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Adamantane |
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Donohue J, Goodman S H |
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Acta Crystallographica 22 (1967) 352-354 |
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The crystal structure of adamantane: |
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An example of a false minimum in least squares |
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Note: low temperature phase |
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Locality: synthetic |
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_database_code_amcsd 0009308 |
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6.60 6.60 8.81 90 90 90 P-42_1c |
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atom x y z |
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C1 -.0296 .1870 .0999 |
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C2 .1580 .2187 -.0009 |
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C3 0 0 .2006 |
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H1 -.054 .317 .164 |
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H2 .141 .017 .267 |
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H3 .290 .237 .070 |
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H4 .129 .354 -.064 |
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Skutterudite |
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Mandel N, Donohue J |
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Acta Crystallographica B27 (1971) 2288-2289 |
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The refinement of the crystal structure of skutterudite, CoAs3 |
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Locality: Bou-Azzer, Morocco |
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_database_code_amcsd 0009417 |
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8.195 8.195 8.195 90 90 90 Im3 |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Co .25 .25 .25 .87 .0045 .0045 .0045 .0004 .0004 .0004 |
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Fe .25 .25 .25 .11 .0045 .0045 .0045 .0004 .0004 .0004 |
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Ni .25 .25 .25 .13 .0045 .0045 .0045 .0004 .0004 .0004 |
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As 0 .3431 .1503 .0027 .0035 .0032 0 0 .0002 |
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Gallium |
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Sharma B D, Donohue J |
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Zeitschrift fur Kristallographie 117 (1962) 293-300 |
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A refinement of the crystal structure of gallium |
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_database_code_amcsd 0010597 |
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4.523 7.661 4.524 90 90 90 Cmca |
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atom x y z Biso |
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Ga 0 .1549 .0810 .48 |
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Sulfur |
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Donohue J, Caron A, Goldish E |
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Journal of the American Chemical Society 83 (1961) 3748-3751 |
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The crystal and molecular structure of S6 (sulfur-6) |
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Locality: synthetic |
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_database_code_amcsd 0014103 |
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10.818 10.818 4.280 90 90 120 R-3 |
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atom x y z Biso |
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S .1454 .1882 .1055 -.89 |
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