Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9011005 | CIF | K | I m -3 m | 5.225; 5.225; 5.225 90; 90; 90 | 142.646 | Barrett, C. S. X-ray study of the alkali metals at low temperatures Locality: synthetic Sample: at T = 5 K Note: lattice parameters are average of 3 values Acta Crystallographica, 1956, 9, 671-677 |
| 9011006 | CIF | K | I m -3 m | 5.236; 5.236; 5.236 90; 90; 90 | 143.549 | Barrett, C. S. X-ray study of the alkali metals at low temperatures Sample: at T = 66 K Acta Crystallographica, 1956, 9, 671-677 |
| 9011007 | CIF | K | I m -3 m | 5.247; 5.247; 5.247 90; 90; 90 | 144.455 | Barrett, C. S. X-ray study of the alkali metals at low temperatures Locality: synthetic Sample: at T = 78 K Note: lattice parameters are average of 3 values Acta Crystallographica, 1956, 9, 671-677 |
| 9011008 | CIF | Rb | I m -3 m | 5.585; 5.585; 5.585 90; 90; 90 | 174.209 | Barrett, C. S. X-ray study of the alkali metals at low temperatures Locality: synthetic Sample: at T = 5 K Note: lattice parameters are average of 3 values Acta Crystallographica, 1956, 9, 671-677 |
| 9011009 | CIF | Rb | I m -3 m | 5.605; 5.605; 5.605 90; 90; 90 | 176.087 | Barrett, C. S. X-ray study of the alkali metals at low temperatures Locality: synthetic Sample: at T = 78 K Note: lattice parameters are average of 2 values Acta Crystallographica, 1956, 9, 671-677 |
| 9011010 | CIF | Cs | I m -3 m | 6.045; 6.045; 6.045 90; 90; 90 | 220.897 | Barrett, C. S. X-ray study of the alkali metals at low temperatures Locality: synthetic Sample: at T = 5 K Note: lattice parameters are average of 4 values Acta Crystallographica, 1956, 9, 671-677 |
| 9011011 | CIF | Cs | I m -3 m | 6.067; 6.067; 6.067 90; 90; 90 | 223.317 | Barrett, C. S. X-ray study of the alkali metals at low temperatures Locality: synthetic Sample: at T = 78 K Note: lattice parameters are average of 6 values Acta Crystallographica, 1956, 9, 671-677 |
| 9011012 | CIF | Cu Fe2 O4 | I 41/a m d :2 | 5.8; 5.8; 8.73 90; 90; 90 | 293.677 | Prince, E.; Treuting, R. G. The structure of tetragonal copper ferrite Note: cell extrapolated from tetrahedra description Acta Crystallographica, 1956, 9, 1025-1028 |
| 9011013 | CIF | B2 H6 Mg O7 | P 42/n :1 | 7.62; 7.62; 8.19 90; 90; 90 | 475.547 | Paton, F.; MacDonald, S. G. G. The crystal structure of pinnoite Acta Crystallographica, 1957, 10, 653-656 |
| 9011014 | CIF | H2 O3 V | I 1 2/c 1 | 8.8; 3.95; 5.96 90; 90.67; 90 | 207.155 | Evans, H. T.; Mrose, M. E. The crystal structures of three new vanadium oxide minerals Note: x(OH2) corrected Acta Crystallographica, 1958, 11, 56-58 |
| 9011015 | CIF | O5 V2 | C 1 2/m 1 | 12.17; 2.99; 4.83 90; 98.25; 90 | 173.937 | Evans, H. T.; Mrose, M. E. The crystal structures of three new vanadium oxide minerals Acta Crystallographica, 1958, 11, 56-58 |
| 9011016 | CIF | O8 V3 | C 1 2/m 1 | 19.64; 2.99; 4.83 90; 103.92; 90 | 275.305 | Evans, H. T.; Mrose, M. E. The crystal structures of three new vanadium oxide minerals Acta Crystallographica, 1958, 11, 56-58 |
| 9011017 | CIF | H K O4 S | P b c a | 8.4; 9.79; 18.93 90; 90; 90 | 1556.73 | Loopstra, L. H.; MacGillavry, V. H. The crystal structure of KHSO4 (mercallite) Acta Crystallographica, 1958, 11, 349-354 |
| 9011018 | CIF | H8 Na2 O12 S2 Zn | P 1 21/a 1 | 11.05; 8.23; 5.54 90; 100.58; 90 | 495.251 | Giglio, M. Die kristallstruktur von Na2Zn(SO4)2*4H2O (Zn-blodit) Acta Crystallographica, 1958, 11, 789-794 |
| 9011019 | CIF | Ag0.5 Bi0.5 Se | F m -3 m | 5.82; 5.82; 5.82 90; 90; 90 | 197.137 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Sample: pure sample Acta Crystallographica, 1959, 12, 46-54 |
| 9011020 | CIF | Ag0.5 Bi0.5 Se | F m -3 m | 5.832; 5.832; 5.832 90; 90; 90 | 198.359 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Sample: solid solution extrapolation Acta Crystallographica, 1959, 12, 46-54 |
| 9011021 | CIF | Ag0.5 Bi0.5 Se | F m -3 m | 5.887; 5.887; 5.887 90; 90; 90 | 204.024 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Sample: quenched from T = 300 C Acta Crystallographica, 1959, 12, 46-54 |
| 9011022 | CIF | Ag Bi Se2 | R -3 m :R | 7.022; 7.022; 7.022 34.5; 34.5; 34.5 | 99.098 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Sample: quenched from T = 240 C Acta Crystallographica, 1959, 12, 46-54 |
| 9011023 | CIF | Ag Bi Se2 | P -3 m 1 | 4.18; 4.18; 19.67 90; 90; 120 | 297.637 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Locality: synthetic Acta Crystallographica, 1959, 12, 46-54 |
| 9011024 | CIF | Ag Bi S2 | P -3 m 1 | 4.07; 4.07; 19.06 90; 90; 120 | 273.428 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Acta Crystallographica, 1959, 12, 46-54 |
| 9011025 | CIF | Ag0.5 Bi0.5 S | F m -3 m | 5.648; 5.648; 5.648 90; 90; 90 | 180.171 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Locality: synthetic Acta Crystallographica, 1959, 12, 46-54 |
| 9011026 | CIF | Ag0.5 Bi0.5 S | F m -3 m | 5.682; 5.682; 5.682 90; 90; 90 | 183.444 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Locality: synthetic Sample: quenched from T = 200 C Acta Crystallographica, 1959, 12, 46-54 |
| 9011027 | CIF | Ag0.5 Bi0.5 S | F m -3 m | 5.693; 5.693; 5.693 90; 90; 90 | 184.512 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Locality: synthetic Sample: quenched from T = 243 C Acta Crystallographica, 1959, 12, 46-54 |
| 9011028 | CIF | Ag0.5 Sb0.5 Se | F m -3 m | 5.786; 5.786; 5.786 90; 90; 90 | 193.703 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Acta Crystallographica, 1959, 12, 46-54 |
| 9011029 | CIF | Ag0.5 S Sb0.5 | F m -3 m | 5.647; 5.647; 5.647 90; 90; 90 | 180.075 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Acta Crystallographica, 1959, 12, 46-54 |
| 9011030 | CIF | Ag0.5 Sb0.5 Te | F m -3 m | 6.078; 6.078; 6.078 90; 90; 90 | 224.534 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Acta Crystallographica, 1959, 12, 46-54 |
| 9011031 | CIF | Ag0.5 Bi0.5 Te | F m -3 m | 6.155; 6.155; 6.155 90; 90; 90 | 233.176 | Geller, S.; Wernick, J. H. Ternary semiconducting compounds with sodium chloride-like structure: AgSbSe2, AgSbTe2, AgBiS2, AgBiSe2 Acta Crystallographica, 1959, 12, 46-54 |
| 9011033 | CIF | Ca | F m -3 m | 5.5884; 5.5884; 5.5884 90; 90; 90 | 174.527 | Bernstein, B. T.; Smith, J. F. Coefficients of thermal expansion for face-centered cubic and body-centered cubic calcium Sample: at T = 26 C Acta Crystallographica, 1959, 12, 419-420 |
| 9011034 | CIF | Ca | I m -3 m | 4.48; 4.48; 4.48 90; 90; 90 | 89.915 | Bernstein, B. T.; Smith, J. F. Coefficients of thermal expansion for face-centered cubic and body-centered cubic calcium Sample: at T = 467 C Acta Crystallographica, 1959, 12, 419-420 |
| 9011035 | CIF | Al2 Ca O8 Si2 | P 63/m c m | 5.1; 5.1; 14.72 90; 90; 120 | 331.573 | Takeuchi, Y.; Donnay, G. The crystal structure of hexagonal CaAl2Si2O8 Acta Crystallographica, 1959, 12, 465-470 |
| 9011036 | CIF | B | R -3 m :H | 4.908; 4.908; 12.567 90; 90; 120 | 262.163 | Decker, B. F.; Kasper, J. S. The crystal structure of a simple rhombohedral form of boron Locality: synthetic Acta Crystallographica, 1959, 12, 503-506 |
| 9011037 | CIF | Li Mn O4 P | P m n b | 6.1; 10.46; 4.744 90; 90; 90 | 302.696 | Geller, S.; Durand, J. L. Refinement of the structure of LiMnPO4 Acta Crystallographica, 1960, 13, 325-331 |
| 9011038 | CIF | Fe H6 O6 Sn | P n -3 m :2 | 7.79; 7.79; 7.79 90; 90; 90 | 472.729 | Strunz, V. H.; Contag, B. Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur Acta Crystallographica, 1960, 13, 601-603 |
| 9011039 | CIF | H6 Mn O6 Sn | P n -3 m :2 | 7.88; 7.88; 7.88 90; 90; 90 | 489.304 | Strunz, V. H.; Contag, B. Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur Acta Crystallographica, 1960, 13, 601-603 |
| 9011040 | CIF | Co H6 O6 Sn | P n -3 m :2 | 7.78; 7.78; 7.78 90; 90; 90 | 470.911 | Strunz, V. H.; Contag, B. Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur Acta Crystallographica, 1960, 13, 601-603 |
| 9011041 | CIF | H6 Mg O6 Sn | P n -3 m :2 | 7.77; 7.77; 7.77 90; 90; 90 | 469.097 | Strunz, V. H.; Contag, B. Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur Acta Crystallographica, 1960, 13, 601-603 |
| 9011042 | CIF | Ca H6 O6 Sn | P n -3 m :2 | 8.13; 8.13; 8.13 90; 90; 90 | 537.368 | Strunz, V. H.; Contag, B. Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur Acta Crystallographica, 1960, 13, 601-603 |
| 9011043 | CIF | Ca4 H2 O11 Si3 | P -1 | 10.32; 7.36; 7.04 90; 106.4; 90 | 512.969 | Gard, J. A.; Taylor, H. F. W. The crystal structure of foshagite Acta Crystallographica, 1960, 13, 785-793 |
| 9011044 | CIF | Li3 O4 P | P m n b | 6.12; 10.53; 4.93 90; 90; 90 | 317.707 | Zemann, J. Die kristallstruktur von lithiumphosphat, Li3PO4 Acta Crystallographica, 1960, 13, 863-867 |
| 9011045 | CIF | H4 In O6 P | P b c a | 10.36; 8.84; 10.19 90; 90; 90 | 933.225 | Mooney-Slater R C L X-ray diffraction study of indium phosphate dihydrate and isostructural thallic compounds Acta Crystallographica, 1961, 14, 1140-1146 |
| 9011046 | CIF | As9 Pb5 S18 | P -1 | 22.78; 8.33; 7.9 90; 97.4; 90 | 1486.6 | Le Bihan, M. T. Contribution a l'etude structurale des sulfures d'arsenic et de plomb. Structure de la baumhauerite Acta Crystallographica, 1961, 14, 1210-1211 |
| 9011047 | CIF | As13 Pb9 S28 | P 1 21/c 1 | 8.43; 70.9; 7.91 90; 90.25; 90 | 4727.66 | Le Bihan, M. T. Structure de la rathite II. Comparaison entre les differentes structures connues de sulfures d'arsenic et de plomb Acta Crystallographica, 1961, 14, 1211-1212 |
| 9011048 | CIF | C H Na O3 | P 1 21/c 1 | 3.51; 9.71; 8.05 90; 111.85; 90 | 254.651 | Sass, R. L.; Scheuerman, R. F. The crystal structure of sodium bicarbonate Acta Crystallographica, 1962, 15, 77-81 |
| 9011049 | CIF | B4 Li2 O7 | I 41 c d | 9.47; 9.47; 10.26 90; 90; 90 | 920.126 | Krogh-Moe J The crystal structure of lithium diborate, Li2O*2B2O3 Acta Crystallographica, 1962, 15, 190-193 |
| 9011050 | CIF | Ge | F d -3 m :1 | 5.65754; 5.65754; 5.65754 90; 90; 90 | 181.085 | Cooper, A. S. Precise lattice constants of germanium, aluminum, gallium arsenide, uranium, sulphur, quartz and sapphire Sample: at T = 24.6 C Acta Crystallographica, 1962, 15, 578-582 |
| 9011051 | CIF | Pd17 Se15 | P m -3 m | 10.606; 10.606; 10.606 90; 90; 90 | 1193.04 | Geller, S. The crystal structure of Pd17Se15 Sample: Pm3m refinement Acta Crystallographica, 1962, 15, 713-721 |
| 9011052 | CIF | Pd17 Se15 | P -4 3 m | 10.606; 10.606; 10.606 90; 90; 90 | 1193.04 | Geller, S. The crystal structure of Pd17Se15 Sample: P-43m refinement Acta Crystallographica, 1962, 15, 713-721 |
| 9011053 | CIF | Pd17 Se15 | P 4 3 2 | 10.606; 10.606; 10.606 90; 90; 90 | 1193.04 | Geller, S. The crystal structure of Pd17Se15 Sample: P432 refinement Acta Crystallographica, 1962, 15, 713-721 |
| 9011054 | CIF | B H O2 | P -4 3 n | 8.886; 8.886; 8.886 90; 90; 90 | 701.647 | Zachariasen, W. H. The crystal structure of cubic metaboric acid Acta Crystallographica, 1963, 16, 380-384 |
| 9011055 | CIF | Cu1.25 Fe0.25 S | R 3 m :R | 6.7; 6.7; 6.7 33.53; 33.53; 33.53 | 81.736 | Morimoto, N. Structures of two polymorphic forms of Cu5FeS4 Sample: metastable, twin process Acta Crystallographica, 1964, 17, 351-360 |
| 9011056 | CIF | Si | I a -3 | 6.636; 6.636; 6.636 90; 90; 90 | 292.226 | Kasper, J. S.; Richards, S. M. The crystal structures of new forms of silicon and germanium Acta Crystallographica, 1964, 17, 752-755 |
| 9011057 | CIF | Ge | P 43 21 2 | 5.93; 5.93; 6.98 90; 90; 90 | 245.451 | Kasper, J. S.; Richards, S. M. The crystal structures of new forms of silicon and germanium Acta Crystallographica, 1964, 17, 752-755 |
| 9011058 | CIF | F6 Na2 Si | P 3 2 1 | 8.859; 8.859; 5.038 90; 90; 120 | 342.419 | Zalkin, A.; Forrester, J. D.; Templeton, D. H. The crystal structure of sodium fluorosilicate Acta Crystallographica, 1964, 17, 1408-1412 |
| 9011059 | CIF | O3 S | P 21 n b | 5.13; 10.82; 12.4 90; 90; 90 | 688.282 | Pascard, R.; Pascard-Billy C Structure precise de l'anhydride sulfurique Acta Crystallographica, 1965, 18, 830-834 |
| 9011060 | CIF | As Cu S | P n a 21 | 11.35; 5.456; 3.749 90; 90; 90 | 232.159 | Craig, D. C.; Stephenson, N. C. The crystal structure of lautite, CuAsS Acta Crystallographica, 1965, 19, 543-547 |
| 9011061 | CIF | C5 H4 N4 O3 | P 1 21/a 1 | 14.464; 7.403; 6.208 90; 65.1; 90 | 602.943 | Ringertz, H. The molecular and crystal structure of uric acid Acta Crystallographica, 1966, 20, 397-403 |
| 9011062 | CIF | D12 Ni O10 S | P 41 21 2 | 6.79; 6.79; 18.305 90; 90; 90 | 843.936 | O'Connor B H; Dale, D. H. A neutron diffraction analysis of the crystal structure of tetragonal nickel sulphate hexadeuterate Locality: synthetic Acta Crystallographica, 1966, 21, 705-709 |
| 9011063 | CIF | O3 S | P 21 n b | 5.191; 10.82; 12.384 90; 90; 90 | 695.567 | McDonald, W. S.; Cruickshank, D. W. J. A refinement of the structure of S3O9 Acta Crystallographica, 1967, 22, 48-51 |
| 9011064 | CIF | Al H24 Na O20 S2 | P a -3 | 12.213; 12.213; 12.213 90; 90; 90 | 1821.66 | Cromer, D. T.; Kay, M. I.; Larson, A. C. Refinement of the alum structures. II. X-ray and neutron diffraction of NaAl(SO4)2*12H2O, gamma alum Locality: synthetic Acta Crystallographica, 1967, 22, 182-187 |
| 9011066 | CIF | C7 H4 O | P 1 21/a 1 | 15.81; 3.942; 7.895 90; 102.72; 90 | 479.964 | Prakash, A. Refinement of the crystal structure of anthraquinone Acta Crystallographica, 1967, 22, 439-440 |
| 9011067 | CIF | Fe6.3 K1.8 Mn0.7 Na1.2 Nb0.2 O31 Si8 Sn0.1 Ti1.6 Zr0.1 | A -1 | 5.36; 11.76; 21.07999 85.13; 90; 103.22 | 1288.61 | Woodrow, P. J. The crystal structure of astrophyllite Acta Crystallographica, 1967, 22, 673-678 |
| 9011068 | CIF | Mn | I -4 3 m | 8.9125; 8.9125; 8.9125 90; 90; 90 | 707.944 | Gazzara, C. P.; Middleton, R. M.; Weiss, R. J.; Hall, E. O. A refinement of the parameters of alpha manganese Localilty: synthetic Sample: at T = 298K Acta Crystallographica, 1967, 22, 859-862 |
| 9011070 | CIF | B2 H6 Mg O7 | P 42 | 7.62; 7.62; 8.19 90; 90; 90 | 475.547 | Krogh-Moe J A note on the structure of pinnoite Acta Crystallographica, 1967, 23, 500-501 |
| 9011071 | CIF | O4 Ta Y | P 1 2/a 1 | 5.292; 5.451; 5.11 90; 96.44; 90 | 146.476 | Wolten, G. M. The structure of the M'-phase of YTaO4, a third fergusonite polymorph Acta Crystallographica, 1967, 23, 939-944 |
| 9011072 | CIF | C6 D6 Fe K4 N6 O3 | A 1 2/a 1 | 9.415; 17.006; 9.382 90; 90.03; 90 | 1502.17 | Taylor, J. C.; Mueller, M. H.; Hitterman, R. L. A neutron diffraction study of ferroelectric KFCT, K4Fe(CN)6*3D2O, above the Curie temperature Locality: synthetic Acta Crystallographica, Section A, 1970, 26, 559-567 |
| 9011073 | CIF | C60 | F m -3 | 14.26; 14.26; 14.26 90; 90; 90 | 2899.74 | Dorset, D. L.; McCourt, M. P. Disorder and the molecular packing of C60 buckminsterfullerene: a direct electron-crystallographic analysis Sample: room T Acta Crystallographica, Section A, 1994, 50, 344-351 |
| 9011074 | CIF | Fe0.24 Ni7.76 P0.63 Si2.37 | R -3 c :H | 6.64; 6.64; 37.9819 90; 90; 120 | 1450.25 | Marsh, R. E. The centrosymmetric - noncentrosymmetric ambiguity: some more examples Acta Crystallographica, Section A, 1994, 50, 450-455 |
| 9011075 | CIF | Pd8 Sb3 | R -3 c :H | 7.6152; 7.6152; 43.032 90; 90; 120 | 2161.15 | Marsh, R. E. The centrosymmetric - noncentrosymmetric ambiguity: some more examples Acta Crystallographica, Section A, 1994, 50, 450-455 |
| 9011076 | CIF | C14 N4 O2 Pt | C m c m | 18.722; 11.889; 6.688 90; 90; 90 | 1488.65 | Marsh, R. E. The centrosymmetric - noncentrosymmetric ambiguity: some more examples Acta Crystallographica, Section A, 1994, 50, 450-455 |
| 9011077 | CIF | C9 H17 O4 P | P 1 21/n 1 | 12.385; 6.59; 13.394 90; 98; 90 | 1082.54 | Marsh, R. E. The centrosymmetric - noncentrosymmetric ambiguity: some more examples Acta Crystallographica, Section A, 1994, 50, 450-455 |
| 9011078 | CIF | H12 Ni O10 S | P 41 21 2 | 6.782; 6.782; 18.274 90; 90; 90 | 840.522 | Rousseau, B.; Maes, S. T.; Lenstra, A. T. H. Systematic intensity errors and model imperfection as the consequence of spectral truncation Acta Crystallographica, Section A, 2000, 56, 300-307 |
| 9011079 | CIF | Cl K O4 | P n m a | 8.7684; 5.6237; 7.2039 90; 90; 90 | 355.23 | Marabello, D.; Bianchi, R.; Gervasio, G.; Cargnoni, F. An experimental (120K) and theoretical electron-density study of KMnO4 and KClO4 Locality: synthetic Note: potassium perchlorate T = 120 K Acta Crystallographica, Section A, 2004, 60, 494-501 |
| 9011080 | CIF | Cl2 Hg3 S2 | I 21 3 | 8.949; 8.949; 8.949 90; 90; 90 | 716.677 | Frueh, A. J.; Gray, N. Confirmation and refinement of the structure of Hg3S2Cl2 Acta Crystallographica, Section B, 1968, 24, 156-157 |
| 9011083 | CIF | Al Cl3 H12 O6 | R -3 c :H | 11.827; 11.827; 11.895 90; 90; 120 | 1440.94 | Buchanan, D. R.; Harris, P. M. A neutron and X-ray diffraction investigation of aluminium chloride hexahydrate Locality: synthetic Sample: single crystal X-ray diffraction data Acta Crystallographica, Section B, 1968, 24, 954-960 |
| 9011085 | CIF | Na2 O5 Si2 | P 1 21/a 1 | 12.329; 4.848; 8.133 90; 104.24; 90 | 471.181 | Pant, A. K. A reconsideration of the crystal structure of beta-Na2Si2O5 Acta Crystallographica, Section B, 1968, 24, 1077-1083 |
| 9011086 | CIF | Cl Hg1.5 S | A 2 m m | 4.664; 16.82; 9.081 90; 90; 90 | 712.391 | Durovic, S. The crystal structure of gamma-Hg3S2Cl2 Sample: one-layer structure used for interatomic functions Acta Crystallographica, Section B, 1968, 24, 1661-1670 |
| 9011088 | CIF | Cl Hg1.5 S | P b m m | 9.328; 8.41; 4.5405 90; 90; 90 | 356.195 | Durovic, S. The crystal structure of gamma-Hg3S2Cl2 Sample: superposition structure Acta Crystallographica, Section B, 1968, 24, 1661-1670 |
| 9011089 | CIF | Ga | C 1 2/c 1 | 2.766; 8.053; 3.332 90; 92.02; 90 | 74.173 | Bosio, L.; Defrain, A.; Curien, H.; Rimsky, A. Structure cristalline du gallium-beta Sample: at T = 248.15 K Note: structure known as beta phase Acta Crystallographica, Section B, 1969, 25, 995-995 |
| 9011090 | CIF | Fe7 O10 Si | P 1 21/m 1 | 21.4; 3.06; 5.88 90; 98; 90 | 381.299 | Smuts, J.; Steyn, J. G. D.; Boeyens, J. C. A. The crystal structure of an iron silicate, iscorite Acta Crystallographica, Section B, 1969, 25, 1251-1255 |
| 9011091 | CIF | Ca5 H O13 P3 | P 63/m | 9.424; 9.424; 6.879 90; 90; 120 | 529.086 | Sudarsanan, K.; Young, R. A. Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-4 Acta Crystallographica, Section B, 1969, 25, 1534-1543 |
| 9011092 | CIF | Ca5 H O13 P3 | P 63/m | 9.424; 9.424; 6.879 90; 90; 120 | 529.086 | Sudarsanan, K.; Young, R. A. Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-6 Acta Crystallographica, Section B, 1969, 25, 1534-1543 |
| 9011093 | CIF | Ca5 H O13 P3 | P 63/m | 9.424; 9.424; 6.879 90; 90; 120 | 529.086 | Sudarsanan, K.; Young, R. A. Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-10 Acta Crystallographica, Section B, 1969, 25, 1534-1543 |
| 9011094 | CIF | Ca5 H O13 P3 | P 63/m | 9.424; 9.424; 6.879 90; 90; 120 | 529.086 | Sudarsanan, K.; Young, R. A. Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: Neutron Acta Crystallographica, Section B, 1969, 25, 1534-1543 |
| 9011099 | CIF | Cl Fe2 O12 Te4 | P -1 | 8.89; 5.08; 6.63 103.17; 107.08; 77.87 | 275.366 | Dusausoy, Y.; Protas, J. Determination et etude de la structure cristalline de la rodalquilarite, chlorotellurite acide de fer Acta Crystallographica, Section B, 1969, 25, 1551-1558 |
| 9011100 | CIF | C H30 Ca3 Mn O25 S | P 63 | 11.06; 11.06; 10.5 90; 90; 120 | 1112.32 | Granger, M. M.; Protas, J. Determination et etude de la structure cristalline de la jouravskite Ca3MnIV(SO4)(CO3)(OH)*12(H2O) Acta Crystallographica, Section B, 1969, 25, 1943-1951 |
| 9011101 | CIF | B5 H4 N O10 | P 1 21/c 1 | 9.47; 7.63; 11.65 90; 97.08; 90 | 835.365 | Merlino, S.; Sartori, F. The crystal structure of lardellite, NH4B5O7(OH)2*H2O Acta Crystallographica, Section B, 1969, 25, 2264-2270 |
| 9011102 | CIF | C H20 Na2 O13 | C 1 c 1 | 12.83; 9.026; 13.44 90; 123; 90 | 1305.31 | Taga, T. Crystal structure of Na2CO3*10H2O Acta Crystallographica, Section B, 1969, 25, 2656-2657 |
| 9011103 | CIF | Al2 Ca6 H66 O49.68 S3 | P 3 1 c | 11.26; 11.26; 21.48 90; 90; 120 | 2358.53 | Moore, A. E.; Taylor, H. F. W. Crystal structure of ettringite Acta Crystallographica, Section B, 1970, 26, 386-393 |
| 9011104 | CIF | O7 Si2 Yb2 | C 1 2/m 1 | 6.802; 8.875; 4.703 90; 102.12; 90 | 277.581 | Smolin, Y. I.; Shepelev, Y. F. The crystal structures of the rare earth pyrosilicates Acta Crystallographica, Section B, 1970, 26, 484-492 |
| 9011105 | CIF | Er2 O7 Si2 | P 1 1 21/b | 4.683; 5.556; 10.79 90; 90; 96 | 279.204 | Smolin, Y. I.; Shepelev, Y. F. The crystal structures of the rare earth pyrosilicates Acta Crystallographica, Section B, 1970, 26, 484-492 |
| 9011106 | CIF | Gd2 O7 Si2 | P n a 21 | 13.87; 5.073; 8.33 90; 90; 90 | 586.12 | Smolin, Y. I.; Shepelev, Y. F. The crystal structures of the rare earth pyrosilicates Acta Crystallographica, Section B, 1970, 26, 484-492 |
| 9011107 | CIF | Nd2 O7 Si2 | P 21 21 21 | 5.394; 12.95; 8.72 90; 90; 90 | 609.112 | Smolin, Y. I.; Shepelev, Y. F. The crystal structures of the rare earth pyrosilicates Acta Crystallographica, Section B, 1970, 26, 484-492 |
| 9011108 | CIF | Mn | I -4 3 m | 8.911; 8.911; 8.911 90; 90; 90 | 707.586 | Oberteuffer, J. A.; Ibers, J. A. A refinement of the atomic and thermal parameters of alpha-manganese from a single crystal Acta Crystallographica, Section B, 1970, 26, 1499-1504 |
| 9011109 | CIF | B35 | R -3 m :R | 10.17; 10.17; 10.17 65.12; 65.12; 65.12 | 826.857 | Geist, D.; Kloss, R.; Follner, H. Verfeinerung des beta-rhomboedrischen bors Acta Crystallographica, Section B, 1970, 26, 1800-1802 |
| 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 |
| 9011115 | CIF | K2 Mg5 O30 Si12 | P 6/m c c | 10.222; 10.222; 14.152 90; 90; 120 | 1280.62 | Khan, A. A.; Baur, W. H.; Forbes, W. C. Synthetic magnesian merrihueite, dipotassium pentamagnesium dodecasilicate: a tetrahedral magnesiosilicate framework crystal structure Acta Crystallographica, Section B, 1972, 28, 267-272 |
| 9011116 | CIF | Se8 | P 1 21/n 1 | 9.054; 9.083; 11.601 90; 90.81; 90 | 953.942 | Cherin, P.; Unger, P. Refinement of the crystal structure of alpha-monoclinic Se Sample: at T = 26 C Note: structure known as alpha phase Acta Crystallographica, Section B, 1972, 28, 313-317 |
| 9011117 | CIF | Ag5 Hg7.55 | I 2 3 | 10.0506; 10.0506; 10.0506 90; 90; 90 | 1015.26 | Fairhurst, C. W.; Cohen, J. B. The crystal structure of two compounds found in dental amalgam: Ag2Hg3 and Ag3Sn Acta Crystallographica, Section B, 1972, 28, 371-378 |
| 9011118 | CIF | Ag3 Sn | P m m n :2 | 5.968; 4.7802; 5.1843 90; 90; 90 | 147.899 | Fairhurst, C. W.; Cohen, J. B. The crystal structure of two compounds found in dental amalgam: Ag2Hg3 and Ag3Sn Acta Crystallographica, Section B, 1972, 28, 371-378 |
| 9011119 | CIF | C8 H5 N O2 | P 1 21/n 1 | 22.83; 7.651; 3.81 90; 91.36; 90 | 665.314 | Matzat, E. Die kristallstruktur des phtalimids (kladnoit) Acta Crystallographica, Section B, 1972, 28, 415-418 |
| 9011120 | CIF | Ga | C m c m | 10.593; 13.523; 5.203 90; 90; 90 | 745.325 | Bosio, L.; Curien, H.; Dupont, M.; Rimsky, A. Structure cristalline de Ga-gamma Sample: at T = 220 K Note: structure known as gamma phase Acta Crystallographica, Section B, 1972, 28, 1974-1975 |
| 9011121 | CIF | H9 N2 O4 P | P 1 21/c 1 | 11.043; 6.7; 8.031 90; 113.42; 90 | 545.246 | Khan, A. A.; Roux, J. P.; James, W. J. The crystal structure of diammonium hydrogen phosphate, (NH4)2HPO4 Acta Crystallographica, Section B, 1972, 28, 2065-2069 |
| 9011122 | CIF | H4 Mo O5 | P 1 21/n 1 | 10.476; 13.822; 10.606 90; 91.62; 90 | 1535.13 | Krebs, B. Die kristallstruktur von MoO3*2H2O Acta Crystallographica, Section B, 1972, 28, 2222-2231 |
| 9011123 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.035; 10.309; 3.795 90; 90; 90 | 314.351 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: HOX(XR) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011124 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.025; 10.3; 3.799 90; 90; 90 | 314.016 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: NOX(XR) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011125 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.027; 10.298; 3.816 90; 90; 90 | 315.438 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: DOX(XR) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011126 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.035; 10.309; 3.795 90; 90; 90 | 314.351 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: HOX(N) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011127 | CIF | C2 H2 N2 O5 | P 21 21 2 | 8.025; 10.3; 3.799 90; 90; 90 | 314.016 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: NOX(N) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011128 | CIF | C2 H10 N2 O5 | P 21 21 2 | 8.027; 10.298; 3.816 90; 90; 90 | 315.438 | Taylor, J. C.; Sabine, T. M. Isotope and bonding effects in ammonium oxalate monohydrate, determined by the combined use of neutron and X-ray diffraction analyses Locality: synthetic Sample: DOX(N) Acta Crystallographica, Section B, 1972, 28, 3340-3351 |
| 9011129 | CIF | Cl10 Cu4 K4 O | C 1 2/c 1 | 14.7; 14.88; 8.95 90; 104.74; 90 | 1893.26 | de Boer, J. J.; Bright, D.; Helle, J. N. The structure of the potassium salt of mu4-oxo-hexa-mu-chloro- tetra[chlorocuprate(II)], K4Cu4OCl10 Acta Crystallographica, Section B, 1972, 28, 3436-3437 |
| 9011130 | CIF | B5 H10 Na O13 | C 1 2/c 1 | 11.119; 16.474; 13.576 90; 112.83; 90 | 2291.96 | Merlino, S.; Sartori, F. The crystal structure of sborgite, NaB5O6(OH)4*3H2O Acta Crystallographica, Section B, 1972, 28, 3559-3567 |
| 9011131 | CIF | H0.886 O12.886 P3 Sr4.894 | P 63/m | 9.745; 9.745; 7.265 90; 90; 120 | 597.489 | Sudarsanan, K.; Young, R. A. Structure of strontium hydroxide phosphate, Sr5(PO4)3OH Locality: synthetic Acta Crystallographica, Section B, 1972, 28, 3668-3670 |
| 9011133 | CIF | Cu3 S4 Sb | I -4 2 m | 5.385; 5.385; 10.754 90; 90; 90 | 311.847 | Garin, J.; Parthe, E. The crystal structure of Cu3PSe4 and other ternary normal tetrahedral structure compounds with composition 1_356_4 Acta Crystallographica, Section B, 1972, 28, 3672-3674 |
| 9011134 | CIF | Cu3 P Se4 | P m n 21 | 7.697; 6.661; 6.381 90; 90; 90 | 327.152 | Garin, J.; Parthe, E. The crystal structure of Cu3PSe4 and other ternary normal tetrahedral structure compounds with composition 1_356_4 Acta Crystallographica, Section B, 1972, 28, 3672-3674 |
| 9011135 | CIF | As Lu O4 | I 41/a m d :2 | 6.949; 6.949; 6.227 90; 90; 90 | 300.693 | Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C. Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic Note: isostructural with Chernovite-(Y) Acta Crystallographica, Section B, 1973, 29, 141-142 |
| 9011136 | CIF | Lu O4 P | I 41/a m d :2 | 6.792; 6.792; 5.955 90; 90; 90 | 274.712 | Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C. Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic Note: isostructural with xenotime-(Y) Acta Crystallographica, Section B, 1973, 29, 141-142 |
| 9011137 | CIF | O4 V Y | I 41/a m d :2 | 7.12; 7.12; 6.289 90; 90; 90 | 318.817 | Lohmuller, G.; Schmidt, G.; Deppisch, B.; Gramlich, V.; Scheringer, C. Die kristallstrukturen von yttrium-vanadat, lutetium-phosphat und lutetium-arsenat Locality: synthetic Acta Crystallographica, Section B, 1973, 29, 141-142 |
| 9011138 | CIF | Ca O7 V3 | P n a m | 10.459; 5.295; 10.382 90; 90; 90 | 574.959 | Bouloux, J. C.; Galy, J. Les hypovanadates MV3O7 (M=Ca,Sr,Cd). Structure cristalline de CaV3O7 Acta Crystallographica, Section B, 1973, 29, 269-275 |
| 9011139 | CIF | Ga | R -3 m :H | 9.087; 9.087; 17.02 90; 90; 120 | 1217.11 | Bosio, L.; Curien, H.; Dupont, M.; Rimsky, A. Structure cristalline de Ga-delta Loclity: synthetic Sample: at T = 191 K Note: structure known as the delta phase Acta Crystallographica, Section B, 1973, 29, 367-368 |
| 9011140 | CIF | Cu O5 Te2 | P 1 21/c 1 | 6.871; 9.322; 7.602 90; 109.08; 90 | 460.169 | Hanke, K.; Kupcik, V.; Lindqvist, O. The crystal structure of CuTe2O5 Acta Crystallographica, Section B, 1973, 29, 963-970 |
| 9011141 | CIF | O5 Te U | P c a 21 | 10.161; 5.363; 7.862 90; 90; 90 | 428.427 | Meunier, G.; Galy, J. Structure cristalline de la schmitterite synthetique UTeO5 Acta Crystallographica, Section B, 1973, 29, 1251-1255 |
| 9011142 | CIF | Cu5 O10 V2 | P 1 21/c 1 | 8.393; 6.0652; 16.156 90; 108.09; 90 | 781.772 | Shannon, R. D.; Calvo, C. Crystal structure of Cu5V2O10 Acta Crystallographica, Section B, 1973, 29, 1338-1345 |
| 9011143 | CIF | As Hg3 O4 | P 1 21/c 1 | 8.73; 5.08; 15.64 90; 128.4; 90 | 543.577 | Kamenar, B.; Kaitner, B. The crystal structure of mercury(I) orthoarsenate Acta Crystallographica, Section B, 1973, 29, 1666-1669 |
| 9011144 | CIF | Ca4 O9 P2 | P 1 21 1 | 7.023; 11.986; 9.473 90; 90.9; 90 | 797.317 | Dickens, B.; Brown, W. E.; Kruger, G. J.; Stewart, J. M. Ca4(PO4)2O, tetracalcium diphosphate monooxide. Crystal structure and relationships to Ca5(PO4)3OH and K3Na(SO4)2 Note: z(O11) corrected to match reported bond lengths Acta Crystallographica, Section B, 1973, 29, 2046-2056 |
| 9011145 | CIF | Cu9 Fe9 S16 | P -4 2 m | 10.585; 10.585; 5.383 90; 90; 90 | 603.123 | Hall, S. R.; Rowland, J. F. The crystal structure of synthetic mooihoekite, Cu9Fe9S16 Acta Crystallographica, Section B, 1973, 29, 2365-2372 |
| 9011146 | CIF | Na O6 Sc Si2 | C 1 2/c 1 | 9.8438; 9.0439; 5.354 90; 107.215; 90 | 455.294 | Hawthorne, F. C.; Grundy, H. D. Refinement of the crystal structure of NaScSi2O6 Acta Crystallographica, Section B, 1973, 29, 2615-2616 |
| 9011147 | CIF | H9 N Na O8 P | P -1 | 10.636; 6.9187; 6.4359 90.46; 97.87; 109.2 | 442.331 | Ferraris, G.; Franchini-Angela M Hydrogen bonding in the crystalline state. Crystal structure and twinning of NaNH4HPO4*4H2O (Stercorite) Acta Crystallographica, Section B, 1974, 30, 504-510 |
| 9011148 | CIF | Cl H4 Na O2 | P 1 21/c 1 | 6.3313; 10.1178; 6.5029 90; 114.407; 90 | 379.341 | Klewe, B.; Pedersen, B. The crystal structure of sodium chloride dihydrate Acta Crystallographica, Section B, 1974, 30, 2363-2371 |
| 9011149 | CIF | Al2.672 Ca0.82 H12 K O22 Si5.328 | P 1 21/m 1 | 9.865; 14.3; 8.668 90; 124.2; 90 | 1011.35 | Rinaldi, R.; Pluth, J. J.; Smith, J. V. Zeolites of the phillipsite family. Refinement of the crystal structure of phillipsite and harmotome Acta Crystallographica, Section B, 1974, 30, 2426-2433 |
| 9011150 | CIF | Al2.48 Ba Ca0.3 H12 O22 Si5.52 | P 1 21/m 1 | 9.879; 14.139; 8.693 90; 124.81; 90 | 996.944 | Rinaldi, R.; Pluth, J. J.; Smith, J. V. Zeolites of the phillipsite family. Refinement of the crystal structure of phillipsite and harmotome Acta Crystallographica, Section B, 1974, 30, 2426-2433 |
| 9011152 | CIF | H K O4 S | P b c a | 8.412; 9.8; 18.957 90; 90; 90 | 1562.77 | Cotton, F. A.; Frenz, B. A.; Hunter, D. L. The structure of potassium hydrogensulfate Note: y(O23), z(H1), x(H2) corrected Acta Crystallographica, Section B, 1975, 31, 302-304 |
| 9011153 | CIF | C H2 Na2 O4 | P 21 a b | 6.472; 10.724; 5.259 90; 90; 90 | 365.005 | Wu, K. K.; Brown, I. D. A neutron diffraction study of Na2CO3*H2O Acta Crystallographica, Section B, 1975, 31, 890-892 |
| 9011154 | CIF | H8 O12 P2 Zn3 | P n m a | 10.629; 18.339; 5.04 90; 90; 90 | 982.423 | Whitaker, A. The crystal structure of hopeite, Zn3(PO4)2*4H2O Acta Crystallographica, Section B, 1975, 31, 2026-2035 |
| 9011155 | CIF | O9 S2 Sb2 | P 41 21 2 | 6.59; 6.59; 17.04 90; 90; 90 | 740.015 | Mercier, R.; Douglade, J.; Theobald, F. R. Structure cristalline de Sb2O3*2SO3 Acta Crystallographica, Section B, 1975, 31, 2081-2085 |
| 9011156 | CIF | Cu4 Fe5 S8 | P 2 2 2 | 10.705; 10.734; 31.63 90; 90; 90 | 3634.52 | Rowland, J. F.; Hall, S. R. Haycockite, Cu4Fe5S8: a superstructure in the chalcopyrite series Acta Crystallographica, Section B, 1975, 31, 2105-2112 |
| 9011157 | CIF | Cu2.5 Fe0.5 S2 | P b c a | 10.95; 21.862; 10.95 90; 90; 90 | 2621.31 | Koto, K.; Morimoto, N. Superstructure investigation of bornite, Cu5FeS4, by the modified partial Patterson function Acta Crystallographica, Section B, 1975, 31, 2268-2273 |
| 9011158 | CIF | B5 H5 Na2 O11 | P n a 21 | 12.015; 6.518; 11.173 90; 90; 90 | 875 | Corazza, E.; Menchetti, S.; Sabelli, C. The crystal structure of nasinite, Na2[B5O8(OH)]*2H2O Acta Crystallographica, Section B, 1975, 31, 2405-2410 |
| 9011159 | CIF | F3 La | P -3 c 1 | 7.185; 7.185; 7.351 90; 90; 120 | 328.648 | Cheetham, A. K.; Fender, B. E. F.; Fuess, H.; Wright, A. F. A powder neutron diffraction study of lanthanum and cerium trifluorides Chem 5 (1966) 1466-1468 Acta Crystallographica, Section B, 1976, 32, 94-97 |
| 9011160 | CIF | Ce F3 | P -3 c 1 | 7.131; 7.131; 7.286 90; 90; 120 | 320.864 | Cheetham, A. K.; Fender, B. E. F.; Fuess, H.; Wright, A. F. A powder neutron diffraction study of lanthanum and cerium trifluorides Acta Crystallographica, Section B, 1976, 32, 94-97 |
| 9011161 | CIF | Ca9 H Mn O28 P7 | R 3 c :H | 10.438; 10.438; 37.15 90; 90; 120 | 3505.29 | Kostiner, E.; Rea, J. R. The crystal structure of manganese-whitlockite, Ca18Mn2H2(PO4)14 Acta Crystallographica, Section B, 1976, 32, 250-253 |
| 9011162 | CIF | B7 Ba3 H4 Na O20 Si2 | C 1 2/c 1 | 14.639; 8.466; 13.438 90; 114.21; 90 | 1518.95 | Ghose, S.; Wan, C.; Ulbrich, H. H. Structural chemistry of borosilicates. I. Garrelsite, NaBa3Si2B7O16(OH)4, a silicoborate with the pentaborate [B5O12]9- polyanion Acta Crystallographica, Section B, 1976, 32, 824-832 |
| 9011163 | CIF | Cu H12 N6 O6 | P n n m | 10.84; 23.693; 6.902 90; 90; 90 | 1772.66 | Morosin, B. The crystal structure of copper(II) tetraammine nitrate Acta Crystallographica, Section B, 1976, 32, 1237-1240 |
| 9011164 | CIF | Fe6.34 Mn O38 Pb0.83 Ti13.66 | R -3 :R | 9.172; 9.172; 9.172 69.02; 69.02; 69.02 | 648.885 | Grey, I. E.; Lloyd, D. J. The crystal structure of senaite Acta Crystallographica, Section B, 1976, 32, 1509-1513 |
| 9011165 | CIF | O15 S2 Sb6 | C c c 2 | 12.073; 19.023; 5.876 90; 90; 90 | 1349.51 | Bovin, J. O. The crystal structure of the antimony(III) oxide sulphate Sb6O7(SO4)2 Acta Crystallographica, Section B, 1976, 32, 1771-1777 |
| 9011166 | CIF | H K O4 S | P b c a | 8.429; 9.807; 18.976 90; 90; 90 | 1568.62 | Payan, F.; Haser, R. On the hydrogen bonding in potassium hydrogen sulphate. Comparison with a previous crystal structure determination Acta Crystallographica, Section B, 1976, 32, 1875-1879 |
| 9011167 | CIF | O12 S3 Sb2 | P 1 21/c 1 | 13.12; 4.75; 17.55 90; 126.3; 90 | 881.457 | Mercier, R.; Douglade, J.; Bernard, J. Structure cristalline de Sb2O3*3SO3 Acta Crystallographica, Section B, 1976, 32, 2787-2791 |
| 9011168 | CIF | H28 Mg3 N2 O24 P4 | P -1 | 10.728; 7.67; 6.702 97.87; 96.97; 104.74 | 521.225 | Catti, M.; Franchini-Angela M Hydrogen bonding in the crystalline state. Structure of Mg3(NH4)2(HPO4)4*8H2O (hannayite), and crystal-chemical relationships with schertelite and struvite Acta Crystallographica, Section B, 1976, 32, 2842-2848 |
| 9011169 | CIF | O2 Sb | P n a 21 | 5.456; 4.814; 11.787 90; 90; 90 | 309.588 | Thornton, G. A neutron diffraction study of a-Sb2O4 Acta Crystallographica, Section B, 1977, 33, 1271-1273 |
| 9011170 | CIF | B | R -3 m :H | 10.9251; 10.9251; 23.8143 90; 90; 120 | 2461.61 | Callmer, B. An accurate refinement of the beta-rhombohedral boron structure Acta Crystallographica, Section B, 1977, 33, 1951-1954 |
| 9011171 | CIF | As Cu2 H O5 | P 21/n 1 1 | 8.615; 8.24; 5.953 90; 90; 90 | 422.589 | Toman, K. The symmetry and crystal structure of olivenite Sample: alpha = .23 Acta Crystallographica, Section B, 1977, 33, 2628-2631 |
| 9011172 | CIF | As Cu2 H O5 | P 21/n 1 1 | 8.615; 8.24; 5.953 90; 90; 90 | 422.589 | Toman, K. The symmetry and crystal structure of olivenite Sample: alpha = .00 Acta Crystallographica, Section B, 1977, 33, 2628-2631 |
| 9011173 | CIF | Ca Cl F | P 4/n m m :2 | 3.894; 3.894; 6.818 90; 90; 90 | 103.383 | Liebich, W.; Nicollin, D. Refinement of the PbFCl types BaFI, BaFBr and CaFCl Note: matlockite structure Acta Crystallographica, Section B, 1977, 33, 2790-2794 |
| 9011174 | CIF | Ba Br F | P 4/n m m :2 | 4.508; 4.508; 7.441 90; 90; 90 | 151.216 | Liebich, W.; Nicollin, D. Refinement of the PbFCl types BaFI, BaFBr and CaFCl Note: matlockite structure Acta Crystallographica, Section B, 1977, 33, 2790-2794 |
| 9011175 | CIF | Ba F I | P 4/n m m :2 | 4.654; 4.654; 7.962 90; 90; 90 | 172.455 | Liebich, W.; Nicollin, D. Refinement of the PbFCl types BaFI, BaFBr and CaFCl Note: matlockite structure Acta Crystallographica, Section B, 1977, 33, 2790-2794 |
| 9011177 | CIF | Al1.42 Ba0.39 Ca0.01 K0.43 Na0.17 O8 Si2.58 | C 1 2/m 1 | 8.557; 13.04; 7.2 90; 115.69; 90 | 723.986 | De Pieri, R.; Quareni, S.; Hall, K. M. Refinement of the structures of low and high hyalophanes Sample: Low hyalophane Acta Crystallographica, Section B, 1977, 33, 3073-3076 |
| 9011178 | CIF | Al1.42 Ba0.39 Ca0.01 K0.43 Na0.17 O8 Si2.58 | C 1 2/m 1 | 8.556; 13.045; 7.189 90; 115.63; 90 | 723.436 | De Pieri, R.; Quareni, S.; Hall, K. M. Refinement of the structures of low and high hyalophanes Sample: High hyalophane Acta Crystallographica, Section B, 1977, 33, 3073-3076 |
| 9011179 | CIF | H5 Na2 O6 P | P b c a | 16.872; 10.359; 6.599 90; 90; 90 | 1153.35 | Catti, M.; Ferraris, G.; Franchini-Angela M The crystal structure of Na2HPO4*2H2O. Competition between coordination and hydrogen bonds Locality: synthetic Note: displacement parameters from ICSD, Biso(H1) invented Acta Crystallographica, Section B, 1977, 33, 3449-3452 |
| 9011180 | CIF | Al B O3 | R -3 c :H | 4.4638; 4.4638; 13.745 90; 90; 120 | 237.184 | Vegas, A.; Cano, F. H.; Garcia-Blanco S Refinement of aluminium orthoborate Sample: 0-50 degree reflections Note: calcite structure type Acta Crystallographica, Section B, 1977, 33, 3607-3609 |
| 9011181 | CIF | Al B O3 | R -3 c :H | 4.4638; 4.4638; 13.745 90; 90; 120 | 237.184 | Vegas, A.; Cano, F. H.; Garcia-Blanco S Refinement of aluminium orthoborate Sample: 0-50 degree reflections, Al3+, O- Note: calcite structure type Acta Crystallographica, Section B, 1977, 33, 3607-3609 |
| 9011182 | CIF | Al B O3 | R -3 c :H | 4.4638; 4.4638; 13.745 90; 90; 120 | 237.184 | Vegas, A.; Cano, F. H.; Garcia-Blanco S Refinement of aluminium orthoborate Sample: 0-30 degree reflections Note: calcite structure type Acta Crystallographica, Section B, 1977, 33, 3607-3609 |
| 9011183 | CIF | Al B O3 | R -3 c :H | 4.4638; 4.4638; 13.745 90; 90; 120 | 237.184 | Vegas, A.; Cano, F. H.; Garcia-Blanco S Refinement of aluminium orthoborate Sample: 0-30 degree reflections, Al3+, O- Note: calcite structure type Acta Crystallographica, Section B, 1977, 33, 3607-3609 |
| 9011184 | CIF | Al B O3 | R -3 c :H | 4.4638; 4.4638; 13.745 90; 90; 120 | 237.184 | Vegas, A.; Cano, F. H.; Garcia-Blanco S Refinement of aluminium orthoborate Sample: 30-50 degree reflections Note: calcite structure type Acta Crystallographica, Section B, 1977, 33, 3607-3609 |
| 9011185 | CIF | Al B O3 | R -3 c :H | 4.4638; 4.4638; 13.745 90; 90; 120 | 237.184 | Vegas, A.; Cano, F. H.; Garcia-Blanco S Refinement of aluminium orthoborate Sample: 30-50 degree reflections, Al3+, O- Note: calcite structure type Acta Crystallographica, Section B, 1977, 33, 3607-3609 |
| 9011186 | CIF | Ca I2 O6 | P 1 21/n 1 | 7.1432; 11.297; 7.2804 90; 106.35; 90 | 563.746 | Ghose, S.; Wan, C. The crystal structure of synthetic lautarite, Ca(IO3)2 Note: Biso(O1) corrected Acta Crystallographica, Section B, 1978, 34, 84-88 |
| 9011187 | CIF | Fe Na O8 Ti3 | C 1 2/m 1 | 12.267; 3.823; 6.483 90; 107.16; 90 | 290.497 | Ishiguro, T.; Tanaka, K.; Marumo, F.; Ismail, M. G. M. U.; Hirano, S.; Somiya, S. Freudenbergite Note: anisoU's from ICSD Acta Crystallographica, Section B, 1978, 34, 255-256 |
| 9011188 | CIF | As Cu0.86 H O5 Zn1.14 | P n n m | 8.5; 8.52; 5.99 90; 90; 90 | 433.796 | Toman, K. Ordering in olivenite-adamite solid solutions Acta Crystallographica, Section B, 1978, 34, 715-721 |
| 9011189 | CIF | Na2 O5 Si Ti | P 4/n m m :1 | 6.48; 6.48; 5.107 90; 90; 90 | 214.445 | Nyman, H.; O'Keeffe M; Bovin, J. O. Sodium titanium silicate, Na2TiSiO5 Note: anisoU's from ICSD Acta Crystallographica, Section B, 1978, 34, 905-906 |
| 9011190 | CIF | O3 Pb Ti | P 4 m m | 3.895; 3.895; 4.171 90; 90; 90 | 63.278 | Glazer, A. M.; Mabud, S. A. Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample: T = -183 C Acta Crystallographica, Section B, 1978, 34, 1065-1070 |
| 9011191 | CIF | O3 Pb Ti | P 4 m m | 3.899; 3.899; 4.167 90; 90; 90 | 63.348 | Glazer, A. M.; Mabud, S. A. Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample; T = -115 C Acta Crystallographica, Section B, 1978, 34, 1065-1070 |
| 9011192 | CIF | O3 Pb Ti | P 4 m m | 3.905; 3.905; 4.156 90; 90; 90 | 63.375 | Glazer, A. M.; Mabud, S. A. Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample: T = 25 C Acta Crystallographica, Section B, 1978, 34, 1065-1070 |
| 9011193 | CIF | O3 Pb Ti | P 4/m m m | 3.97; 3.97; 3.97 90; 90; 90 | 62.571 | Glazer, A. M.; Mabud, S. A. Powder profile refinement of lead zirconate titanate at several temperatures. II. Pure PbTiO3 Locality: synthetic Sample: T = 550 C Acta Crystallographica, Section B, 1978, 34, 1065-1070 |
| 9011194 | CIF | O5 Te U | P b c m | 5.363; 10.161; 7.862 90; 90; 90 | 428.427 | Loopstra, B. O.; Brandenburg, N. P. Uranyl selenite and uranyl tellurite Acta Crystallographica, Section B, 1978, 34, 1335-1337 |
| 9011195 | CIF | O5 Se U | P 1 21/m 1 | 5.408; 9.278; 4.2545 90; 93.45; 90 | 213.084 | Loopstra, B. O.; Brandenburg, N. P. Uranyl selenite and uranyl tellurite Acta Crystallographica, Section B, 1978, 34, 1335-1337 |
| 9011196 | CIF | Ca O10 S6 Sb10 | C 1 2/c 1 | 25.37; 5.654; 16.87 90; 117.58; 90 | 2144.89 | Nakai, I.; Nagashima, K.; Koto, K.; Morimoto, N. Crystal structure of oxide-chalcogenide. I.The crystal stucture of sarabauite CaSb10O10S6 Locality: Sarabau mine, Sarawak, Malaysia Acta Crystallographica, Section B, 1978, 34, 3569-3572 |
| 9011197 | CIF | Mn | P 41 3 2 | 6.315; 6.315; 6.315 90; 90; 90 | 251.837 | Shoemaker, C. B.; Shoemaker, D. P.; Hopkins, T. E.; Yindepit, S. Refinement of the structure of beta-manganese and of related phase in the Mn-Ni-Si system Acta Crystallographica, Section B, 1978, 34, 3573-3576 |
| 9011198 | CIF | Mn3.28 Ni1.01 Si0.71 | P 21 3 | 6.292; 6.292; 6.292 90; 90; 90 | 249.096 | Shoemaker, C. B.; Shoemaker, D. P.; Hopkins, T. E.; Yindepit, S. Refinement of the structure of beta-manganese and of related phase in the Mn-Ni-Si system Acta Crystallographica, Section B, 1978, 34, 3573-3576 |
| 9011199 | CIF | H12 K Mg O10 P | P m n 21 | 6.873; 6.16; 11.087 90; 90; 90 | 469.398 | Mathew, M.; Schroeder, L. W. Crystal structure of a struvite analogue, MgKPO4*6H2O Acta Crystallographica, Section B, 1979, 35, 11-13 |
| 9011200 | CIF | Al0.92 Ca0.43 Na0.07 O4 Si1.08 | I -1 | 8.183; 12.883; 14.186 93.38; 115.87; 90.82 | 1341.96 | Facchinelli, A.; Bruno, E.; Chiari, G. The structure of bytownite quenched from 1723 K Locality: satellite dyke, Traversella stock, Sesia Lanzo zone, Western Alps, Italy Sample: non-split model Note: T and O anisoB's from ICSD Acta Crystallographica, Section B, 1979, 35, 34-42 |
| 9011201 | CIF | Al7.76 Ca3.44 Na0.56 O32 Si8.24 | P -1 | 8.183; 12.883; 14.186 93.38; 115.87; 90.82 | 1341.96 | Facchinelli, A.; Bruno, E.; Chiari, G. The structure of bytownite quenched from 1723 K Locality: satellite dyke, Traversella stock, Sesia Lanzo zone, Western Alps, Italy Sample: BytQ, P-1 model Acta Crystallographica, Section B, 1979, 35, 34-42 |
| 9011202 | CIF | Bi54 Pb46 S127 | P 1 21/m 1 | 189.8; 4.09; 74.06 90; 11.93; 90 | 11884.4 | Matzat, E. Cannizzarite Locality: Vulcano, Italy Acta Crystallographica, Section B, 1979, 35, 133-136 |
| 9011203 | CIF | Bi4 Te3 | R -3 m :H | 4.451; 4.451; 41.888 90; 90; 120 | 718.68 | Yamana, K.; Kihara, K.; Matsumoto, T. Bismuth tellurides: BiTe and Bi4Te3 Note: anisoB's from ICSD Acta Crystallographica, Section B, 1979, 35, 147-149 |
| 9011204 | CIF | Bi Te | P -3 m 1 | 4.423; 4.423; 24.002 90; 90; 120 | 406.642 | Yamana, K.; Kihara, K.; Matsumoto, T. Bismuth tellurides: BiTe and Bi4Te3 Note: anisoB's from ICSD Acta Crystallographica, Section B, 1979, 35, 147-149 |
| 9011205 | CIF | O5 Sb2 | C 1 2/c 1 | 12.646; 4.782; 5.4247 90; 103.91; 90 | 318.429 | Jansen, M. Die kristallstruktur von antimon(V)-oxid Acta Crystallographica, Section B, 1979, 35, 539-542 |
| 9011206 | CIF | H O5 Pb V Zn | P n m a | 7.593; 6.057; 9.416 90; 90; 90 | 433.049 | Hawthorne, F. C.; Faggiani, R. Refinement of the structure of descloizite Note: anisoB's from ICSD Acta Crystallographica, Section B, 1979, 35, 717-720 |
| 9011207 | CIF | H12 Mg N2 O12 | P 1 21/c 1 | 6.194; 12.707; 6.6 90; 92.99; 90 | 518.76 | Braibanti, A.; Tiripicchio, A.; Lanfredi, A. M. M.; Bigoli, F. The crystal structures of nitrates of divalent hexaquocations. II. Hexaquomagnesium nitrate Note: z(Wat2) corrected Acta Crystallographica, Section B, 1979, 35, 354-361 |
| 9011208 | CIF | O21 S6 Sb2 | P -1 | 6.644; 12.39; 9.678 92.69; 82.29; 96.88 | 783.412 | Douglade, J.; Mercier, R. Structure cristalline du disulfate d'antimoine(III) Sb2(S2O7)3 Acta Crystallographica, Section B, 1979, 35, 1062-1067 |
| 9011209 | CIF | H10 O10 S V | P 1 21/c 1 | 6.976; 9.716; 12.902 90; 110.9; 90 | 816.945 | Tachez, M.; Theobald, F. R.; Watson, K. J.; Mercier, R. Redetermination de la structure du sulfate de vanadyle pentahydrate VOSO4*5H2O Locality: synthetic Note: anisoB's from ICSD Acta Crystallographica, Section B, 1979, 35, 1545-1550 |
| 9011210 | CIF | Al2 O30 P2 U3 | P 1 21/a 1 | 13.836; 20.918; 9.428 90; 112.44; 90 | 2522.05 | Piret, P.; Piret-Meunier J; Declercq, J. P. Structure of phuralumite Acta Crystallographica, Section B, 1979, 35, 1880-1882 |
| 9011211 | CIF | Cu Fe0.5 S4 Sn1.5 | I 41/a :1 | 7.305; 7.305; 10.33 90; 90; 90 | 551.24 | Jumas, J. C.; Philippot, E.; Maurin, M. Structure du rhodostannite synthetique Acta Crystallographica, Section B, 1979, 35, 2195-2197 |
| 9011213 | CIF | Bi2 Hg S4 | C 1 2/m 1 | 14.17; 4.06; 13.99 90; 118.27; 90 | 708.85 | Mumme, W. G.; Watts, J. A. HgBi2S4: Crystal structure and relationship with the pavonite homologous series Locality: synthetic Acta Crystallographica, Section B, 1980, 36, 1300-1304 |
| 9011214 | CIF | As O4 Sb | P 1 21/m 1 | 4.794; 6.925; 5.307 90; 93.55; 90 | 175.846 | Jones, P. G.; Sheldrick, G. M.; Schwarzmann, E. Antimony(III) arsenic(V) oxide Acta Crystallographica, Section B, 1980, 36, 1923-1925 |
| 9011215 | CIF | C4 H4 Cu Na2 O10 | P -1 | 3.583; 9.649; 7.549 109.07; 76.38; 103.32 | 236.358 | Chananont, P.; Nixon, P. E.; Waters, J. M.; Water, T. N. The structure of disodium catena-bis(mu-oxalato)-cuprate(II) dihydrate Acta Crystallographica, Section B, 1980, 36, 2145-2147 |
| 9011216 | CIF | O2 Pb | P 42/m n m | 4.9578; 4.9578; 3.3878 90; 90; 90 | 83.271 | D'Antonio P; Santoro, A. Powder neutron diffraction study of chemically prepared B-lead dioxide Acta Crystallographica, Section B, 1980, 36, 2394-2397 |
| 9011217 | CIF | O Sn | P 4/n m m :1 | 3.8029; 3.8029; 4.8382 90; 90; 90 | 69.97 | Pannetier, J.; Denes, G. Tin(II) oxide: structure refinement and thermal expansion Acta Crystallographica, Section B, 1980, 36, 2763-2765 |
| 9011218 | CIF | N2 | P m -3 n | 6.164; 6.164; 6.164 90; 90; 90 | 234.201 | Cromer, D. T.; Mills, R. L.; Schiferl, D.; Schwalbe, L. A. The structure of N2 at 49 kbar and 299 K Sample: at T = 299 K and P = 4.9 GPa Note: model #4 Acta Crystallographica, Section B, 1981, 37, 8-11 |
| 9011219 | CIF | Br1.012 Ca4.922 O11.965 P2.896 | P 63/m | 9.761; 9.761; 6.739 90; 90; 120 | 556.051 | Elliott, J. C.; Dykes, E.; Mackie, P. E. Structure of bromapatite and the radius of the bromide ion Acta Crystallographica, Section B, 1981, 37, 435-438 |
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