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Oxammite |
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Taylor J C, Sabine T M |
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Acta Crystallographica B28 (1972) 3340-3351 |
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Isotope and bonding effects in ammonium oxalate monohydrate, determined by the |
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combined use of neutron and X-ray diffraction analyses |
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Locality: synthetic |
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Sample: HOX(XR) |
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_database_code_amcsd 0009458 |
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8.035 10.309 3.795 90 90 90 P2_12_12 |
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atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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N .3876 .2264 .4249 .0085 .0049 .0377 -.0013 .0005 -.0011 |
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H1 .4749 .2657 .2902 4 |
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H2 .4248 .1519 .5425 4 |
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H3 .2912 .2007 .2882 4 |
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H4 .3553 .2935 .5810 4 |
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C .0917 .0230 .0707 .0060 .0052 .0284 -.0010 -.0028 -.0003 |
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O1 .2021 -.0591 .1416 .0060 .0048 .0628 .0011 .0000 .0054 |
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O2 .1178 .1406 .002 .0074 .0038 .0643 -.0013 -.0037 .0034 |
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Ow 0 .5 .1860 .0073 .0060 .0516 -.0006 0 0 |
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Hw .0841 .4829 .0467 4 |
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