Crystallography Open Database
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| 9007540 | CIF | Cr O2 | P 42/m n m | 4.421; 4.421; 2.917 90; 90; 90 | 57.013 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Cloud et al (1962) Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007541 | CIF | O2 Ru | P 42/m n m | 4.4919; 4.4919; 3.1066 90; 90; 90 | 62.682 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Boman (1970) Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007542 | CIF | O2 Os | P 42/m n m | 4.5003; 4.5003; 3.1839 90; 90; 90 | 64.483 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Boman (1970) Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007543 | CIF | O2 Pb | P 42/m n m | 4.9568; 4.9568; 3.3866 90; 90; 90 | 83.208 | Baur, W. H.; Khan, A. A. Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures Note: data from Leciejewicz and Padlo (1962) Acta Crystallographica, Section B, 1971, 27, 2133-2139 |
| 9007544 | CIF | As3 Co0.87 Fe0.11 Ni0.13 | I m -3 | 8.195; 8.195; 8.195 90; 90; 90 | 550.36 | Mandel, N.; Donohue, J. The refinement of the crystal structure of skutterudite, CoAs3 Acta Crystallographica, Section B, 1971, 27, 2288-2289 |
| 9009603 | CIF | As2 H4 O10 Zn3 | P -1 | 6.71; 8.989; 14.533 105.59; 93.44; 108.68 | 789.532 | Riffel, H.; Keller, P.; Hess, H. Die kristallstruktur von warikahnit, Zn3[(H2O)2|(AsO4)2] Tschermaks Mineralogische und Petrographische Mitteilungen, 1980, 27, 187-199 |
| 9009927 | CIF | Ca2 H4 Mg O10 P2 | P -1 | 5.7344; 6.78; 5.4413 97.29; 108.56; 107.28 | 185.681 | Brotherton, P. D.; Maslen, E. N.; Pryce, M. W.; White, A. H. Crystal structure of collinsite Australian Journal of Chemistry, 1974, 27, 653-656 |
| 9011110 | CIF | O9 Te3 U | P a -3 | 11.37; 11.37; 11.37 90; 90; 90 | 1469.88 | Galy, J.; Meunier, G. A propos de la cliffordite UTe3O8. Le Systeme UO3-TeO2 a 700 C. Structure cristalline de UTe3O9 Sample: T = 700 C Acta Crystallographica, Section B, 1971, 27, 608-616 |
| 9011111 | CIF | B2 Ca H12 O10 | C 1 2/c 1 | 16.07999; 6.69; 7.95 90; 104.9; 90 | 826.466 | Sedlacek, P.; Dornberger-Schiff K An OD-Disordered modification of the calcium monoborate dihydrate Ca[B(OH)4]2*2H2O Sample: MDO (1) Acta Crystallographica, Section B, 1971, 27, 1532-1541 |
| 9011112 | CIF | B2 Ca H12 O10 | P 1 2/c 1 | 8.04; 6.69; 7.95 90; 104.9; 90 | 413.233 | Sedlacek, P.; Dornberger-Schiff K An OD-Disordered modification of the calcium monoborate dihydrate Ca[B(OH)4]2*2H2O Sample: MDO (2) Acta Crystallographica, Section B, 1971, 27, 1532-1541 |
| 9011113 | CIF | Al Ca2 Fe O5 | I b m 2 | 5.584; 14.6; 5.374 90; 90; 90 | 438.123 | Colville, A. A.; Geller, S. The crystal structure of brownmillerite, Ca2FeAlO5 Note: no bond lengths could be reproduced Acta Crystallographica, Section B, 1971, 27, 2311-2315 |
| 9011114 | CIF | C5 H7 N5 O2 | P 1 21/n 1 | 16.51; 11.277; 3.645 90; 96.8; 90 | 673.864 | Thewalt, U.; Bugg, C. E.; Marsh, R. E. The crystal structure of guanine monohydrate Acta Crystallographica, Section B, 1971, 27, 2358-2362 |
| 9011704 | CIF | Sc | P 63/m m c | 3.3088; 3.3088; 5.268 90; 90; 120 | 49.948 | Saw, C. K.; Beaudry, B. J.; Stassis, C. Location of deuterium in alpha-scandium Physical Review B - Condensed Matter, 1983, 27, 7013-7017 |
| 9011903 | CIF | Al0.26 B4 Ca4 Ce2 Fe0.34 O24 Si4 Ti0.4 | P 1 2/a 1 | 18.946; 4.714; 10.302 90; 111.58; 90 | 855.593 | Chernitsova, N. M.; Pudovkina, Z. V.; Pyatenko, Y. A. About the crystal structure of tadzhikite {(Ca,Tr)4(Y,Tr)2(Ti,Fe,Al)(O,OH)2 [Si4B4O22]} Soviet Physics Doklady, 1982, 27, 367-368 |
| 9011955 | CIF | C Ca2 F2 O3 | P b c n | 7.65; 7.55; 6.548 90; 90; 90 | 378.196 | Leufer, U.; Tillmanns, E. Die kristallstruktur von brenkit, Ca2F2CO3 Tschermaks Mineralogische und Petrographische Mitteilungen, 1980, 27, 261-266 |
| 9012063 | CIF | Cu Fe Se2 | P -4 2 c | 5.53; 5.53; 11.049 90; 90; 90 | 337.888 | Delgado, J. M.; Diaz de Delgado, G.; Quintero, M.; Woolley, J. C. The crystal structure of copper iron selenide, CuFeSe2 Materials Research Bulletin, 1992, 27, 367-373 |
| 9012420 | CIF | Bi2 S Te2 | R -3 m :R | 10.31; 10.31; 10.31 24.17; 24.17; 24.17 | 161.469 | Lange, P. W. Ein Vergleich zwischen Bi2Te3 und Bi2Te2S Naturwissenschaften, 1939, 27, 133-134 |
| 9012447 | CIF | Li | I m -3 m | 3.5107; 3.5107; 3.5107 90; 90; 90 | 43.269 | Covington, E. J.; Montgomery, D. J. Sample: at T = 20 C Note: Li6 isotope Journal of Chemical Physics, 1957, 27, 1030-1032 |
| 9012448 | CIF | Li | I m -3 m | 3.5092; 3.5092; 3.5092 90; 90; 90 | 43.214 | Covington, E. J.; Montgomery, D. J. Sample: at T = 20 C Note: Li7 isotope Journal of Chemical Physics, 1957, 27, 1030-1032 |
| 9012516 | CIF | O2 Sb | P n a 21 | 5.434; 4.8091; 11.779 90; 90; 90 | 307.816 | Amador, J.; Gutierrez-Puebla E; Monge, M. A.; Rasines, I.; Ruiz-Valero C Diantimony tetraoxides revisited Note: displacement parameters from ICSD Inorganic Chemistry, 1988, 27, 1367-1370 |
| 9012517 | CIF | O2 Sb | C 1 2/c 1 | 12.057; 4.8352; 5.384 90; 104.56; 90 | 303.796 | Amador, J.; Gutierrez-Puebla E; Monge, M. A.; Rasines, I.; Ruiz-Valero C Diantimony tetraoxides revisited Note: displacement parameters from ICSD Inorganic Chemistry, 1988, 27, 1367-1370 |
| 9012548 | CIF | C H Nd O4 | P -6 | 12.32; 12.32; 9.88 90; 90; 120 | 1298.7 | Christensen, N. Hydrothermal preparation of rare earth hydroxycarbonates. The crystal structure of NdOHCO3 Acta Chemica Scandinavica, 1973, 27, 2973-2982 |
| 9012894 | CIF | Bi4 O12 Si3 | I -4 3 d | 10.2776; 10.2776; 10.2776 90; 90; 90 | 1085.61 | Barbier, J.; Greedan, J. E.; Asaro, T.; McCarthy, G. J. Neutron diffraction study of disorder in eulytite-type Sr3La(PO4)3 European Journal of Solid State and Inorganic Chemistry, 1990, 27, 855-867 |
| 9012895 | CIF | La O12 P3 Sr3 | I -4 3 d | 10.1853; 10.1853; 10.1853 90; 90; 90 | 1056.63 | Barbier, J.; Greedan, J. E.; Asaro, T.; McCarthy, G. J. Neutron diffraction study of disorder in eulytite-type Sr3La(PO4)3 Sample: T = 298 K European Journal of Solid State and Inorganic Chemistry, 1990, 27, 855-867 |
| 9012896 | CIF | La3 O12 P3 Sr3 | I -4 3 d | 10.1633; 10.1633; 10.1633 90; 90; 90 | 1049.79 | Barbier, J.; Greedan, J. E.; Asaro, T.; McCarthy, G. J. Neutron diffraction study of disorder in eulytite-type Sr3La(PO4)3 Sample: T = 15 K European Journal of Solid State and Inorganic Chemistry, 1990, 27, 855-867 |
| 9012900 | CIF | C2 Ba0.11 Ca0.74 Ce0.4 Na0.26 O6 Sr0.44 | P m c 21 | 5.26; 6.4; 7.34 90; 90; 90 | 247.094 | Nicheng, S.; Zhesheng, M.; Zhizhong, P. The crystal structure of carbocernaite Kexue Tongbao, 1982, 27, 76-80 |
| 9013412 | CIF | S Zn | P 63 m c | 3.818; 3.818; 6.26 90; 90; 120 | 79.027 | Ballentyne, D. W. G.; Roy, B. Electroluminescence and crystal structure in the alloy system ZnS - CdS Physica, 1961, 27, 337-341 |
| 9013890 | CIF | B2 Cu O4 | I -4 2 d | 11.484; 11.484; 5.62 90; 90; 90 | 741.178 | Martinez-Ripoll M; Martinez-Carrera S; Garcia-Blanco S The crystal structure of copper metaborate, CuB2O4 Acta Crystallographica, Section B, 1971, 27, 677-681 |
| 9014143 | CIF | As4 Cu6 Hg3 S12 | R 3 :H | 13.73; 13.73; 9.329 90; 90; 120 | 1523.02 | Nowacki, W. Isotypy in aktashite Cu6Hg3As4S12 and nowackiite Cu6Zn3As4S12 Soviet Physics Crystallography, 1982, 27, 26-27 |
| 9014751 | CIF | Fe3 Si | F m -3 m | 5.644; 5.644; 5.644 90; 90; 90 | 179.788 | Kanematsu, K. Stability of crystal structure of (Fe,V)3M and (Fe,Ni)3M (M=Si,Ge,Sn) and its analysis based on rigid band model Transactions of the Japan Institute of Metals, 1986, 27, 225-232 |
| 9015028 | CIF | B F4 H4 N | P n m a | 9.077; 5.679; 7.279 90; 90; 90 | 375.22 | Caron, A. P.; Ragle, J. L. Refinement of the structure of orthorhombic ammonium tetrafluoroborate, NH4BF4 Acta Crystallographica, Section B, 1971, 27, 1102-1107 |
| 9016429 | CIF | B H2 O2 | P 1 21/c 1 | 7.409; 7.666; 7.0421 90; 116.04; 90 | 359.371 | Baber, R. A.; Norman, N. C.; Orpen, A. G.; Rossi, J. The solid-state structure of diboronic acid, B2(OH)4 New Journal of Chemistry, 2003, 27, 772-775 |
| 9016605 | CIF | Fe0.96 Si2 | C m c e | 9.8362; 7.8301; 7.8655 90; 90; 90 | 605.788 | Li, G.; Sh, N.; Xiong, M.; Ma, Z.; Bai, W.; Fang, Q. Rietveld structure refinement of new mineral luobusaite (beta-FeSi2) Journal of Mineralogy and Petrology, 2007, 27, 1-5 |
| 9017246 | CIF | Ca0.25 Ce0.18 Dy0.1 Er0.08 Fe0.09 Gd0.07 La0.07 Mn0.61 Na0.1 Nd0.09 O28 Pr0.02 Si12 Sm0.03 Y1.17 Yb0.06 | I b a m | 7.5549; 15.2342; 19.6418 90; 90; 90 | 2260.63 | Kampf, A. R.; Housley, R. M. Chiappinoite-(Y), Y2Mn(Si3O7)4, a new layer silicate found in peralkaline syenitic ejecta from the Agua de Pau volcano, Azores European Journal of Mineralogy, 2015, 27, 91-97 |
| 9017247 | CIF | Al6.423 Ca6 Cl1.191 Fe0.388 H3.618 O17.809 Si0.189 | I -4 3 d | 12.0285; 12.0285; 12.0285 90; 90; 90 | 1740.34 | Galuskin, E. V.; Galuskina, I. O.; Kusz, J.; Gfeller, F.; Armbruster, T.; Bailau, R.; Dulski, M.; Gazeev, V. M.; Pertsev, N. N.; Zadov, A. E.; Dzierzanowski, P. Mayenite supergroup, part II: Chlorkyuygenite from Upper Chegem, Northern Caucasus, Kabardino-Balkaria, Russia, a new microporous mineral with "zeolitic" H2O European Journal of Mineralogy, 2015, 27, 113-122 |
| 9017248 | CIF | Al6.664 Ca6 F0.947 Fe0.224 H3.958 O18.053 Si0.112 | I -4 3 d | 11.966; 11.966; 11.966 90; 90; 90 | 1713.35 | Galuskin, E. V.; Gfeller, F.; Armbruster, T.; Galuskina, I. O.; Vapnik, Y.; Dulski, M.; Murashko, M.; Dzierzanowski, P.; Sharygin, V. V.; Krivovichev, S. V.; Wirth, R. Mayenite supergroup, part III: fluormayenite, Ca12Al14O32[[]4F2], and fluorkyuygenite, Ca12Al14O32[(H2O)4F2], two new minerals from pyrometamorphic rocks of the Hatrurim Complex, South Levant European Journal of Mineralogy, 2015, 27, 123-136 |
| 9017249 | CIF | Al6.838 Ca5.981 F1.053 Fe0.135 H1.053 Mg0.02 Na0.019 O16.593 | I -4 3 d | 11.9894; 11.9894; 11.9894 90; 90; 90 | 1723.43 | Galuskin, E. V.; Gfeller, F.; Armbruster, T.; Galuskina, I. O.; Vapnik, Y.; Dulski, M.; Murashko, M.; Dzierzanowski, P.; Sharygin, V. V.; Krivovichev, S. V.; Wirth, R. Mayenite supergroup, part III: fluormayenite, Ca12Al14O32[[]4F2], and fluorkyuygenite, Ca12Al14O32[(H2O)4F2], two new minerals from pyrometamorphic rocks of the Hatrurim Complex, South Levant European Journal of Mineralogy, 2015, 27, 123-136 |
| 9017250 | CIF | Cl6.951 Cu0.14 K2.949 Mg0.09 Rb0.03 Zn1.84 | P -1 | 6.7737; 10.5715; 11.073 117.93; 106.909; 90.389 | 660.609 | Pekov, I. V.; Zubkova, N. V.; Yapaskurt, V. O.; Lykova, I. S.; Belakovskiy, D. I.; Vigasina, M. F.; Sidorov, E. G.; Britvin, S. N.; Pushcharovsky, D. Y. New zinc and potassium chlorides from fumaroles of the Tolbachik volcano, Kamchatka, Russia: mineral data and crystal chemistry. I. Mellizinkalite, K3Zn2Cl7 European Journal of Mineralogy, 2015, 27, 247-253 |
| 9017399 | CIF | Al7 Ca6 F O16 | I -4 3 d | 11.981; 11.981; 11.981 90; 90; 90 | 1719.81 | Yu, Q.; Sugita, S.; Feng, X.; Mi, J. On the preparation of single crystals of 11CaO*7Al2O3*CaF2 and the confirmation of its crystal structure Cement and Concrete Research, 1997, 27, 1439-1449 |
| 9017530 | CIF | As Cu Pt S2 | A 1 a 1 | 5.852; 15.876; 3.756 90; 90; 90 | 348.956 | Ding, K.; He, C.; Zheng, Q. Determination of daomanite crystal structure Kexue Tongbao, 1982, 27, 62-66 |
| 9017531 | CIF | As Cu Pt S2 | C 1 c 1 | 3.756; 15.876; 5.852 90; 90; 90 | 348.956 | Ding, K.; He, C.; Zheng, Q. Determination of daomanite crystal structure Kexue Tongbao, 1982, 27, 62-66 |
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