Crystallography Open Database

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Searching space group like 'C 2 2 2'

COD ID: 1501805
CIF file Formula: - C9 H20 Cl N -
Comments: Kavala, Miroslav; Mathia, František; Kožíšek, Jozef; Szolcsányi, Peter Efficient total synthesis of (+)-dihydropinidine, (-)-epidihydropinidine, and (-)-pinidinone. Journal of natural products 74(4) (2011) 803-808
Space group: C 2 2 2
Cell volume: 4898.51
Cell parameters: 9.90868; 34.4359; 14.3561; 90; 90; 90;  

COD ID: 1509590
CIF file Formula: - Ag1.346 Ba2 Si1.886 -
Comments: Fornasini, M.L.; Merlo, F.; Pani, M. RMX compounds formed by alkaline earths, europium and ytterbium. IV: ternary phases with M = Ag and X =Si, Ge, Sn, Pb Journal of Alloys Compd. 232 (1996) 289-295
Space group: C 2 2 2
Cell volume: 2522.16
Cell parameters: 8.612; 14.917; 19.633; 90; 90; 90;  

COD ID: 1509928
CIF file Formula: - Ag5 Si9 Sr8 -
Comments: Schaefer, H.; Doerrscheidt, W. Beitraege zu den Stabilitaetskriterien der (Al B2)-Struktur Journal of the Less-Common Metals 78 (1981) 69-79
Space group: C 2 2 2
Cell volume: 2292.11
Cell parameters: 8.48; 14.69; 18.4; 90; 90; 90;  

COD ID: 1511341
CIF file Formula: - B1.27 Ce Pt2 -
Comments: Salamakha, P.S.; Sologub, O.L.; Godart, C. Ce Pt2 B2-x, a new structure type of ternary intermetallic borides Journal of Alloys Compd. 299 (2000) 189-194
Space group: C 2 2 2
Cell volume: 136.731
Cell parameters: 3.1648; 5.4799; 7.884; 90; 90; 90;  

COD ID: 1522039
CIF file Formula: - Ca2 K O10 Ta3 -
Comments: Toda, K.; Takakuwa, S.; Teranishi, T.; Sakai, N.; Sato, M. New layered perovskite compound synthesized by the soft chemistry: K Ca2 Ta3 O10 Key Engineering Materials 169 (1999) 231-234
Space group: C 2 2 2
Cell volume: 443.4
Cell parameters: 3.8657; 29.777; 3.852; 90; 90; 90;  

COD ID: 1522040
CIF file Formula: - Ca2 K O10 Ta3 -
Comments: Toda, K.; Takakuwa, S.; Sakai, N.; Teranishi, T.; Sato, M. New layered perovskite compound synthesized by the soft chemistry: K Ca2 Ta3 O10 Key Engineering Materials 169 (1999) 231-234
Space group: C 2 2 2
Cell volume: 434.046
Cell parameters: 3.8789; 29.021; 3.8558; 90; 90; 90;  

COD ID: 1528093
CIF file Formula: - Ga Li5 O4 -
Comments: Stewner, F.; Hoppe, R. Zur Kristallstruktur von beta-Li5 Ga O4 Zeitschrift fuer Anorganische und Allgemeine Chemie 381 (1971) 140-148
Space group: C 2 2 2
Cell volume: 386.467
Cell parameters: 9.288; 8.983; 4.632; 90; 90; 90;  

COD ID: 1530123
CIF file Formula: - D0.48 Ta -
Comments: Kaneko, H.; Kajitani, T.; Leung, P.; Nimura, N.; Hirabayashi, M.; Schultz, A.J. Neutron diffraction study of beta1-beta2 transformation in Ta2 D Journal of the Less-Common Metals 103 (1984) 45-51
Space group: C 2 2 2
Cell volume: 153.357
Cell parameters: 6.718; 3.359; 6.796; 90; 90; 90;  

COD ID: 1533733
CIF file Formula: - Ga2.49 Ge0.51 Y -
Comments: Speka, M.V.; Zakharenko, M.I.; Markiv, V.Ya.; Belyavina, N.M. Isothermal section of the Y - Ge - Ga system at 600 C in the region up to 37 at% Y Journal of Alloys Compd. 368 (2004) 41-46
Space group: C 2 2 2
Cell volume: 2021.1
Cell parameters: 8.425; 22.64; 10.596; 90; 90; 90;  

COD ID: 1540370
CIF file Formula: - Bi10 Fe10 O46 Sr15 -
Comments: le Page, Y.; McKinnon, W.R.; Barboux, P.; Tarascon, J.M. Origin of the incommensurate modulation of the 80-K superconductor Bi2 Sr2 Ca Cu2 O8.21 derived from isostructural commensurate Bi10 Sr15 Fe10 O46 Physical Review, Serie 3. B - Condensed Matter (18,1978-) 40 (1989) 6810-6816
Space group: C 2 2 2
Cell volume: 4716.49
Cell parameters: 27.245; 31.696; 5.4617; 90; 90; 90;  

COD ID: 1543203
CIF file Formula: - C384 H504 Cd24 N24 O144 Sm8 -
Comments: Yang, Xiaoping; Wang, Shiqing; Schipper, Desmond; Zhang, Lijie; Li, Zongping; Huang, Shaoming; Yuan, Daqiang; Chen, Zhongning; Gnanam, Annie J.; Hall, Justin W.; King, Tyler L.; Que, Emily; Dieye, Yakhya; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A. Self-assembly of high-nuclearity lanthanide-based nanoclusters for potential bioimaging applications. Nanoscale 8(21) (2016) 11123-11129
Space group: C 2 2 2
Cell volume: 159875
Cell parameters: 56.782; 62.983; 44.704; 90; 90; 90;  

COD ID: 1545643
CIF file Formula: - K La Nb2 O7 -
Comments: Sato, M.; Abo, J.; Jin, T.; Ohta, M. Structure determination of KLaNb2O7 exhibiting ion exchange ability by X-ray powder diffraction Solid State Ionics 51 (1992) 85-89
Space group: C 2 2 2
Cell volume: 328.066
Cell parameters: 3.906; 21.603; 3.8879; 90; 90; 90;  

COD ID: 1556347
CIF file Formula: - C144 Cu6 O42 P3 -
Comments: Zheng, Min; Liu, Yan; Wang, Cheng; Liu, Shubin; Lin, Wenbin Cavity-induced enantioselectivity reversal in a chiral metal‒organic framework Brønsted acid catalyst Chemical Science 3(8) (2012) 2623
Space group: C 2 2 2
Cell volume: 26171.9
Cell parameters: 17.5328; 30.3514; 49.1818; 90; 90; 90;  

COD ID: 1562792
CIF file Formula: - Br0 O4.25 Rb0.5 Se0 Si1.25 U0.5 -
Comments: Babo, Jean-Marie; Albrecht-Schmitt, Thomas E. High temperature synthesis of two open-framework uranyl silicates with ten-ring channels: Cs2(UO2)2Si8O19 and Rb2(UO2)2Si5O13 Journal of Solid State Chemistry 197 (2013) 186-190
Space group: C 2 2 2
Cell volume: 901.6
Cell parameters: 7.1181; 17.949; 7.0568; 90; 90; 90;  

COD ID: 1571902
CIF file Formula: - C7 H12 I6 N2 Pb2 -
Comments: Fan, Chang-Chun; Liu, Cheng-Dong; Liang, Bei-Dou; Ju, Tong-Yu; Wang, Wei; Jin, Ming-Liang; Chai, Chao-Yang; Zhang, Wen Chiral three-dimensional organic-inorganic lead iodide hybrid semiconductors. Chemical science 15(29) (2024) 11374-11381
Space group: C 2 2 2
Cell volume: 1093.35
Cell parameters: 9.4743; 17.7301; 6.5088; 90; 90; 90;  

COD ID: 1571903
CIF file Formula: - C7 H12 I6 N2 Pb2 -
Comments: Fan, Chang-Chun; Liu, Cheng-Dong; Liang, Bei-Dou; Ju, Tong-Yu; Wang, Wei; Jin, Ming-Liang; Chai, Chao-Yang; Zhang, Wen Chiral three-dimensional organic-inorganic lead iodide hybrid semiconductors. Chemical science 15(29) (2024) 11374-11381
Space group: C 2 2 2
Cell volume: 1092.5
Cell parameters: 9.4786; 17.7233; 6.5033; 90; 90; 90;  

COD ID: 2101049
CIF file

Original IUCr paper

 Formula: - O8 W3 -
Comments: Sundberg, M.; Zakharov, N. D.; Zibrov, I. P.; Barabanenkov, Yu. A.; Filonenko, V. P.; Werner, P. Two high-pressure tungsten oxide structures of W~3~O~8~ stoichiometry deduced from high-resolution electron microscopy images Acta Crystallographica Section B 49(6) (1993) 951-958
Space group: C 2 2 2
Cell volume: 252.97
Cell parameters: 6.386; 10.43; 3.798; 90; 90; 90;  

COD ID: 2103256
CIF file

HKL data

Original IUCr paper

 Formula: - Bi Co2 O8.25 Sr3 -
Comments: Perez, O.; Masset, A. C.; Leligny, H.; Baldinozzi, G.; Pelloquin, D.; Dutheil, M. Single-crystal study of the <i>m</i> = 2 tubular cobalt oxide, Bi~4~Sr~12~Co~8~O~30{-~δ} Acta Crystallographica Section B 58(2) (2002) 191-197
Space group: C 2 2 2
Cell volume: 3042.14
Cell parameters: 23.4782; 23.4857; 5.5171; 90; 90; 90;  

COD ID: 2106971
CIF file Formula: - O2.634 U0.878 -
Comments: Greaves, C.; Fender, B.E.F. The Structure of alpha-U O3 by Neutron and Electron Diffraction Acta Crystallographica B (24,1968-38,1982) 28 (1972) 3609-3614
Space group: C 2 2 2
Cell volume: 1235.45
Cell parameters: 6.84; 43.45; 4.157; 90; 90; 90;  

COD ID: 2310519
CIF file Formula: - O8 U3 -
Comments: Andresen, A.F. The structure of U3 O8 determined by neutron diffraction Acta Crystallographica (1,1948-23,1967) 11 (1958) 612-614
Space group: C 2 2 2
Cell volume: 331.827
Cell parameters: 6.704; 11.95; 4.142; 90; 90; 90;  

COD ID: 4118579
CIF file Formula: - C36 H37 Au Cl N3 -
Comments: Javier Francos; Francisca Grande-Carmona; Hélio Faustino; Javier Iglesias-Sigüenza; Elena Díez; Isaac Alonso; Rosario Fernández; José M. Lassaletta; Fernando López; José L. Mascareñas Axially Chiral Triazoloisoquinolin-3-ylidene Ligands in Gold(I)-Catalyzed Asymmetric Intermolecular (4 + 2) Cycloadditions of Allenamides and Dienes Journal of the American Chemical Society 134 (2012) 14322-14325
Space group: C 2 2 2
Cell volume: 8024
Cell parameters: 24.428; 27.216; 12.0685; 90; 90; 90;  

COD ID: 4119068
CIF file Formula: - Ag2 Cs2 Te4 Zr -
Comments: Ibers, J.A.; Pell, M.A. Cs2 Ag2 Zr Te4 : a new layered telluride containing tetrahedrally coordinated zirconium Journal of the American Chemical Society 117 (1995) 6284-6286
Space group: C 2 2 2
Cell volume: 643.244
Cell parameters: 6.508; 15.164; 6.518; 90; 90; 90;  

COD ID: 4130050
CIF file Formula: - C65 H38 Cu4 N12 O20 -
Comments: Li, Pei-Zhou; Wang, Xiao-Jun; Liu, Jia; Lim, Jie Sheng; Zou, Ruqiang; Zhao, Yanli A Triazole-Containing Metal-Organic Framework as a Highly Effective and Substrate Size-Dependent Catalyst for CO2 Conversion. Journal of the American Chemical Society 138(7) (2016) 2142-2145
Space group: C 2 2 2
Cell volume: 13601.5
Cell parameters: 46.0575; 20.9442; 14.1001; 90; 90; 90;  

COD ID: 4305011
CIF file Formula: - C23 H27 N2 Ni O4 -
Comments: Jian Zhang; Emily Chew; Shumei Chen; Jimmy T. H. Pham; Xianhui Bu Three-Dimensional Homochiral Transition-Metal Camphorate Architectures Directed by a Flexible Auxiliary Ligand Inorganic Chemistry 47 (2008) 3495-3497
Space group: C 2 2 2
Cell volume: 2282.09
Cell parameters: 11.1411; 21.1153; 9.7008; 90; 90; 90;  

COD ID: 4315633
CIF file Formula: - C14 H28 Br2 Cr N O P4 -
Comments: Hemamala I. Karunadasa; Kristine D. Arquero; Louise A. Berben; Jeffrey R. Long Enhancing the Magnetic Anisotropy of Cyano-Ligated Chromium(II) and Chromium(III) Complexes via Heavy Halide Ligand Effects Inorganic Chemistry 49 (2010) 4738-4740
Space group: C 2 2 2
Cell volume: 1308.4
Cell parameters: 9.159; 13.4; 10.661; 90; 90; 90;  

COD ID: 4315637
CIF file Formula: - C15 H12 Cr I2 N O2 P4 -
Comments: Hemamala I. Karunadasa; Kristine D. Arquero; Louise A. Berben; Jeffrey R. Long Enhancing the Magnetic Anisotropy of Cyano-Ligated Chromium(II) and Chromium(III) Complexes via Heavy Halide Ligand Effects Inorganic Chemistry 49 (2010) 4738-4740
Space group: C 2 2 2
Cell volume: 1376.6
Cell parameters: 9.295; 13.662; 10.84; 90; 90; 90;  

COD ID: 4315654
CIF file Formula: - B H4 Rb -
Comments: Yaroslav Filinchuk; Alexandr V. Talyzin; Hans Hagemann; Vladimir Dmitriev; Dmitry Chernyshov; Bertil Sundqvist Cation Size and Anion Anisotropy in Structural Chemistry of Metal Borohydrides. The Peculiar Pressure Evolution of RbBH4 Inorganic Chemistry 49 (2010) 5285-5292
Space group: C 2 2 2
Cell volume: 107.76
Cell parameters: 5.3679; 5.1343; 3.9098; 90; 90; 90;  

COD ID: 4328415
CIF file Formula: - C30 H6 Cu2 O11 -
Comments: David J. Mihalcik; Teng Zhang; Liqing Ma; Wenbin Lin Highly Porous 4,8-Connected Metal-Organic Frameworks: Synthesis, Characterization, and Hydrogen Uptake Inorganic Chemistry 51 (2012) 2503-2508
Space group: C 2 2 2
Cell volume: 15140
Cell parameters: 24.495; 27.929; 22.13; 90; 90; 90;  

COD ID: 4344305
CIF file Formula: - Ho Sb2 -
Comments: Johnson, Q. The Crystal Structure of High-Pressure Synthesized Holmium Diantimonide Inorganic Chemistry 10 (1971) 2089-2090
Space group: C 2 2 2
Cell volume: 151.751
Cell parameters: 3.343; 5.79; 7.84; 90; 90; 90;  

COD ID: 4517887
CIF file Formula: - C20 H26 N4 O6 -
Comments: Ji, Wei; Xue, Bin; Bera, Santu; Guerin, Sarah; Liu, Yanqing; Yuan, Hui; Li, Qi; Yuan, Chengqian; Shimon, Linda J. W.; Ma, Qing; Kiely, Evan; Tofail, Syed A. M.; Si, Mingsu; Yan, Xuehai; Cao, Yi; Wang, Wei; Yang, Rusen; Thompson, Damien; Li, Junbai; Gazit, Ehud Tunable Mechanical and Optoelectronic Properties of Organic Cocrystals by Unexpected Stacking Transformation from H- to J- and X-Aggregation ACS Nano (2020)
Space group: C 2 2 2
Cell volume: 2074.8
Cell parameters: 12.216; 14.294; 11.882; 90; 90; 90;  

COD ID: 6000693
CIF file Formula: - Ca O4 S -
Comments: Bezou, C.; Nonat, A.; Mutin, J. C.; Christensen, A. N.; Lehmann, M. S. Investigation of the crystal-structure of gamma-CaSO4, CaSO4.0.5 H2O, and CaSO4.0.6 H2O by powder diffraction methods Journal of Solid State Chemistry 117 (1995) 165-176
Space group: C 2 2 2
Cell volume: 530.86
Cell parameters: 12.0777; 6.9723; 6.304; 90; 90; 90;  

COD ID: 7108965
CIF file Formula: - C40 H72 Cl Ho2 N8 Na3 O32 -
Comments: Katherine M. Payne; Edward J. Valente; Silvio Aime; Mauro Botta; Mark Woods Picture of a chelate in exchange: the crystal structure of NaHoDOTMA, a 'semi'-hydrated chelate Chem.Commun. 49 (2013) 2320
Space group: C 2 2 2
Cell volume: 6568.7
Cell parameters: 18.5845; 18.6061; 18.9964; 90; 90; 90;  

COD ID: 7109661
CIF file Formula: - C64.4 H75 B2 F8 N5 Ni O5.6 P4 -
Comments: Wesley A. Hoffert; John A. S. Roberts; R. Morris Bullock; Monte L. Helm Production of H2 at fast rates using a nickel electrocatalyst in water-acetonitrile solutions Chem.Commun. 49 (2013) 7767
Space group: C 2 2 2
Cell volume: 7090.2
Cell parameters: 15.1339; 23.3855; 20.0338; 90; 90; 90;  

COD ID: 7118391
CIF file Formula: - O64 Si32 -
Comments: Plevert, J.; Kubota, Y.; Honda, T.; Okubo, T.; Sugi, Y. GUS-1: a mordenite-like molecular sieve with the 12-ring channel of ZSM-12 Chemical Communications 2000 (2000) 2363-2364
Space group: C 2 2 2
Cell volume: 1661.77
Cell parameters: 16.42059; 20.05399; 5.0464; 90; 90; 90;  

COD ID: 7201964
CIF file Formula: - C40 H32 Ag4 Cl2 N10 O6 -
Comments: Zhang, Lei; Li, Zhao-Ji; Qin, Ye-Yan; Zhang, Jian; Cheng, Jian-Kai; Yin, Pei-Xiu; Yao, Yuan-Gen Homochiral moganite-type metal‒organic framework based on unusual (Ag2Cl)n skeletons CrystEngComm 10(6) (2008) 655
Space group: C 2 2 2
Cell volume: 1215.3
Cell parameters: 15.0535; 21.8564; 3.6939; 90; 90; 90;  

COD ID: 7202078
CIF file Formula: - C20 H16 Cl Cu2 N5 O3 -
Comments: Hao, Hong-Qing; Wang, Jing; Liu, Wen-Ting; Tong, Ming-Liang Two 3D hybrid networks of mog and bcu topology constructed with copper(I/I,II) halides and N,N′-spacers CrystEngComm 10(10) (2008) 1454
Space group: C 2 2 2
Cell volume: 1135.1
Cell parameters: 15.083; 20.531; 3.6656; 90; 90; 90;  

COD ID: 7210186
CIF file Formula: - C22 H20 Cl I4 S12 -
Comments: Lieffrig, Julien; Pennec, Ronan Le; Jeannin, Olivier; Auban-Senzier, Pascale; Fourmigué, Marc Toward chiral conductors: combining halogen bonding ability and chirality within a single tetrathiafulvalene molecule CrystEngComm 15(22) (2013) 4408
Space group: C 2 2 2
Cell volume: 3711
Cell parameters: 9.6986; 26.2429; 14.5803; 90; 90; 90;  

COD ID: 7210187
CIF file Formula: - C22 H20 Br I4 S12 -
Comments: Lieffrig, Julien; Pennec, Ronan Le; Jeannin, Olivier; Auban-Senzier, Pascale; Fourmigué, Marc Toward chiral conductors: combining halogen bonding ability and chirality within a single tetrathiafulvalene molecule CrystEngComm 15(22) (2013) 4408
Space group: C 2 2 2
Cell volume: 3773.6
Cell parameters: 9.6691; 26.5929; 14.676; 90; 90; 90;  

COD ID: 7220408
CIF file Formula: - C36 H68 Ag Cr2 F18 N8 O16 P3 -
Comments: Wang, Ai; Merkens, Carina; Englert, Ulli Interplay of ligand chirality and metal configuration in mononuclear complexes and in a coordination polymer of Cr(iii) CrystEngComm 17(23) (2015) 4293
Space group: C 2 2 2
Cell volume: 3149.5
Cell parameters: 10.078; 42.812; 7.2997; 90; 90; 90;  

COD ID: 8100957
CIF file Formula: - C20 H34 O2 -
Comments: Loyola, Luis Alberto; Bórquez, Jorge; Galdámez, Antonio; Manríquez, Víctor; San-Martín, Aurelio Crystal structure of 7-deacetylazorellanol, C~20~H~34~O~2~ , a deterpenoid from Azorella Compacta Zeitschrift für Kristallographie - New Crystal Structures 216(2) (2001) 291-292
Space group: C 2 2 2
Cell volume: 3796.2
Cell parameters: 15.885; 17.168; 13.92; 90; 90; 90;  

COD ID: 9004845
CIF file Formula: - Ca0.25 H7.8 Na2.52 Nb0.2 O18.49 Si6 Ti0.925 -
Comments: McDonald, A. M.; Chao, G. Y. Haineaultite, a new hydrated sodium calcium titanosilicate from Mont Saint-Hilaire, Quebec: Description, structure determination and genetic implications Locality: Mont Saint-Hilaire, Quebec, Canada The Canadian Mineralogist 42 (2004) 769-780
Space group: C 2 2 2
Cell volume: 1159.82
Cell parameters: 7.204; 23.155; 6.953; 90; 90; 90;  

COD ID: 9007722
CIF file Formula: - Fe0.561 Ni17.439 S16 -
Comments: Fleet, M. E. Structure of godlevskite, Ni9S8 Acta Crystallographica, Section C 43 (1987) 2255-2257
Space group: C 2 2 2
Cell volume: 987.649
Cell parameters: 9.3359; 11.2185; 9.43; 90; 90; 90;  

COD ID: 9008054
CIF file Formula: - Cd Cl2 N2 -
Comments: MacGillavry, C. H.; Bijvoet, J. M. Die kristallstruktur der cadmium-und quecksilber-diammin-dihalogenide Locality: synthetic Zeitschrift fur Kristallographie 94 (1936) 231-245
Space group: C 2 2 2
Cell volume: 270.158
Cell parameters: 8.196; 8.307; 3.968; 90; 90; 90;  

COD ID: 9008059
CIF file Formula: - Br2 Cd N2 -
Comments: MacGillavry, C. H.; Bijvoet, J. M. Die kristallstruktur der cadmium-und quecksilber-diammin-dihalogenide Locality: synthetic Zeitschrift fur Kristallographie 94 (1936) 231-245
Space group: C 2 2 2
Cell volume: 301.913
Cell parameters: 8.55; 8.55; 4.13; 90; 90; 90;  

COD ID: 9012207
CIF file Formula: - Ca O4 S -
Comments: Bezou, C.; Nonat, A.; Mutin, J. C.; Christensen, A. N.; Lehmann, M. S. Of the crystal structure of gamma-CaSO4, CaSO4*0.5(H2O), and CaSO4*0.6(H2O) by powder diffraction methods Journal of Solid State Chemistry 117 (1995) 165-176
Space group: C 2 2 2
Cell volume: 530.856
Cell parameters: 12.0777; 6.9723; 6.304; 90; 90; 90;  

COD ID: 9016335
CIF file Formula: - Al0.6 K1.26 Na2.22 Nb1.29 O31 Ta9.11 -
Comments: Atencio, D.; Contreira, R. R.; Mills, S. J.; Coutinho, J. M. V.; Honorato, S. B.; Ayala, A. P.; Ellena, J.; De Andrade, M. B. Rankamaite from the Urubu pegmatite, Itinga, Minas Gerais, Brazil: Crystal chemistry and Rietveld refinement Note: Identification of OH not reported American Mineralogist 96 (2011) 1455-1460
Space group: C 2 2 2
Cell volume: 1199.1
Cell parameters: 17.224; 17.687; 3.9361; 90; 90; 90;  


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