R. Hristova; Jack K. Clegg; Christopher S. Wood; Boris Breiner; Jonathan R. Nitschke Five Discrete Multinuclear Metal-Organic Assemblies from One Ligand: Deciphering the Effects of Different Templates Journal of the American Chemical Society 135 (2013) 2723-2733
Space group: P -6 2 c
Cell volume: 21627
Cell parameters: 24.581; 24.581; 41.33; 90; 90; 120;

COD ID: 4120118

Formula: - C63 H51 Co2 In3 N6 O37 -
Comments: Shou-Tian Zheng; Xiang Zhao; Samuel Lau; Addis Fuhr; Pingyun Feng; Xianhui Bu Entrapment of Metal Clusters in Metal-Organic Framework Channels by Extended Hooks Anchored at Open Metal Sites Journal of the American Chemical Society 135 (2013) 10270-10273
Space group: P -6 2 c
Cell volume: 5742.9
Cell parameters: 18.1997; 18.1997; 20.0204; 90; 90; 120;

COD ID: 4126518
CIF file	Formula: - C Na O P - Comments: Hennersdorf, Felix; Frötschel, Julia; Weigand, Jan J. Selective Derivatization of a Hexaphosphane from Functionalization of White Phosphorus. Journal of the American Chemical Society (2017) Space group: P -6 2 c Cell volume: 451.55 Cell parameters: 8.5229; 8.5229; 7.178; 90; 90; 120;

COD ID: 4127833

Formula: - C110 H62 O12 -
Comments: Li, Penghao; Chen, Zhijie; Ryder, Matthew R.; Stern, Charlotte L.; Guo, Qing-Hui; Wang, Xingjie; Farha, Omar K.; Stoddart, J. Fraser Assembly of a Porous Supramolecular Polyknot from Rigid Trigonal Prismatic Building Blocks. Journal of the American Chemical Society 141(33) (2019) 12998-13002
Space group: P -6 2 c
Cell volume: 67898
Cell parameters: 37.888; 37.888; 54.616; 90; 90; 120;

COD ID: 4130656

Formula: - C188 H97.5 In9 N1.5 O46.5 -
Comments: Reinares-Fisac, Daniel; Aguirre-Díaz, Lina María; Iglesias, Marta; Snejko, Natalia; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Gándara, Felipe A Mesoporous Indium Metal-Organic Framework: Remarkable Advances in Catalytic Activity for Strecker Reaction of Ketones. Journal of the American Chemical Society 138(29) (2016) 9089-9092
Space group: P -6 2 c
Cell volume: 14929
Cell parameters: 31.718; 31.718; 17.1352; 90; 90; 120;

COD ID: 4130657

Formula: - C168 H90 In9 O48 -
Comments: Reinares-Fisac, Daniel; Aguirre-Díaz, Lina María; Iglesias, Marta; Snejko, Natalia; Gutiérrez-Puebla, Enrique; Monge, M Ángeles; Gándara, Felipe A Mesoporous Indium Metal-Organic Framework: Remarkable Advances in Catalytic Activity for Strecker Reaction of Ketones. Journal of the American Chemical Society 138(29) (2016) 9089-9092
Space group: P -6 2 c
Cell volume: 15141.2
Cell parameters: 31.8903; 31.8903; 17.1915; 90; 90; 120;

COD ID: 4130927
CIF file	Formula: - C21 H9 Ag In3 N3 O16 - Comments: Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society 138(46) (2016) 15102-15105 Space group: P -6 2 c Cell volume: 2402.9 Cell parameters: 13.636; 13.636; 14.9222; 90; 90; 120;

COD ID: 4130928
CIF file	Formula: - C21 H9 Cu Mg3 N3 O16 - Comments: Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society 138(46) (2016) 15102-15105 Space group: P -6 2 c Cell volume: 2222.6 Cell parameters: 13.1696; 13.1696; 14.7973; 90; 90; 120;

COD ID: 4131504

Formula: - C6 H14 I3 N2 Rb -
Comments: Zhang, Wan-Ying; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Liao, Wei-Qiang; Fu, Da-Wei; Ye, Heng-Yun; Zhang, Yi; Xiong, Ren-Gen Precise Molecular Design of High-Tc 3D Organic-Inorganic Perovskite Ferroelectric: [MeHdabco]RbI3 (MeHdabco = N-Methyl-1,4-diazoniabicyclo[2.2.2]octane). Journal of the American Chemical Society 139(31) (2017) 10897-10902
Space group: P -6 2 c
Cell volume: 685.5
Cell parameters: 9.821; 9.821; 8.2067; 90; 90; 120;

COD ID: 4301648
CIF file	Formula: - Ga2.83 Sm1.06 - Comments: Monique Tillard; David Zitoun; Claude Belin Structural Versatility of the ε-SmGax Phase: X-Ray, Electron Diffraction, and DFT Studies Inorganic Chemistry 48 (2009) 2399-2406 Space group: P -6 2 c Cell volume: 1209 Cell parameters: 12.861; 12.861; 8.4402; 90; 90; 120;

COD ID: 4304912
CIF file	Formula: - C117 H75 Cl5 N6 O52 P6 V12 - Comments: Sanjit Konar; Abraham Clearfield Mixed-Valent Dodecanuclear Vanadium Cluster Encapsulating Chloride Anions and Its Reaction To Form a "Bowl"-Shaped Cluster Inorganic Chemistry 47 (2008) 3492-3494 Space group: P -6 2 c Cell volume: 8545 Cell parameters: 16.8442; 16.8442; 34.778; 90; 90; 120;

COD ID: 4305090
CIF file	Formula: - K3 O13 Si2 U3 - Comments: Chia-Hui Lin; Chih-Shan Chen; A. A. Shiryaev; Ya. V. Zubavichus; Kwang-Hwa Lii K3(U3O6)(Si2O7) and Rb3(U3O6)(Ge2O7): A Pentavalent-Uranium Silicate and Germanate Inorganic Chemistry 47 (2008) 4445-4447 Space group: P -6 2 c Cell volume: 657.11 Cell parameters: 9.5389; 9.5389; 8.3389; 90; 90; 120;

COD ID: 4305091
CIF file	Formula: - Ge2 O13 Rb3 U3 - Comments: Chia-Hui Lin; Chih-Shan Chen; A. A. Shiryaev; Ya. V. Zubavichus; Kwang-Hwa Lii K3(U3O6)(Si2O7) and Rb3(U3O6)(Ge2O7): A Pentavalent-Uranium Silicate and Germanate Inorganic Chemistry 47 (2008) 4445-4447 Space group: P -6 2 c Cell volume: 700.5 Cell parameters: 9.8014; 9.8014; 8.4198; 90; 90; 120;

COD ID: 4311826
CIF file	Formula: - C81 H81 Cl3 Cu3 Mn3 N15 O32 - Comments: Mirela Pascu; Francesc Lloret; Narcis Avarvari; Miguel Julve; Marius Andruh Ferromagnetic Coupling through Spin Polarization in the Hexanuclear [MnII3CuII3] Complex Inorganic Chemistry 43 (2004) 5189-5191 Space group: P -6 2 c Cell volume: 4758 Cell parameters: 16.474; 16.474; 20.244; 90; 90; 120;

COD ID: 4327495
CIF file	Formula: - La18 O57 W10 - Comments: Chambrier, M H; Le Bail, A; Kodjikian, S; Suard, E; Goutenoire, F Structure Determination of La18W10O57 Inorganic Chemistry 48 (2009) 6566-6572 Space group: P -6 2 c Cell volume: 2315.64 Cell parameters: 9.0448; 9.0448; 32.6846; 90; 90; 120;

COD ID: 4329281

Formula: - C36 H84.24 Dy N9 O36.12 Zn6 -
Comments: George J. Sopasis; Angelos B. Canaj; Aggelos Philippidis; Milosz Siczek; Tadeusz Lis; James R. O'Brien; Manolis M. Antonakis; Spiros A. Pergantis; Constantinos J. Milios Heptanuclear Heterometallic [Cu6Ln] Clusters: Trapping Lanthanides into Copper Cages with Artificial Amino Acids Inorganic Chemistry 51 (2012) 5911-5918
Space group: P -6 2 c
Cell volume: 4752
Cell parameters: 20.282; 20.282; 13.339; 90; 90; 120;

COD ID: 4332004
CIF file	Formula: - C9 H24 Cd5 N46 O6 - Comments: He, Xiang; Lu, Can-Zhong; Yuan, Da-Qiang Two 3D Porous Cadmium Tetrazolate Frameworks with Hexagonal Tunnels Inorganic Chemistry 45(15) (2006) 5760-5766 Space group: P -6 2 c Cell volume: 2027.43 Cell parameters: 13.1198; 13.1198; 13.6007; 90; 90; 120;

COD ID: 4332825
CIF file	Formula: - Ge5 Sm3 - Comments: Tobash, Paul H.; Lins, Daniel; Bobev, Svilen; Hur, Namjung; Thompson, Joe D.; Sarrao, John L. Vacancy Ordering in SmGe2-xand GdGe2-x(x= 0.33): Structure and Properties of Two Sm3Ge5Polymorphs and of Gd3Ge5 Inorganic Chemistry 45(18) (2006) 7286-7294 Space group: P -6 2 c Cell volume: 352.52 Cell parameters: 6.9238; 6.9238; 8.491; 90; 90; 120;

COD ID: 4334876
CIF file	Formula: - C63 H57 F6 N3 P Pt3 S3 Tl - Comments: Úrsula Belío; Sara Fuertes; Antonio Martín Synthesis and Characterization of a "Pt3Tl" Cluster Containing an Unprecedented Trigonal Environment for Thallium(I) Inorganic Chemistry 52 (2013) 5627-5629 Space group: P -6 2 c Cell volume: 2824.8 Cell parameters: 15.6681; 15.6681; 13.2867; 90; 90; 120;

COD ID: 4335432
CIF file	Formula: - C201 H144 Cl6 Cu4 I4 N6 P12 - Comments: Sang Ho Lim; Seth M. Cohen Self-Assembled Supramolecular Clusters Based on Phosphines and Coinage Metals: Tetrahedra, Helicates, and Mesocates Inorganic Chemistry 52 (2013) 7862-7872 Space group: P -6 2 c Cell volume: 5807.5 Cell parameters: 13.1976; 13.1976; 38.5008; 90; 90; 120;

COD ID: 4335433
CIF file	Formula: - C102 H75 Au2 Cl3 I2 N3 P6 - Comments: Sang Ho Lim; Seth M. Cohen Self-Assembled Supramolecular Clusters Based on Phosphines and Coinage Metals: Tetrahedra, Helicates, and Mesocates Inorganic Chemistry 52 (2013) 7862-7872 Space group: P -6 2 c Cell volume: 5978.8 Cell parameters: 13.3154; 13.3154; 38.938; 90; 90; 120;

COD ID: 4336646
CIF file	Formula: - Ag5 K S3 - Comments: Chi Zhang; Kai-Ni Wang; Min Ji; Yong-Lin An Mild Solvothermal Syntheses of Thioargentates A-Ag-S (A = K, Rb, Cs) and A-Ag-Ge-S (A = Na, Rb): Crucial Role of Excess Sulfur Inorganic Chemistry 52 (2013) 12367-12371 Space group: P -6 2 c Cell volume: 1203.1 Cell parameters: 13.2208; 13.2208; 7.9479; 90; 90; 120;

COD ID: 4336647
CIF file	Formula: - Ag5 Rb S3 - Comments: Chi Zhang; Kai-Ni Wang; Min Ji; Yong-Lin An Mild Solvothermal Syntheses of Thioargentates A-Ag-S (A = K, Rb, Cs) and A-Ag-Ge-S (A = Na, Rb): Crucial Role of Excess Sulfur Inorganic Chemistry 52 (2013) 12367-12371 Space group: P -6 2 c Cell volume: 1226 Cell parameters: 13.296; 13.296; 8.006; 90; 90; 120;

COD ID: 4344191
CIF file	Formula: - Cl8 Mo2 Rb3 - Comments: Bennett, M.J.; Brencic, J.V.; Cotton, F.A. The preparation and structural characterization of trirubidium octachlorodimolybdenum. A binuclear structure with strong metal-metal bonding. Inorganic Chemistry 8 (1969) 1060-1065 Space group: P -6 2 c Cell volume: 745.96 Cell parameters: 7.19; 7.19; 16.662; 90; 90; 120;

COD ID: 4345073

Formula: - C171 H147 Er12 N3 O66 -
Comments: Li, Yun-Jian; Wang, Yu-Ling; Liu, Qing-Yan The Highly Connected MOFs Constructed from Nonanuclear and Trinuclear Lanthanide-Carboxylate Clusters: Selective Gas Adsorption and Luminescent pH Sensing. Inorganic chemistry 56(4) (2017) 2159-2164
Space group: P -6 2 c
Cell volume: 12562.9
Cell parameters: 22.4349; 22.4349; 28.8212; 90; 90; 120;

COD ID: 4345074

Formula: - C171 H147 Gd12 N3 O66 -
Comments: Li, Yun-Jian; Wang, Yu-Ling; Liu, Qing-Yan The Highly Connected MOFs Constructed from Nonanuclear and Trinuclear Lanthanide-Carboxylate Clusters: Selective Gas Adsorption and Luminescent pH Sensing. Inorganic chemistry 56(4) (2017) 2159-2164
Space group: P -6 2 c
Cell volume: 12797
Cell parameters: 22.6051; 22.6051; 28.9178; 90; 90; 120;

COD ID: 4345351

Formula: - C171 H147 N3 O66 Tb12 -
Comments: Li, Yun-Jian; Wang, Yu-Ling; Liu, Qing-Yan The Highly Connected MOFs Constructed from Nonanuclear and Trinuclear Lanthanide-Carboxylate Clusters: Selective Gas Adsorption and Luminescent pH Sensing. Inorganic chemistry 56(4) (2017) 2159-2164
Space group: P -6 2 c
Cell volume: 12776.3
Cell parameters: 22.5682; 22.5682; 28.9654; 90; 90; 120;

COD ID: 4347384
CIF file	Formula: - C102 H97.5 N12 Na2 Ni8 O33 P3 - Comments: Escuer, Albert; Mayans, Júlia; Font-Bardia, Mercè Linked Nickel Metallacrowns from a Phosphonate/2-Pyridyloximate Blend of Ligands: Structure and Magnetic Properties. Inorganic chemistry 55(6) (2016) 3161-3168 Space group: P -6 2 c Cell volume: 6748.2 Cell parameters: 18.6908; 18.6908; 22.3049; 90; 90; 120;

COD ID: 4500727
CIF file	Formula: - C145 H139 Cl3 F6 O33 Sn6 - Comments: Chandrasekhar, V.; Thilagar, P.; Steiner, A. Guest-Assisted Self-assembly of Organostannoxane Nanotubules on a Mica Surface Crystal Growth & Design 11(5) (2011) 1446 Space group: P -6 2 c Cell volume: 7904 Cell parameters: 15.7406; 15.7406; 36.836; 90; 90; 120;

COD ID: 4500908
CIF file	Formula: - C9 H3 N O9 Sr2 - Comments: Lee, Dong Woo; Jo, Vinna; Ok, Kang Min Sr2[C6H3(CO2)3(NO3)]·DMF: One-Dimensional Nano-Channel in a New Non-Centrosymmetric Strontium‒Organic Framework with High Thermal Stability Crystal Growth & Design 11(7) (2011) 2698 Space group: P -6 2 c Cell volume: 2620.1 Cell parameters: 17.3726; 17.3726; 10.0243; 90; 90; 120;

COD ID: 4503674

Formula: - C6 H15 N27 O7 Zn4 -
Comments: Jiang, Tao; Zhang, Xian-Ming Temperature Tuned Synthesis of ZincN,N-bis-(1(2)H-tetrazol-5-yl)-amine Complexes: From Zn3O Cluster-Based 3-Connected 63-hcband (3,6)-Connected (43)2(46)-kgdLayers to Zn5(OH)4Chain-Based 3D Open Framework Crystal Growth & Design 8(8) (2008) 3077
Space group: P -6 2 c
Cell volume: 1232.47
Cell parameters: 13.8529; 13.8529; 7.4159; 90; 90; 120;

COD ID: 5900017
CIF file	Formula: - C3 H6 Cl2 Sb - Comments: Wells, A. F. The Crystal Structure of the Trimethylstibine Dihalides (CH~3~)~3~SbX~2~ Zeitschrift für Kristallographie - Crystalline Materials 99(1-6) (1938) 367-367 Space group: P -6 2 c Cell volume: 386.32 Cell parameters: 7.27; 7.27; 8.44; 90; 90; 120;

COD ID: 5900018
CIF file	Formula: - C3 H6 Br2 Sb - Comments: Wells, A. F. The Crystal Structure of the Trimethylstibine Dihalides (CH~3~)~3~SbX~2~ Zeitschrift für Kristallographie - Crystalline Materials 99(1-6) (1938) 367-367 Space group: P -6 2 c Cell volume: 419.79 Cell parameters: 7.38; 7.38; 8.9; 90; 90; 120;

COD ID: 5900019
CIF file	Formula: - C3 H6 I2 Sb - Comments: Wells, A. F. The Crystal Structure of the Trimethylstibine Dihalides (CH~3~)~3~SbX~2~ Zeitschrift für Kristallographie - Crystalline Materials 99(1-6) (1938) 367-367 Space group: P -6 2 c Cell volume: 470.91 Cell parameters: 7.53; 7.53; 9.59; 90; 90; 120;

COD ID: 6000341
CIF file	Formula: - Ir Sn Zr - Comments: Zumdick, M. F.; Pottgen, R. Determination of the superstructures for the stannides ZrIrSn, HfCoSn, and HfRhSn Zeitschrift für Kristallographie 214(2) (1999) 90-97 Space group: P -6 2 c Cell volume: 339.86 Cell parameters: 7.321; 7.321; 7.322; 90; 90; 120;

COD ID: 6000342
CIF file	Formula: - Co Hf Sn - Comments: Zumdick, M. F.; Pottgen, R. Determination of the superstructures for the stannides ZrIrSn, HfCoSn, and HfRhSn Zeitschrift für Kristallographie 214(2) (1999) 90-97 Space group: P -6 2 c Cell volume: 310.65 Cell parameters: 7.131; 7.131; 7.054; 90; 90; 120;

COD ID: 6000343
CIF file	Formula: - Hf Rh Sn - Comments: Zumdick, M. F.; Pottgen, R. Determination of the superstructures for the stannides ZrIrSn, HfCoSn, and HfRhSn Zeitschrift für Kristallographie 214(2) (1999) 90-97 Space group: P -6 2 c Cell volume: 331.69 Cell parameters: 7.32; 7.32; 7.148; 90; 90; 120;

COD ID: 7003651

Formula: - C39 H57 Ag F6 Fe3 O12 P4 Se3 -
Comments: Santra, Bidyut Kumar; Chen, Jia-Li; Sarkar, Bijay; Liu, C. W. The coordination chemistry of selenophosphite ligands. Synthesis and characterization of heterometallic tetranuclear clusters [M{CpFe(CO)2P(Se)(OR)2}3](PF6) (M = Cu, Ag; R = nPr, iPr) and [Cu(μ-X) {CpFe(CO)2P(Se)(OiPr)2}]2 (X = Cl, Br) Dalton Transactions (issue 17) (2008) 2270-2276
Space group: P -6 2 c
Cell volume: 2840
Cell parameters: 13.2836; 13.2836; 18.5844; 90; 90; 120;

COD ID: 7003652

Formula: - C39 H57 Cu F6 Fe3 O12 P4 Se3 -
Comments: Santra, Bidyut Kumar; Chen, Jia-Li; Sarkar, Bijay; Liu, C. W. The coordination chemistry of selenophosphite ligands. Synthesis and characterization of heterometallic tetranuclear clusters [M{CpFe(CO)2P(Se)(OR)2}3](PF6) (M = Cu, Ag; R = nPr, iPr) and [Cu(μ-X) {CpFe(CO)2P(Se)(OiPr)2}]2 (X = Cl, Br) Dalton Transactions (issue 17) (2008) 2270-2276
Space group: P -6 2 c
Cell volume: 2797.3
Cell parameters: 13.0809; 13.0809; 18.877; 90; 90; 120;

COD ID: 7016988
CIF file	Formula: - C12 H23 Br5 N6 - Comments: Driver, Gordon W.; Mutikainen, Ilpo The complex story of a simple Brønsted acid: Unusual speciation of HBr in an ionic liquid medium. Dalton transactions (Cambridge, England : 2003) 40(41) (2011) 10801-10803 Space group: P -6 2 c Cell volume: 1073.93 Cell parameters: 13.2; 13.2; 7.117; 90; 90; 120;

COD ID: 7021184

Formula: - C36 H108 Cl9 La3 N15 Na3 Ni9 O96 -
Comments: Li, Zhong-Yi; Zhu, Jiang; Wang, Xiao-Qun; Ni, Jun; Zhang, Jian-Jun; Liu, Shu-Qin; Duan, Chun-Ying New 3d-4f heterometallic clusters built from mixed glycine and iminodiacetate acid: dioctahedron {La2Ni9} and onion-like {Gd5}⊂{Ni12} with interesting magnetocaloric effect. Dalton transactions (Cambridge, England : 2003) 42(16) (2013) 5711-5717
Space group: P -6 2 c
Cell volume: 5692
Cell parameters: 15; 15; 29.211; 90; 90; 120;

COD ID: 7030914
CIF file	Formula: - C63 H57 F6 N3 P Pt3 S3 Tl - Comments: Belío, Ursula; Fuertes, Sara; Martín, Antonio Preparation of Pt-Tl clusters showing new geometries. X-ray, NMR and luminescence studies. Dalton transactions (Cambridge, England : 2003) 43(28) (2014) 10828-10843 Space group: P -6 2 c Cell volume: 2824.8 Cell parameters: 15.6681; 15.6681; 13.2867; 90; 90; 120;

COD ID: 7036757
CIF file	Formula: - C24 H49 Co4 N9 O27 P3 S0.5 - Comments: Begum, S.; Horike, S.; Kitagawa, S.; Krautscheid, H. Water stable triazolyl phosphonate MOFs: steep water uptake and facile regeneration. Dalton transactions (Cambridge, England : 2003) 44(43) (2015) 18727-18730 Space group: P -6 2 c Cell volume: 2398.6 Cell parameters: 20.594; 20.594; 6.5304; 90; 90; 120;

COD ID: 7047934

Formula: - C78 H85 Cd3 N13 O25 -
Comments: Kang, Da-Wei; Han, Xue; Ma, Xin-Jun; Liu, Ying-Ying; Ma, Jian-Fang Two cyclotriveratrylene metal-organic frameworks as effective catalysts for Knoevenagel condensation and CO2 cycloaddition with epoxides. Dalton transactions (Cambridge, England : 2003) 47(45) (2018) 16197-16204
Space group: P -6 2 c
Cell volume: 11018.2
Cell parameters: 18.3047; 18.3047; 37.9711; 90; 90; 120;

COD ID: 7047935

Formula: - C84 H95 N15 O28 Zn3 -
Comments: Kang, Da-Wei; Han, Xue; Ma, Xin-Jun; Liu, Ying-Ying; Ma, Jian-Fang Two cyclotriveratrylene metal-organic frameworks as effective catalysts for Knoevenagel condensation and CO2 cycloaddition with epoxides. Dalton transactions (Cambridge, England : 2003) 47(45) (2018) 16197-16204
Space group: P -6 2 c
Cell volume: 12254.3
Cell parameters: 19.456; 19.456; 37.381; 90; 90; 120;

COD ID: 7047936

Formula: - C81 H78 Cd3 N12 O18 -
Comments: Kang, Da-Wei; Han, Xue; Ma, Xin-Jun; Liu, Ying-Ying; Ma, Jian-Fang Two cyclotriveratrylene metal-organic frameworks as effective catalysts for Knoevenagel condensation and CO2 cycloaddition with epoxides. Dalton transactions (Cambridge, England : 2003) 47(45) (2018) 16197-16204
Space group: P -6 2 c
Cell volume: 11158.2
Cell parameters: 18.113; 18.113; 39.272; 90; 90; 120;

COD ID: 7049963
CIF file	Formula: - C H0 N6 Na6 O73 V15 - Comments: Mulkapuri, Sateesh; Kurapati, Sathish Kumar; Das, Samar K. Carbonate encapsulation from dissolved atmospheric CO<sub>2</sub> into a polyoxovanadate capsule. Dalton transactions (Cambridge, England : 2003) 48(24) (2019) 8773-8781 Space group: P -6 2 c Cell volume: 3377.6 Cell parameters: 12.991; 12.991; 23.1099; 90; 90; 120;

COD ID: 7058007

Formula: - C15 H30 N9 Nd O12 S3 -
Comments: Packiaraj, S.; Kanchana, P.; Pushpaveni, A.; Puschmann, H.; Govindarajan, S. Different coordination geometries of lighter lanthanates driven by the symmetry of guanidines as charge compensators New Journal of Chemistry 43(2) (2019) 979
Space group: P -6 2 c
Cell volume: 1571.83
Cell parameters: 10.84404; 10.84404; 15.4345; 90; 90; 120;

COD ID: 7058009
CIF file	Formula: - C15 H30 N9 O12 Pr S3 - Comments: Packiaraj, S.; Kanchana, P.; Pushpaveni, A.; Puschmann, H.; Govindarajan, S. Different coordination geometries of lighter lanthanates driven by the symmetry of guanidines as charge compensators New Journal of Chemistry 43(2) (2019) 979 Space group: P -6 2 c Cell volume: 1574.42 Cell parameters: 10.8781; 10.8781; 15.3633; 90; 90; 120;

COD ID: 7059326

Formula: - C H38 B24 K15 N2 Na O68 -
Comments: Cao, Yuchen; Zhang, Bingbing; Liu, Hongkun; Li, Danni; Wang, Ying NaK15[B4O5(OH)4]6(NO2)2(CO3)·7H2O: assembly of an unprecedented mixed anion inorganic compound via a facile hydrothermal route New Journal of Chemistry 44(11) (2020) 4253-4256
Space group: P -6 2 c
Cell volume: 3277.3
Cell parameters: 11.1399; 11.1399; 30.495; 90; 90; 120;

COD ID: 7060587

Formula: - C2 H Cl2 N3 -
Comments: Kordestani, Nazanin; Amiri Rudbari, Hadi; Correia, Isabel; Valente, Andreia; Côrte-Real, Leonor; Islam, Mohammad Khairul; Micale, Nicola; Braun, Jason D.; Herbert, David E.; Tumanov, Nikolay; Wouters, Johan; Enamullah, Mohammed Heteroleptic enantiopure Pd(ii)-complexes derived from halogen-substituted Schiff bases and 2-picolylamine: synthesis, experimental and computational characterization and investigation of the influence of chirality and halogen atoms on the anticancer activity New Journal of Chemistry 45(20) (2021) 9163-9180
Space group: P -6 2 c
Cell volume: 733.61
Cell parameters: 11.409; 11.409; 6.5079; 90; 90; 120;

COD ID: 7100637
CIF file	Formula: - C58 Cr6 N2 O48 - Comments: Christian Serre; Gerard Ferey; Caroline Mellot-Draznieks; Franck Millange; Suzy Surble An new isoreticular class of Metal-Organic-Frameworks with the MIL-88 topology Chemical Communications (2006) Space group: P -6 2 c Cell volume: 1998.2 Cell parameters: 11.0282; 11.0282; 18.9717; 90; 90; 120;

COD ID: 7100638
CIF file	Formula: - C84 Cr6 N56 O50 - Comments: Christian Serre; Gerard Ferey; Caroline Mellot-Draznieks; Franck Millange; Suzy Surble An new isoreticular class of Metal-Organic-Frameworks with the MIL-88 topology Chemical Communications (2006) Space group: P -6 2 c Cell volume: 3485.4 Cell parameters: 12.1647; 12.1647; 27.1971; 90; 90; 120;

COD ID: 7100639
CIF file	Formula: - C90.4 Fe6 O46.4 - Comments: Christian Serre; Gerard Ferey; Caroline Mellot-Draznieks; Franck Millange; Suzy Surble An new isoreticular class of Metal-Organic-Frameworks with the MIL-88 topology Chemical Communications (2006) Space group: P -6 2 c Cell volume: 2131.5 Cell parameters: 10.1751; 10.1751; 23.7722; 90; 90; 120;

COD ID: 7107838

Formula: - C66 H42 In3 O16 -
Comments: Fuxing Sun; Jiangtao Jia; Tsolmon Borjigin; Hao Ren; Tingting Zhang; Zheng Bian; Lianxun Gao; Guangshan Zhu Highly porous and robust ionic MOFs with nia topology constructed by connecting an octahedral ligand and a trigonal prismatic metal cluster Chem.Commun. 48 (2012) 6010
Space group: P -6 2 c
Cell volume: 9124.8
Cell parameters: 19.4356; 19.4356; 27.893; 90; 90; 120;

COD ID: 7107839

Formula: - C66 H43 Mn3 O16 -
Comments: Fuxing Sun; Jiangtao Jia; Tsolmon Borjigin; Hao Ren; Tingting Zhang; Zheng Bian; Lianxun Gao; Guangshan Zhu Highly porous and robust ionic MOFs with nia topology constructed by connecting an octahedral ligand and a trigonal prismatic metal cluster Chem.Commun. 48 (2012) 6010
Space group: P -6 2 c
Cell volume: 9413.4
Cell parameters: 20.0962; 20.0962; 26.9145; 90; 90; 120;

COD ID: 7108891

Formula: - C36 H68 Cl16 Fe6 N12 O23 -
Comments: Prodius, Denis; Macaev, Fliur; Stingaci, Eugenia; Pogrebnoi, Vsevolod; Mereacre, Valeriu; Novitchi, Ghenadie; Kostakis, George E.; Anson, Christopher E.; Powell, Annie K. Catalytic "triangles": binding of iron in task-specific ionic liquids Chemical Communications (Cambridge, United Kingdom) 49(19) (2013) 1915-1917
Space group: P -6 2 c
Cell volume: 3801.1
Cell parameters: 13.3201; 13.3201; 24.738; 90; 90; 120;

COD ID: 7109533

Formula: - C66 H0 N0 O16 Yb3 -
Comments: Yabing He; Hiroyasu Furukawa; Chuande Wu; Michael O'Keeffe; Rajamani Krishna; Banglin Chen Low-energy regeneration and high productivity in a lanthanide-hexacarboxylate framework for high-pressure CO2-CH4-H2 separation Chem.Commun. 49 (2013) 6773
Space group: P -6 2 c
Cell volume: 9502.5
Cell parameters: 19.848; 19.848; 27.853; 90; 90; 120;

COD ID: 7110645
CIF file	Formula: - C40 H66 N11 Ru S6 - Comments: Maiti, Rabindranath; Shang, Maoyu; Graham Lappin, A. A ruthenium(IV) complex with six sulfur donor atoms Chemical Communications (issue 23) (1999) 2349 Space group: P -6 2 c Cell volume: 2654.6 Cell parameters: 13.494; 13.494; 16.834; 90; 90; 120;

COD ID: 7115933
CIF file	Formula: - C25 H21 B2 F8 N6 Ni - Comments: Peili Zhang; Mei Wang; Yong Yang; Dehua Zheng; Kai Han; Licheng Sun Highly efficient molecular nickel catalysts for electrochemical hydrogen production from neutral water Chem.Commun. 50 (2014) 14153 Space group: P -6 2 c Cell volume: 4126.5 Cell parameters: 18.058; 18.058; 14.612; 90; 90; 120;

COD ID: 7122380

Formula: - C29 H18 Co3 N O16 -
Comments: Zhang, Qing-Qing; Liu, Xiao-Fei; Ma, Lin; Wei, Yong-Sheng; Wang, Zhao-Yang; Xu, Hong; Zang, Shuang-Quan Remoulding a MOF's pores by auxiliary ligand introduction for stability improvement and highly selective CO2-capture. Chemical communications (Cambridge, England) 54(85) (2018) 12029-12032
Space group: P -6 2 c
Cell volume: 2519.54
Cell parameters: 14.5594; 14.5594; 13.7247; 90; 90; 120;

COD ID: 7122381

Formula: - C50.01 H28 Co3 N4 O13 -
Comments: Zhang, Qing-Qing; Liu, Xiao-Fei; Ma, Lin; Wei, Yong-Sheng; Wang, Zhao-Yang; Xu, Hong; Zang, Shuang-Quan Remoulding a MOF's pores by auxiliary ligand introduction for stability improvement and highly selective CO2-capture. Chemical communications (Cambridge, England) 54(85) (2018) 12029-12032
Space group: P -6 2 c
Cell volume: 2522.37
Cell parameters: 14.3406; 14.3406; 14.1626; 90; 90; 120;

COD ID: 7122382

Formula: - C50.01 H28 Co3 N4 O13 -
Comments: Zhang, Qing-Qing; Liu, Xiao-Fei; Ma, Lin; Wei, Yong-Sheng; Wang, Zhao-Yang; Xu, Hong; Zang, Shuang-Quan Remoulding a MOF's pores by auxiliary ligand introduction for stability improvement and highly selective CO2-capture. Chemical communications (Cambridge, England) 54(85) (2018) 12029-12032
Space group: P -6 2 c
Cell volume: 2556.78
Cell parameters: 14.339; 14.339; 14.359; 90; 90; 120;

COD ID: 7130694
CIF file	Formula: - C60 H78 F41 N12 P7 Pd3 - Comments: Abe, Tsukasa; Horiuchi, Shinnosuke; Hiraoka, Shuichi Kinetically controlled narcissistic self-sorting of Pd(ii)-linked self-assemblies from structurally similar tritopic ligands Chemical Communications (2022) Space group: P -6 2 c Cell volume: 5819.7 Cell parameters: 16.6805; 16.6805; 24.152; 90; 90; 120;

COD ID: 7200275

Formula: - C22 H29 N5 Ni O9 -
Comments: Gao, Chaoying; Liu, Shuxia; Xie, Linhua; Sun, Chunyan; Cao, Jianfang; Ren, Yuanhang; Feng, Dan; Su, Zhongming Rational design microporous pillared-layer frameworks: syntheses, structures and gas sorption properties CrystEngComm 11(1) (2009) 177
Space group: P -6 2 c
Cell volume: 6679.4
Cell parameters: 16.6361; 16.6361; 27.868; 90; 90; 120;

COD ID: 7209370
CIF file	Formula: - Ag2 I10 Tl6 - Comments: Stoeger, W.; Rabenau, A. Tl6 Ag2 I10, ein Polyiodid mit Ag2-Paaren. Darstellung, Eigenschaften und Kristallstruktur Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986) 33 (1978) 740-744 Space group: P -6 2 c Cell volume: 1275.98 Cell parameters: 10.48; 10.48; 13.415; 90; 90; 120;

COD ID: 7209409
CIF file	Formula: - Au2 I10 Tl6 - Comments: Stoeger, W.; Rabenau, A. Darstellung, Eigenschaften und Kristallstruktur von Tl6 Au2 I10 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986) 34 (1979) 685-692 Space group: P -6 2 c Cell volume: 1299.29 Cell parameters: 10.569; 10.569; 13.431; 90; 90; 120;

COD ID: 7212776
CIF file	Formula: - H150 K12 O239 P6 Rb6 V8 W39 - Comments: Assran, Awatef S.; Izarova, Natalya V.; Kortz, Ulrich Mixed-valent vanadium substituted polyoxometalates: the wheel shaped [Rb3⊂{VVVIV3O7(H2O)6}2{H6P6W39O147(H2O)3}]15− CrystEngComm 12(10) (2010) 2684 Space group: P -6 2 c Cell volume: 9779.4 Cell parameters: 22.9885; 22.9885; 21.3679; 90; 90; 120;

COD ID: 7221229
CIF file	Formula: - Li2 Sb - Comments: Mueller, W. Darstellung und Struktur der Phase Li2 Sb Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977) 32 (1977) 357-359 Space group: P -6 2 c Cell volume: 356.896 Cell parameters: 7.946; 7.946; 6.527; 90; 90; 120;

COD ID: 7222598

Formula: - Pt Sc Sn -
Comments: Mishra, R.; Poettgen, R.; Mosel, B.D.; Hoffmann, R.D.; Trill, H.; Piotrowski, H.; Zumdick, M.F. The stannides RE Rh Sn (RE= Ho-Yb) and Sc T Sn (T= Pd, Pt) - structure refinements and 119Sn Moessbauer spectroscopy Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 56 (2001) 589-597
Space group: P -6 2 c
Cell volume: 344.418
Cell parameters: 7.3837; 7.3837; 7.2947; 90; 90; 120;

COD ID: 7236550

Formula: - C18 H21 N15 -
Comments: Wang, Hailong; Wu, Hui; Kan, Jinglan; Chang, Ganggang; Yao, Zizhu; Li, Bin; Zhou, Wei; Xiang, Shengchang; Cong-Gui Zhao, John; Chen, Banglin A microporous hydrogen-bonded organic framework with amine sites for selective recognition of small molecules Journal of Materials Chemistry A 5(18) (2017) 8292
Space group: P -6 2 c
Cell volume: 1306.21
Cell parameters: 11.3535; 11.3535; 11.701; 90; 90; 120;

COD ID: 7236667

Formula: - C36 H23 Cl3 Cu1.5 N6 O16 Sc3 -
Comments: Marshall, Ross J.; Lennon, Ciaran T.; Tao, Andi; Senn, Hans M.; Wilson, Claire; Fairen-Jimenez, David; Forgan, Ross S. Controlling interpenetration through linker conformation in the modulated synthesis of Sc metal‒organic frameworks Journal of Materials Chemistry A 6(3) (2018) 1181
Space group: P -6 2 c
Cell volume: 6936.1
Cell parameters: 17.993; 17.993; 24.7387; 90; 90; 120;

COD ID: 7241794

Formula: - C58 H38 N O16 Sc3 -
Comments: Prasad, Ram R. R.; Pleass, Charlotte; Rigg, Amber L.; Cordes, David B.; Lozinska, Magdalena M.; Georgieva, Veselina M.; Hoffmann, Frank; Slawin, Alexandra M. Z.; Wright, Paul A. Isoreticular chemistry of scandium analogues of the multicomponent metal‒organic framework MIL-142 CrystEngComm 23(4) (2021) 804-812
Space group: P -6 2 c
Cell volume: 14873.8
Cell parameters: 31.808; 31.808; 16.9754; 90; 90; 120;

COD ID: 7242864
CIF file	Formula: - C108 H66 Cl4 Co14 N30 O25 S12 - Comments: Yu, Yanan; Wang, Zhao; Li, Ziping; Hang, Xinxin; Bi, Yanfeng Assembly of {Co14} nanoclusters from adenine-modified Co4-thiacalix[4]arene units CrystEngComm 23(24) (2021) 4382-4388 Space group: P -6 2 c Cell volume: 11004.9 Cell parameters: 25.8926; 25.8926; 18.9542; 90; 90; 120;

COD ID: 7245153

Formula: - C9 H12 Co K N5 O3 -
Comments: Tsunashima, Ryo; Fujikawa, Naomi; Shiga, Misaki; Miyagawa, Sayu; Ohno, Shiori; Masuya-Suzuki, Atsuko; Takahashi, Kiyonori; Nakamura, Takayoshi; Akutagawa, Tomoyuki; Nishihara, Sadafumi Slider-crank Mechanism in a Molecular Crystal: Conversion of Linear Thermal Expansion of Lattice to Circular Rotation of Coordination Chain CrystEngComm (2022)
Space group: P -6 2 c
Cell volume: 685.46
Cell parameters: 10.473; 10.473; 7.2162; 90; 90; 120;

COD ID: 7245155

Formula: - C9 H12 Co K N5 O3 -
Comments: Tsunashima, Ryo; Fujikawa, Naomi; Shiga, Misaki; Miyagawa, Sayu; Ohno, Shiori; Masuya-Suzuki, Atsuko; Takahashi, Kiyonori; Nakamura, Takayoshi; Akutagawa, Tomoyuki; Nishihara, Sadafumi Slider-crank Mechanism in a Molecular Crystal: Conversion of Linear Thermal Expansion of Lattice to Circular Rotation of Coordination Chain CrystEngComm (2022)
Space group: P -6 2 c
Cell volume: 667.21
Cell parameters: 10.3782; 10.3782; 7.153; 90; 90; 120;

COD ID: 7245156

Formula: - C9 H12 Co K N5 O3 -
Comments: Tsunashima, Ryo; Fujikawa, Naomi; Shiga, Misaki; Miyagawa, Sayu; Ohno, Shiori; Masuya-Suzuki, Atsuko; Takahashi, Kiyonori; Nakamura, Takayoshi; Akutagawa, Tomoyuki; Nishihara, Sadafumi Slider-crank Mechanism in a Molecular Crystal: Conversion of Linear Thermal Expansion of Lattice to Circular Rotation of Coordination Chain CrystEngComm (2022)
Space group: P -6 2 c
Cell volume: 697.06
Cell parameters: 10.5556; 10.5556; 7.2239; 90; 90; 120;

COD ID: 7245157

Formula: - C9 H12 Co K N5 O3 -
Comments: Tsunashima, Ryo; Fujikawa, Naomi; Shiga, Misaki; Miyagawa, Sayu; Ohno, Shiori; Masuya-Suzuki, Atsuko; Takahashi, Kiyonori; Nakamura, Takayoshi; Akutagawa, Tomoyuki; Nishihara, Sadafumi Slider-crank Mechanism in a Molecular Crystal: Conversion of Linear Thermal Expansion of Lattice to Circular Rotation of Coordination Chain CrystEngComm (2022)
Space group: P -6 2 c
Cell volume: 680.13
Cell parameters: 10.453; 10.453; 7.1875; 90; 90; 120;

COD ID: 7245158

Formula: - C9 H12 Co K N5 O3 -
Comments: Tsunashima, Ryo; Fujikawa, Naomi; Shiga, Misaki; Miyagawa, Sayu; Ohno, Shiori; Masuya-Suzuki, Atsuko; Takahashi, Kiyonori; Nakamura, Takayoshi; Akutagawa, Tomoyuki; Nishihara, Sadafumi Slider-crank Mechanism in a Molecular Crystal: Conversion of Linear Thermal Expansion of Lattice to Circular Rotation of Coordination Chain CrystEngComm (2022)
Space group: P -6 2 c
Cell volume: 661.92
Cell parameters: 10.3499; 10.3499; 7.1351; 90; 90; 120;

COD ID: 7245159

Formula: - C9 H12 Co K N5 O3 -
Comments: Tsunashima, Ryo; Fujikawa, Naomi; Shiga, Misaki; Miyagawa, Sayu; Ohno, Shiori; Masuya-Suzuki, Atsuko; Takahashi, Kiyonori; Nakamura, Takayoshi; Akutagawa, Tomoyuki; Nishihara, Sadafumi Slider-crank Mechanism in a Molecular Crystal: Conversion of Linear Thermal Expansion of Lattice to Circular Rotation of Coordination Chain CrystEngComm (2022)
Space group: P -6 2 c
Cell volume: 672.74
Cell parameters: 10.411; 10.411; 7.1669; 90; 90; 120;

COD ID: 7700619

Formula: - C41 H100 Br3 Cl6 N5 Re12 S14 -
Comments: Gayfulin, Yakov M.; Brylev, Konstantin A.; Ryzhikov, Maxim R.; Samsonenko, Denis G.; Kitamura, Noboru; Mironov, Yuri V. Luminescent twelve-nuclear rhenium clusters. Dalton transactions (Cambridge, England : 2003) 48(33) (2019) 12522-12530
Space group: P -6 2 c
Cell volume: 3791.6
Cell parameters: 11.5764; 11.5764; 32.67; 90; 90; 120;

COD ID: 8102958
CIF file	Formula: - Ga Hf Pd - Comments: Demchyna, R.; Prots, Yu.; Burkhardt, U.; Schwarz, U.; Grin, Yu. Crystal structure of hafnium palladium gallium, HfPdGa Zeitschrift für Kristallographie - New Crystal Structures 221(4) (2006) 427-428 Space group: P -6 2 c Cell volume: 305.86 Cell parameters: 7.1572; 7.1572; 6.8945; 90; 90; 120;

COD ID: 8103493
CIF file	Formula: - B4 Ga3 Pt9 - Comments: Petry, K.; Jung, W.; Kluenter, W. Zn3 Pt9 B4, Ga2.7 Ir9 B5 und Ga3 Pt9 B4, Zink und Gallium- Uebergangsmetallboride mit neuen Kristallstrukturen Zeitschrift fuer Kristallographie (149,1979-) 209 (1994) 151-156 Space group: P -6 2 c Cell volume: 422.671 Cell parameters: 8.7503; 8.7503; 6.3742; 90; 90; 120;

COD ID: 9000056
CIF file	Formula: - C Ce F O3 - Comments: Donnay, G.; Donnay, J. D. H. The crystallography of bastnaesite, parasite, roentgenite, and synchisite American Mineralogist 38 (1953) 932-963 Space group: P -6 2 c Cell volume: 434.65 Cell parameters: 7.16; 7.16; 9.79; 90; 90; 120;

COD ID: 9000266
CIF file	Formula: - Cl2.001 Cu9.048 H33.999 N0.034 O36.699 S0.133 - Comments: McLean, W. J.; Anthony, J. W. The disordered, "zeolite-like" structure of connellite American Mineralogist 57 (1972) 426-438 Space group: P -6 2 c Cell volume: 1962.39 Cell parameters: 15.78; 15.78; 9.1; 90; 90; 120;

COD ID: 9000826
CIF file	Formula: - Cl3 Fe4.5 O41 Pb11 Si12.5 - Comments: Mellini, M.; Merlino, S. The crystal structure of jagoite American Mineralogist 66 (1981) 852-858 Space group: P -6 2 c Cell volume: 2099.23 Cell parameters: 8.528; 8.528; 33.33; 90; 90; 120;

COD ID: 9001515
CIF file	Formula: - C Ce F O3 - Comments: Ni, Y.; Hughes, J. M.; Mariano, A. N. The atomic arrangement of bastnasite-(Ce), Ce(CO3)F, and structural elements of synchysite-(Ce), rontgenite-(Ce), and parisite-(Ce) American Mineralogist 78 (1993) 415-418 Space group: P -6 2 c Cell volume: 428.272 Cell parameters: 7.1175; 7.1175; 9.7619; 90; 90; 120;

COD ID: 9004034
CIF file	Formula: - Fe S - Comments: Skala, R.; Cisarova, I.; Drabek, M. Inversion twinning in troilite Sample: Etter American Mineralogist 91 (2006) 917-921 Space group: P -6 2 c Cell volume: 362.283 Cell parameters: 5.965; 5.965; 11.757; 90; 90; 120;

COD ID: 9004035
CIF file	Formula: - Fe S - Comments: Skala, R.; Cisarova, I.; Drabek, M. Inversion twinning in troilite Sample: Georgetown American Mineralogist 91 (2006) 917-921 Space group: P -6 2 c Cell volume: 362.345 Cell parameters: 5.965; 5.965; 11.759; 90; 90; 120;

COD ID: 9004036
CIF file	Formula: - Fe S - Comments: Skala, R.; Cisarova, I.; Drabek, M. Inversion twinning in troilite Sample: Synthetic American Mineralogist 91 (2006) 917-921 Space group: P -6 2 c Cell volume: 362.651 Cell parameters: 5.966; 5.966; 11.765; 90; 90; 120;

COD ID: 9004638
CIF file	Formula: - C3 H4 K3 Na O12 U - Comments: Li, Y.; Burns, P. C. The crystal structure of synthetic grimselite, K3Na[(UO2)(CO3)3](H2O) The Canadian Mineralogist 39 (2001) 1147-1151 Space group: P -6 2 c Cell volume: 618.961 Cell parameters: 9.302; 9.302; 8.26; 90; 90; 120;

COD ID: 9005015
CIF file	Formula: - Fe0.12 K0.94 Mg4.75 Mn0.1 Na1.02 O30 Si12 Ti0.01 - Comments: Armbruster, T. Crystal chemistry of double-ring silicates: structure of roedderite at 100 and 300 K T= 100 K European Journal of Mineralogy 1 (1989) 715-718 Space group: P -6 2 c Cell volume: 1270.32 Cell parameters: 10.139; 10.139; 14.269; 90; 90; 120;

COD ID: 9005016
CIF file	Formula: - Fe0.12 K0.94 Mg4.75 Mn0.1 Na1.02 O30 Si12 Ti0.01 - Comments: Armbruster, T. Crystal chemistry of double-ring silicates: structure of roedderite at 100 and 300 K T= 300 K European Journal of Mineralogy 1 (1989) 715-718 Space group: P -6 2 c Cell volume: 1272.34 Cell parameters: 10.141; 10.141; 14.286; 90; 90; 120;

COD ID: 9007650
CIF file	Formula: - Fe S - Comments: King, Jr, H. E.; Prewitt, C. T. High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 0.0001 GPa Acta Crystallographica, Section B 38(7) (1982) 1877-1887 Space group: P -6 2 c Cell volume: 361.948 Cell parameters: 5.963; 5.963; 11.754; 90; 90; 120;

COD ID: 9007651
CIF file	Formula: - Fe S - Comments: King, Jr, H. E.; Prewitt, C. T. High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 393 K, P = 0.0001 GPa Acta Crystallographica, Section B 38(7) (1982) 1877-1887 Space group: P -6 2 c Cell volume: 364.96 Cell parameters: 5.999; 5.999; 11.71; 90; 90; 120;

COD ID: 9007652
CIF file	Formula: - Fe S - Comments: King, Jr, H. E.; Prewitt, C. T. High-pressure and high-temperature polymorphism of iron sulfides (FeS) Sample: T = 294 K, P = 3.33 GPa Acta Crystallographica, Section B 38(7) (1982) 1877-1887 Space group: P -6 2 c Cell volume: 344.406 Cell parameters: 5.861; 5.861; 11.577; 90; 90; 120;

COD ID: 9011406
CIF file	Formula: - Ce0.5 F La0.5 O2 - Comments: Oftedal, I. Zur kristallstruktur von bastnasit (Ce,La–)FCO3 Note: positions of C and at least one O undetermined Zeitschrift fur Kristallographie 78 (1931) 462-469 Space group: P -6 2 c Cell volume: 423.536 Cell parameters: 7.094; 7.094; 9.718; 90; 90; 120;

COD ID: 9011729
CIF file	Formula: - Ge H12 O17 Pb3 S2 - Comments: Otto, H. H. Die kristallstruktur von fleischerite, Pb3Ge[(OH)6\|(SO4)2]3H2O sowie kristallchemische untersuchungen an isotypen verbindungen Neues Jahrbuch fur Mineralogie, Abhandlungen 123 (1975) 160-190 Space group: P -6 2 c Cell volume: 740.48 Cell parameters*: 8.867; 8.867; 10.875; 90; 90; 120;

COD ID: 9012080
CIF file	Formula: - Ca3 H12 Mn O17 S2 - Comments: Gaudefroy, C.; Granger, M. M.; Permingeat, F.; Protas, J. La despujolsite, une nouvelle espece minerale Bulletin de la Societe Francaise de Mineralogie et de Cristallographie 91 (1968) 43-50 Space group: P -6 2 c Cell volume: 682.795 Cell parameters: 8.56; 8.56; 10.76; 90; 90; 120;

COD ID: 9012717
CIF file	Formula: - As Ni0.808 Pd1.192 - Comments: Evstigneeva, T.; Kabalov, Y.; Schneider, J. Crystal structure of PdNiAs, ordered member of isomorphous series Pd2As-Ni2As Materials Science Forum 321 (2000) 700-705 Space group: P -6 2 c Cell volume: 256.652 Cell parameters: 6.3165; 6.3165; 7.4278; 90; 90; 120;

COD ID: 9014502

Formula: - C3 H2 K2.463 Na1.537 O12 U -
Comments: Plasil, J.; Fejfarova, K.; Skala, R.; Skoda, R.; Meisser, N.; Hlousek, J.; Cisarova, I.; Dusek, M.; Veselovsky, F.; Cejka, J.; Sejkora, J.; Ondrus, P. The crystal chemistry of the uranyl carbonate mineral grimselite, (K,Na)3Na[(UO2)(CO3)3](H2O), from Jachymov, Czech Republic Note: Sample A Mineralogical Magazine 76 (2012) 443-453
Space group: P -6 2 c
Cell volume: 606.135
Cell parameters: 9.2507; 9.2507; 8.1788; 90; 90; 120;

COD ID: 9016453