Crystallography Open Database
Search results
Result: there are 3633 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching space group like 'C 1 2 1'
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
|---|---|---|---|---|---|---|
| 9006295 | CIF | O2 Si | C 1 2 1 | 6.8513; 7.3761; 6.7085 90; 101.918; 90 | 331.712 | Boisen, M. B.; Gibbs, G. V.; Bukowinski, M. S. T. Framework silica structures generated using simulated annealing with a potential energy function based on an H6Si2O7 molecule Sample: 12 Physics and Chemistry of Minerals, 1994, 21, 269-284 |
| 9006296 | CIF | O2 Si | C 1 2 1 | 6.6211; 7.9963; 5.4115 90; 100.228; 90 | 281.955 | Boisen, M. B.; Gibbs, G. V.; Bukowinski, M. S. T. Framework silica structures generated using simulated annealing with a potential energy function based on an H6Si2O7 molecule Sample: 13 Physics and Chemistry of Minerals, 1994, 21, 269-284 |
| 9009432 | CIF | Ca H4 O17 Si6 Zr | C 1 2 1 | 14.04; 14.16; 7.81 90; 109.55; 90 | 1463.17 | Kashaev, A. A.; Sapozhnikov, A. N. Crystal structure of armstrongite Kristallografiya, 1978, 23, 956-961 |
| 9009508 | CIF | Ag S2 Sb | C 1 2 1 | 12.824; 4.406; 13.193 90; 98.567; 90 | 737.121 | Smith, J. V.; Pluth, J. J.; Han, S. Crystal structure refinement of miargyrite, AgSbS2 Mineralogical Magazine, 1997, 61, 671-675 |
| 9009816 | CIF | Br Hg3 I Te2 | C 1 2 1 | 18.376; 9.587; 10.575 90; 90.12; 90 | 1863 | Minets, Y. V.; Voroshilov, Y. V.; Pan'ko, V. V. The structures of mercury chalcogenhalogenides Hg3X2Hal2 Journal of Alloys and Compounds, 2004, 367, 109-114 |
| 9010294 | CIF | Al1.56 F1.88 Fe0.38 H0.12 K0.95 Li1.44 Mg0.01 Mn0.17 Na0.05 O10.12 Si3.44 | C 1 2 1 | 5.264; 9.086; 10.099 90; 100.719; 90 | 474.594 | Brigatti, M. F.; Mottana, A.; Malferrari, D.; Cibin, G. Crystal structure and chemical composition of Li-, Fe-, and Mn-rich micas Sample: Hirukawa American Mineralogist, 2007, 92, 1395-1400 |
| 9010295 | CIF | Al1.68 Ca0.01 F1.9 Fe0.36 H0.1 K0.94 Li1.32 Mg0.16 Mn0.16 Na0.04 O10.1 Si3.32 | C 1 2 1 | 5.297; 9.133; 10.168 90; 100.78; 90 | 483.222 | Brigatti, M. F.; Mottana, A.; Malferrari, D.; Cibin, G. Crystal structure and chemical composition of Li-, Fe-, and Mn-rich micas Sample: Mokrusha American Mineralogist, 2007, 92, 1395-1400 |
| 9010296 | CIF | Al1.79 F1.88 Fe0.46 H0.12 K0.92 Li1.06 Mg0.03 Mn0.52 Na0.05 O10.12 Rb0.02 Si3.12 Ti0.02 | C 1 2 1 | 5.2984; 9.1461; 10.0966 90; 100.818; 90 | 480.583 | Brigatti, M. F.; Mottana, A.; Malferrari, D.; Cibin, G. Crystal structure and chemical composition of Li-, Fe-, and Mn-rich micas Sample: Boise American Mineralogist, 2007, 92, 1395-1400 |
| 9010846 | CIF | Ba1.275 Ca0.8 F2.745 Fe3.91 H2 K0.65 Mn4.09 Na1.15 Nb0.285 O35.255 Si8 Sr0.05 Ti3.585 Zr0.05 | C 1 2 1 | 10.723; 13.826; 20.791 90; 95; 90 | 3070.67 | Rastsvetaeva, R. K.; Eskova, E. M.; Dusmatov, V. D.; Chukanov, N. V.; Schneider, F. Surkhobite: revalidation and redefinition with the new formula, (Ba,K)2CaNa(Mn,Fe2+,Fe3+)8Ti4(Si2O7)4O4(F,OH,O)6 European Journal of Mineralogy, 2008, 20, 289-295 |
| 9011826 | CIF | As10 Co4.5 Cu0.8 Ni4.7 O35 | C 1 2 1 | 33.256; 8.482; 14.191 90; 104.145; 90 | 3881.59 | Roberts, A. C.; Burns, P. C.; Gault, R. A.; Criddle, A. J.; Feinglos, M. N. Petewilliamsite, (Ni,Co)30(As2O7)15, a new mineral from Johanngeorgenstadt, Saxony, Germany: description and crystal structure Mineralogical Magazine, 2004, 68, 231-240 |
| 9011840 | CIF | H0.5 Na2.5 O18.5 Si6 Zr | C 1 2 1 | 10.48; 10.2; 7.33 90; 92.5; 90 | 782.802 | Ilyukhin, V. V.; Belov, N. V. Derivation of the structure of lovozerite from sections of the three-dimensional Patterson function Soviet Physics Crystallography, 1960, 5, 186-198 |
| 9011885 | CIF | H82 Na16 O81 Si16 | C 1 2 1 | 53.83; 9.972; 6.907 90; 96.78; 90 | 3681.7 | Rastsvetaeva, R. K.; Mikheeva, M. G.; Yamnova, N. A.; Pushcharovskii D Yu; Khomyakov, A. P. Crystal structure of revdite Na16[Si4O6(OH)5]2[Si8O15(OH)6](OH)10*28H2O Note: changed Si6(z) sign and OH11(y) value to match reported bond distances Soviet Physics Crystallography, 1992, 37, 632-636 |
| 9012100 | CIF | Al1.64 F1.46 Fe0.12 H0.54 K0.861 Li1.27 Mn0.5 Na0.072 O10.54 Rb0.067 Si3.34 | C 1 2 1 | 5.262; 9.102; 10.094 90; 100.83; 90 | 474.839 | Mizota, T.; Kato, T.; Harada, K. The crystal structure of masutomilite, Mn analogue of zinnwaldite Mineralogical Journal, 1986, 13, 13-21 |
| 9012283 | CIF | Ca7.676 Nd0.324 O28 Ta7.705 Zr0.295 | C 1 2 1 | 12.761; 7.358; 24.565 90; 100.17; 90 | 2270.3 | Grey, I. E.; Mumme, W. G.; Ness, T. J.; Roth, R. S.; Smith, K. L. Structural relations between weberite and zirconolite polytypes - refinements of doped 3T and 4M Ca2Ta2O7 and 3T CaZrTi2O7 Sample: T = 295 K, 4M weberite-type structure Journal of Solid State Chemistry, 2003, 174, 285-295 |
| 9012632 | CIF | Ba2.5 Ca F4 Fe6.1 H8 K1.2 Mn9.4 Na3 Nb0.32 O72 Si16 Ti7.68 Zr0.3 | C 1 2 1 | 10.731; 13.841; 20.845 90; 95.06; 90 | 3084 | Yamnova, N. A.; Egorov-Tismenko Y K; Pekov, I. V. Crystal structure of perraultite from the coastal region of the Sea of Azov Crystallography Reports, 1998, 43, 401-410 |
| 9012657 | CIF | Ba3.3 Ca2.4 F8 Fe8 H4 K0.7 Mn7.4 Na2.2 Nb0.8 O68 Si16 Ti6.4 Zr0.8 | C 1 2 1 | 10.723; 13.826; 20.791 90; 95; 90 | 3070.67 | Rozenberg, K. A.; Rastsvetaeva, R. K.; Verin, I. A. Crystal structure of surkhobite - new mineral from the family of titanosilicate micas Crystallography Reports, 2003, 48, 384-389 |
| 9013439 | CIF | Ca2.572 H4 Na0.856 O13.42 S3 | C 1 2 1 | 12.089; 6.903; 6.3537 90; 90.089; 90 | 530.218 | Freyer, D.; Reck, G.; Bremer, M.; Voigt, W. Thermal behaviour and crystal structure of sodium-containing hemihydrates of calcium sulfate Note: subcell Monatshefte fur Chemie, 1999, 130, 1179-1193 |
| 9013440 | CIF | Ca2.572 H4 Na0.858 O13.442 S3 | C 1 2 1 | 24.1781; 13.805; 12.7074 90; 90.089; 90 | 4241.45 | Freyer, D.; Reck, G.; Bremer, M.; Voigt, W. Thermal behaviour and crystal structure of sodium-containing hemihydrates of calcium sulfate Note: supercell Monatshefte fur Chemie, 1999, 130, 1179-1193 |
| 9013616 | CIF | Ag16 As3.596 Hg S15 Sb0.403 | C 1 2 1 | 26.0388; 15.0651; 15.5361 90; 90.48; 90 | 6094.24 | Bindi, L.; Keutsch, F. N.; Francis, C. A.; Menchetti, S. Fettelite, [Ag6As2S7][Ag10HgAs2S8] from Chanarcillo, Chile: Crystal structure, pseudosymmetry, twinning, and revised chemical formula American Mineralogist, 2009, 94, 609-615 |
| 9013732 | CIF | Al2 H2 K O12 Si4 | C 1 2 1 | 5.1973; 8.999; 10.147 90; 99; 90 | 468.737 | Drits, V. A.; Zviagina, B. B.; McCarty, D. K.; Salyn, A. L. Factors responsible for crystal-chemical variations in the solid solutions from illite to aluminoceladonite and from glauconite to celadonite Sample Name: 10564 American Mineralogist, 2010, 95, 348-361 |
| 9014003 | CIF | C H8 B Na O8 | C 1 2 1 | 16.119; 6.928; 6.73 90; 100.46; 90 | 739.066 | Wang, L.; Zhou, K.; Shi, J. Refinement of the qilianshanite structure Geological Review, 1994, 40, 347-353 |
| 9014222 | CIF | Co F6 Np O3 | C 1 2 1 | 12.119; 6.908; 7.928 90; 92.84; 90 | 662.902 | Abazli, H.; Cousson, A.; Jove, J.; Pages, M.; Gasperin, M. Les composes Co Np F6 (H2 O)3 et Co U F6 (H2 O)3. Etude structurale, mesur des susceptibilites magnetiques et resonance Moessbauer (237 Np) _cod_database_code 1001329 Journal of the Less-Common Metals, 1984, 96, 23-33 |
| 9014547 | CIF | Fe1.22 H2 K Mg0.78 O12 Si4 | C 1 2 1 | 5.223; 9.047; 10.197 90; 100.43; 90 | 473.872 | Tsipurskij, S. I.; Drits, V. A. Refining the crystallographic structure of celadonite Mineralogiceskij Zhurnal, 1986, 8, 32-40 |
| 9014752 | CIF HKL | C3 H10 Mg9 O48 Pb8 Si10 | C 1 2 1 | 16.232; 9.373; 14.06 90; 97.36; 90 | 2121.5 | Kolitsch, U.; Merlino, S.; Holtstam, D. Molybdophyllite: crystal chemistry, crystal structure, OD character and modular relationships with britvinite Mineralogical Magazine, 2012, 76, 493-516 |
| 9015499 | CIF | Ca0.91 H6 Na0.09 O18 Si6 Ti0.01 Y0.03 Zr0.96 | C 1 2 1 | 14.018; 14.133; 7.84 90; 109.4; 90 | 1465.04 | Kabalov, Y. K.; Zubkova, N. V.; Pushcharovsky, D. Y.; Schneider, J.; Sapozhnikov, A. N. Powder Rietveld refinement of armstrongite, CaZr[Si6O15]*3H2O Zeitschrift fur Kristallographie, 2000, 215, 757-761 |
| 9015730 | CIF | Ag16 As4 Fe0.526 Hg0.474 S15 | C 1 2 1 | 26.011; 15.048; 15.513 90; 90.4; 90 | 6071.85 | Bindi, L.; Downs, R. T.; Spry, P. G.; Pinch, W. W.; Menchetti, S. A chemical and structural re-examination of fettelite samples from the type locality, Odenwald, southwest Germany Sample: R100124 Mineralogical Magazine, 2012, 76, 551-566 |
| 9016372 | CIF | C2 H2 Al1.7 Ba2 Ca F0.66 O18 Si2.98 V1.323 | C 1 2 1 | 5.205; 9.033; 32.077 90; 93.49; 90 | 1505.36 | Liu, J.; Li, G.; Mao, Q.; Wu, S.; Liu, Z.; Su, S.; Xiong, M.; Yu, X. Hanjiangite, a new barium-vanadium phyllosilicate carbonate mineral, from the Shiti barium deposit in the Dabashan region, China Note: data is taken from the deposited cif, which unfortunately does not agree with the published tables. American Mineralogist, 2012, 97, 281-290 |
| 9016616 | CIF | Ag16 As4 Cu0.213 Hg0.786 S15 | C 1 2 1 | 26.03; 15.059; 15.524 90; 90.45; 90 | 6085 | Bindi, L.; Downs, R. T.; Spry, P. G.; Pinch, W. W.; Menchetti, S. A chemical and structural re-examination of fettelite samples from the type locality, Odenwald, southwest Germany Sample: R110042 Mineralogical Magazine, 2012, 76, 551-566 |
| 9017353 | CIF | Al0.05 Ca1.9 Fe0.07 H8 Mg0.04 Mn1.88 O17 Si4 Sr0.06 | C 1 2 1 | 9.036; 6.1683; 11.9601 90; 91.433; 90 | 666.409 | Fendrich, K. V.; Downs, R. T.; Origlieri, M. J. Redetermination of ruizite, Ca2Mn3+2[Si4O11(OH)](OH)2*2H2O Acta Crystallographica, Section E, 2016, 72, 959-963 |
| 9017407 | CIF | Ca3 H3.6 O13.8 S3 | C 1 2 1 | 11.9991; 6.9254; 6.3766 90; 90; 90 | 529.886 | Bezou, C.; Christensen, A. N.; Cox, D.; Lehmann, M.; Nonat, A. Structures cristallines de CaSO4,0,5H2O et CaSO4,0,6H2O Note: CaSO4*0.6H2O Comptes Rendus de l'Academie des Sciences Paris, 1991, 312, 43-48 |
| 9017414 | CIF | C Ca O3 | C 1 2 1 | 12.245; 7.197; 9.305 90; 115.16; 90 | 742.224 | Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R. The multiple structures of vaterite Crystal Growth & Design, 2013, 13, 2247-2251 |
| 9017513 | CIF | Al2 As3 Na3 O12 | C 1 2 1 | 14.576; 13.409; 9.728 90; 96.95; 90 | 1887.36 | Masquelier, C.; d'Yvoire F; Collin, G. Crystal structure of Na7Fe4(AsO4)6 and alpha-Na3Al2(AsO4)3, two sodium ion conductors structurally related to II-Na3Fe2(AsO4)3 Journal of Solid State Chemistry, 1995, 118, 33-42 |
| 9017878 | CIF | Ca0.41 Fe0.05 H8 Mn1.95 O17 Si4 Sr1.59 | C 1 2 1 | 9.1575; 6.2857; 12.0431 90; 91.744; 90 | 692.895 | Yang, H.; Gu, X.; Cairncross, B.; Downs, R. T.; Evans, S. H. Taniajacoite and strontioruizite, two new minerals isostructural with ruizite from the N'Chwaning III mine, Kalahari manganese field, South Africa The Canadian Mineralogist, 2021, 59, 431-444 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!

