Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9011353 | CIF | B2 Ca2 Fe0.9 H0.14 Mn0.03 O10 Si2 | P 1 21/a 1 | 9.786; 7.621; 4.776 90; 90.61; 90 | 356.17 | Miyawaki, R.; Nakai, I.; Nagashima, K. Structure of homilite, Ca2.00(Fe0.90Mn0.03)B2.00Si2.00O9.86(OH)0.14 Note: anisoB's form ICSD Acta Crystallographica, Section C, 1985, 41, 13-15 |
| 9011354 | CIF | C2 H10 Cu2 O20 U3 | P -1 | 7.767; 6.924; 7.85 92.16; 90.89; 93.48 | 421.018 | Ginderow, D.; Cesbron, F. Structure de la roubaultite, Cu2(UO2)3(CO3)2O2(OH)2(H2O)4 Note: anisoB's from ICSD Acta Crystallographica, Section C, 1985, 41, 654-657 |
| 9011355 | CIF | Al2.97 Ca0.8 Mg0.36 Na3.12 O15.12 S Si3.03 | P -4 3 n | 9.105; 9.105; 9.105 90; 90; 90 | 754.814 | Hassan, I.; Peterson, R. C.; Grundy, H. D. The structure of lazurite, ideally Na6Ca2(Al6Si6O24)S2, a member of the sodalite group Acta Crystallographica, Section C, 1985, 41, 827-832 |
| 9011356 | CIF | Al2.91 Ca0.6 Na3.48 O11.52 S Si3.09 | P -4 3 n | 9.054; 9.054; 9.054 90; 90; 90 | 742.201 | Hassan, I.; Peterson, R. C.; Grundy, H. D. The structure of lazurite, ideally Na6Ca2(Al6Si6O24)S2, a member of the sodalite group Acta Crystallographica, Section C, 1985, 41, 827-832 |
| 9011357 | CIF | Pb Te | F m -3 m | 6.4384; 6.4384; 6.4384 90; 90; 90 | 266.891 | Noda, Y.; Masumoto, K.; Ohba, S.; Saito, Y.; Toriumi, K.; Iwata, Y.; Shibuya, I. Temperature dependence of atomic thermal parameters of lead chalcogenides, PbS, PbSe and PbTe Locality: synthetic Sample: T = 120 K Acta Crystallographica, Section C, 1987, 43, 1443-1445 |
| 9011358 | CIF | Pb Te | F m -3 m | 6.4541; 6.4541; 6.4541 90; 90; 90 | 268.848 | Noda, Y.; Masumoto, K.; Ohba, S.; Saito, Y.; Toriumi, K.; Iwata, Y.; Shibuya, I. Temperature dependence of atomic thermal parameters of lead chalcogenides, PbS, PbSe and PbTe Locality: synthetic Sample: T = 298 K Acta Crystallographica, Section C, 1987, 43, 1443-1445 |
| 9011359 | CIF | Pb Se | F m -3 m | 6.1054; 6.1054; 6.1054 90; 90; 90 | 227.584 | Noda, Y.; Masumoto, K.; Ohba, S.; Saito, Y.; Toriumi, K.; Iwata, Y.; Shibuya, I. Temperature dependence of atomic thermal parameters of lead chalcogenides, PbS, PbSe and PbTe Locality: synthetic Sample: T = 120 K Acta Crystallographica, Section C, 1987, 43, 1443-1445 |
| 9011360 | CIF | Pb Se | F m -3 m | 6.1213; 6.1213; 6.1213 90; 90; 90 | 229.367 | Noda, Y.; Masumoto, K.; Ohba, S.; Saito, Y.; Toriumi, K.; Iwata, Y.; Shibuya, I. Temperature dependence of atomic thermal parameters of lead chalcogenides, PbS, PbSe and PbTe Locality: synthetic Sample: T = 298 K Acta Crystallographica, Section C, 1987, 43, 1443-1445 |
| 9011361 | CIF | Cu Fe2 H2 O10 P2 | P 1 21/n 1 | 6.984; 7.786; 7.266 90; 117.68; 90 | 349.889 | Sieber, N. H. W.; Tillmanns, E.; Hofmeister, W. Structure of hentschelite, CuFe2(PO4)2(OH)2, a new member of the lazulite group Locality: silicified barite vein, Reichenbach, Odenwald, Germany Acta Crystallographica, Section C, 1987, 43, 1855-1857 |
| 9011362 | CIF | S8 | F d d d :2 | 10.4646; 12.866; 24.486 90; 90; 90 | 3296.74 | Rettig, S. J.; Trotter, J. Refinement of the structure of orthorhombic sulfur, alpha-S8 Locality: synthetic Sample: at T = 298 K Note: alpha phase Acta Crystallographica, Section C, 1987, 43, 2260-2262 |
| 9011363 | CIF | S8 | F d d d :2 | 10.4646; 12.866; 24.486 90; 90; 90 | 3296.74 | Rettig, S. J.; Trotter, J. Refinement of the structure of orthorhombic sulfur, alpha-S8 Locality: synthetic Sample: at T = 298 K Note: alpha phase Note: coordinate positions of atoms correspond to high-angle refinements Acta Crystallographica, Section C, 1987, 43, 2260-2262 |
| 9011364 | CIF | Ca H12 O17 Si2 U2 | P 1 21 1 | 15.909; 7.002; 6.665 90; 97.27; 90 | 736.478 | Ginderow, D. Structure de l'uranophane alpha, Ca(UO2)2(SiO3OH)2*5H2O Acta Crystallographica, Section C, 1988, 44, 421-424 |
| 9011365 | CIF | Co H12 O10 S | C 1 2/c 1 | 10.022; 7.217; 24.224 90; 98.42; 90 | 1733.21 | Elerman, Y. Refinement of the crystal structure of CoSO4*6H2O Acta Crystallographica, Section C, 1988, 44, 599-601 |
| 9011366 | CIF | H12 Ni O10 S | P 41 21 2 | 6.78; 6.78; 18.285 90; 90; 90 | 840.532 | Angel, R. J.; Finger, L. W. Polymorphism of nickel sulfate hexahydrate Acta Crystallographica, Section C, 1988, 44, 1869-1873 |
| 9011367 | CIF | H12 Ni O10 S | C 1 2/c 1 | 9.88; 7.228; 24.13 90; 98.38; 90 | 1704.79 | Angel, R. J.; Finger, L. W. Polymorphism of nickel sulfate hexahydrate Acta Crystallographica, Section C, 1988, 44, 1869-1873 |
| 9011368 | CIF | C5 Ca1.16 Ce1.2 Na3.4 O15 Sr0.24 | P 1 1 21 | 10.412; 10.414; 6.291 90; 90; 119.8 | 591.935 | Ginderow, D. Structure de Na3M3(CO3)5 (M = Terre Rare, Ca Na Sr), rattache a la burbankite Acta Crystallographica, Section C, 1989, 45, 185-187 |
| 9011369 | CIF | Fe H20 N2 O14 S2 | P 1 21/a 1 | 9.167; 12.405; 6.305 90; 106.71; 90 | 686.707 | Figgis, B. N.; Kucharski, E. S.; Reynolds, P. A.; Tasset, F. The structure of (ND4)2Fe(SO4)2*6D2O at 4.3 K by neutron diffraction Acta Crystallographica, Section C, 1989, 45, 942-944 |
| 9011370 | CIF | C5 Ca1.15 Ce1.22 Na3.4 O15 Sr0.24 | C m c 21 | 10.444; 18.01799; 6.291 90; 90; 90 | 1183.84 | Marsh, R. E. Structure of Na3M3(CO3)5. Corrigendum Acta Crystallographica, Section C, 1989, 45, 1840-1840 |
| 9011372 | CIF | Fe S4 Sb2 | P n a m | 11.401; 14.148; 3.758 90; 90; 90 | 606.17 | Lemoine, P.; Carre, D.; Robert, F. Structure du sulfure de fer et d'antimoine, FeSb2S4 (Berthierite) Acta Crystallographica, Section C, 1991, 47, 938-940 |
| 9011373 | CIF | As Ca2 O12 W2 Y | I 41/a :2 | 5.135; 5.135; 33.882 90; 90; 90 | 893.408 | Demartin, F.; Gramaccioli, C. M.; Pilati, T. Structure of a new natural tungstate arsenate, [Ca2Y(AsO4)(WO4)2], structurally related to scheelite Locality: Alpine fissures, Pizzo Cervandone area, Ossola Valley, Italy Note: anisoU's from ICSD Acta Crystallographica, Section C, 1992, 48, 1357-1359 |
| 9011374 | CIF | Al4.44 Ca5.76 Cl2.76 Fe0.48 Mg0.24 O16 Si2.08 | I -4 3 d | 12.001; 12.001; 12.001 90; 90; 90 | 1728.43 | Tsukimura, K.; Kanazawa, Y.; Aoki, M.; Bunno, M. Structure of wadalite Ca6Al5Si2O16Cl3 Note: the values for the anisoU's are from ICSD Acta Crystallographica, Section C, 1993, 49, 205-207 |
| 9011377 | CIF | B5 Ca2 Cl H2 O10 | P 1 | 6.452; 6.559; 6.286 61.6; 118.72; 105.86 | 204.867 | Burns, P. C.; Hawthorne, F. C. Refinement of the structure of hilgardite-1A Locality: Penobsquis potash deposit, Sussex, New Brunswick Acta Crystallographica, Section C, 1994, 50, 653-655 |
| 9011378 | CIF | Ca2 H2 O5 Si | P b c a | 9.487; 9.179; 10.666 90; 90; 90 | 928.808 | Marsh, R. E. A revised structure for alpha-dicalcium silicate hydrate Acta Crystallographica, Section C, 1994, 50, 996-997 |
| 9011379 | CIF | Cl5 Fe H2 K2 O | P n m a | 13.452; 9.631; 7.003 90; 90; 90 | 907.282 | Schultz, A. J.; Carlin, R. L. Single-crystal pulsed neutron diffraction structure of the antiferromagnet K2[FeCl5(H2O)] with and without applied pressure Sample: P = .1 MPa Sample: T = 15 K Acta Crystallographica, Section B, 1995, 51, 43-47 |
| 9011380 | CIF | Cl5 Fe H2 K2 O | P n m a | 13.391; 9.648; 6.942 90; 90; 90 | 896.881 | Schultz, A. J.; Carlin, R. L. Single-crystal pulsed neutron diffraction structure of the antiferromagnet K2[FeCl5(H2O)] with and without applied pressure Sample: P = .14 GPa Sample: T = 15 K Acta Crystallographica, Section B, 1995, 51, 43-47 |
| 9011381 | CIF | Ga Li O6 Si2 | P 1 21/c 1 | 9.5394; 8.5756; 5.2508 90; 110.124; 90 | 403.324 | Sato, A.; Osawa, T.; Ohashi, H. Low-temperature form of LiGaSi2O6 Sample: T = 273 K Note: anisoU's from ICSD Acta Crystallographica, Section C, 1995, 51, 1959-1960 |
| 9011384 | CIF | H2 O4 Sn3 | P -4 21 c | 7.9268; 7.9268; 9.1025 90; 90; 90 | 571.948 | Abrahams, I.; Grimes, S. M.; Johnston, S. R.; Knowles, J. C. Tin(II) oxyhydroxide by X-ray powder diffraction Locality: synthetic Acta Crystallographica, Section C, 1996, 52, 286-288 |
| 9011386 | CIF | Ca4.5 F0.77 Nd0.5 O12.14 P2.55 Si0.45 | P 63/m | 9.3938; 9.3938; 6.9013 90; 90; 120 | 527.405 | Boyer, L.; Savariault, J. M.; Carpena, J.; Lacout, J. L. A neodymium-substituted britholite compound Acta Crystallographica, Section C, 1998, 54, 1057-1059 |
| 9011388 | CIF | C H O4 Pb1.5 | R -3 m :H | 5.2465; 5.2465; 23.702 90; 90; 120 | 565.008 | Martinetto, P.; Anne, M.; Dooryhee, E.; Walter, P.; Tsoucaris, G. Synthetic hydrocerussite, 2PbCO3*Pb(OH)2 by X-ray powder diffraction Acta Crystallographica, Section C, 2002, 58, i82-i84 |
| 9011389 | CIF | H40 Mg2 Na2 O48 V10 | C 1 2/c 1 | 23.8384; 11.0248; 16.9332 90; 118.005; 90 | 3929.18 | Iida, A.; Ozeki, T. Mg2Na2V10O28*20H2O and Mg3V10O28*28H2O Acta Crystallographica, Section C, 2004, 60, i43-i46 |
| 9011390 | CIF | H54.684 Mg3 O56 V10 | P -1 | 10.4834; 10.7309; 21.2293 90.751; 97.866; 103.663 | 2296.24 | Iida, A.; Ozeki, T. Mg2Na2V10O28*20H2O and Mg3V10O28*28H2O Acta Crystallographica, Section C, 2004, 60, i43-i46 |
| 9011391 | CIF | Ca8.424 Na1.16 O28 P7 V | R 3 c :H | 10.3273; 10.3273; 37.098 90; 90; 120 | 3426.53 | Tsirlin, A. A.; Dikarev, E. V.; Shpanchenko, R. V.; Antipov, E. V. A new whitlockite, Ca8.42Na1.16V(PO4)7 Acta Crystallographica, Section C, 2006, 62, i13-i15 |
| 9011392 | CIF | Co1.36 Cu Ni0.64 Se4 | F d -3 m :2 | 9.9885; 9.9885; 9.9885 90; 90; 90 | 996.554 | Yang, H.; Hubler, D. K.; Lavina, B.; Downs, R. T.; Costin, G. Tyrrellite, Cu(Co0.68Ni0.32)2Se4, isostructural with spinel Acta Crystallographica, Section C, 2007, 63, i73-i74 |
| 9011393 | CIF | Ca F0.8 H0.2 Mg O4.2 P | C 1 2/c 1 | 6.5109; 8.7301; 6.9046 90; 112.246; 90 | 363.251 | Yang, H.; Zwick, J.; Downs, R. T.; Costin, G. Isokite, CaMg(PO4)F0.8(OH)0.2, isomorphous with titanite Acta Crystallographica, Section C, 2007, 63, i89-i90 |
| 9011394 | CIF | Al0.01 Fe0.02 H4 O6 P Sc0.94 V0.03 | P 1 21/n 1 | 5.4258; 10.2027; 8.9074 90; 90.502; 90 | 493.075 | Yang, H.; Li, C.; Jenkins, R. A.; Downs, R. T.; Costin, G. Kolbeckite, ScPO4*2H2O, isomorphous with metavariscite Acta Crystallographica, Section C, 2007, 63, i91-i92 |
| 9011395 | CIF | As Ca Co0.95 Cu0.05 H O5 | P 21 21 21 | 7.4919; 8.9946; 5.9158 90; 90; 90 | 398.646 | Yang, H.; Costin, G.; Keogh, J.; Lu, R.; Downs, R. T. Cobaltaustinite, CaCo(AsO4)(OH) Acta Crystallographica, Section E, 2007, 63, i53-i55 |
| 9011397 | CIF | Fe2.75 Na O10 Si3 | P -1 | 10.3355; 10.7847; 8.9142 105.048; 96.461; 125.302 | 738.372 | Burt, J. B.; Downs, R. T.; Costin, G. Single-crystal X-ray refinement of wilkinsonite, Na2Fe2+4Fe3+2Si6O20. Acta Crystallographica, Section E, 2007, 63, i122-i124 |
| 9011399 | CIF | As0.916 Cu2 H O5 P0.084 | P 21/n 1 1 | 8.5844; 8.2084; 5.9258 90.13; 90; 90 | 417.556 | Li, C.; Yang, H.; Downs, R. T. Redetermination of olivenite from an untwinned single-crystal Note: RRUFF ID: R040181 Acta Crystallographica, Section E, 2008, 64, i60-i61 |
| 9011400 | CIF | As2 Co0.61 Fe0.17 Ni0.22 | P n n m | 5.0669; 5.8739; 3.1346 90; 90; 90 | 93.293 | Yang, H.; Downs, R. T.; Eichler, C. Safflorite, (Co,Ni,Fe)As2, isomorphous with marcasite Acta Crystallographica, Section E, 2008, 64, i62-i62 |
| 9011401 | CIF | As3 Ba5 Cl O12 | P 63/m | 10.557; 10.557; 7.73912 90; 90; 120 | 746.97 | Bell, A. M. T.; Henderson, C. M. B.; Wendlandt, R. F.; Harrison, W. J. Rietveld refinement of Ba5(AsO4)3Cl from high-resolution synchrotron data Acta Crystallographica, Section E, 2008, 64, i63-i64 |
| 9011403 | CIF | Fe2 P | P 3 2 1 | 5.852; 5.852; 3.453 90; 90; 120 | 102.408 | Hendricks, S. B.; Kosting, P. R. The crystal structure of Fe2P, Fe2N, Fe3N and FeB Zeitschrift fur Kristallographie, 1930, 74, 511-533 |
| 9011406 | CIF | Ce0.5 F La0.5 O2 | P -6 2 c | 7.094; 7.094; 9.718 90; 90; 120 | 423.536 | Oftedal, I. Zur kristallstruktur von bastnasit (Ce,La–)FCO3 Note: positions of C and at least one O undetermined Zeitschrift fur Kristallographie, 1931, 78, 462-469 |
| 9011407 | CIF | Ca H Na O7 Sb2 | F d -3 m :1 | 10.272; 10.272; 10.272 90; 90; 90 | 1083.84 | Zedlitz, O. Die kristallstruktur von romeit und schneebergit Zeitschrift fur Kristallographie, 1932, 81, 253-263 |
| 9011409 | CIF | Mn O2 | B 1 21/d 1 | 8.86; 5.24; 5.7 90; 90; 90 | 264.63 | Buerger, M. J. The symmetry and crystal structure of manganite, Mn(OH)O Locality: Ilfeld, Germany Zeitschrift fur Kristallographie, 1936, 95, 163-174 |
| 9011412 | CIF | Fe O2 | P b n m | 4.59; 10; 3.03 90; 90; 90 | 139.077 | Hoppe, W. Uber die kristallstruktur von alpha-AlOOH (diaspore) und alpha-Fe OOH(nadeleisenerz) Locality: Synthetic Zeitschrift fur Kristallographie, 1940, 103, 73-89 |
| 9011413 | CIF | Al O2 | P b n m | 4.42; 9.44; 2.84 90; 90; 90 | 118.498 | Hoppe, W. Uber die kristallstruktur von alpha-AlOOH (diaspore). II. Fourieranalyse Zeitschrift fur Kristallographie, 1942, 104, 11-17 |
| 9011414 | CIF | Ag2 S | P 1 21/n 1 | 4.23; 6.91; 7.87 90; 99.58; 90 | 226.827 | Frueh, A. J. The crystallography of silver sulfide, Ag2S Zeitschrift fur Kristallographie, 1958, 110, 136-144 |
| 9011415 | CIF | C7 H4 O | P 1 21/a 1 | 15.81; 3.942; 7.865 90; 102.72; 90 | 478.141 | Murty, B. V. R. Refinement of the structure of anthraquinone Zeitschrift fur Kristallographie, 1960, 113, 445-465 |
| 9011416 | CIF | S3 Sb2 | P b n m | 11.25; 11.33; 3.83 90; 90; 90 | 488.181 | Scavnicar, S. The crystal structure of stibnite. A redetermination of atomic positions Zeitschrift fur Kristallographie, 1960, 114, 85-97 |
| 9011417 | CIF | H2 Mn O6 Si Zn2 | P 1 21/a 1 | 8.17; 5.316; 11.761 90; 95.25; 90 | 508.658 | Rentzeperis, P. J. The crystal structure of hodgkinsonite Zn2Mn[(OH)2|SiO4] Note: y(H2) corrected Zeitschrift fur Kristallographie, 1963, 119, 117-138 |
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