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Nissonite |
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Groat L A, Hawthorne F C |
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American Mineralogist 75 (1990) 1170-1175 |
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The crystal structure of nissonite |
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_database_code_amcsd 0001329 |
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22.523 5.015 10.506 90 99.62 90 C2/c |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Cu .24534 .1541 .36677 0.086 0.131 0.055 -0.023 -0.033 -0.016 |
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P .3437 .1768 .2264 0.061 0.115 0.056 0.013 -0.043 0.002 |
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Mg .1226 .1547 .4673 0.049 0.108 0.044 -0.010 -0.040 -0.001 |
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O1 .3631 .103 .3702 0.177 0.167 0.059 0.059 -0.063 0.013 |
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O2 .2770 .296 .2161 0.058 0.123 0.088 0.034 -0.023 0.005 |
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O3 .3846 .388 .1833 0.083 0.129 0.122 -0.005 -0.019 0.035 |
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O4 .3405 -.072 .1447 0.085 0.169 0.123 0.008 -0.038 -0.036 |
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Oh .2136 .055 .5211 .007 |
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OW1 .0866 -.138 .5790 0.127 0.176 0.131 -0.047 -0.047 -0.008 |
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OW2 .0359 .288 .4132 0.059 0.355 0.263 0 -0.055 0 |
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OW3 .5 .201 .25 0.090 0.292 0.388 0 -0.134 0 |
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H .245 0 .578 .015 |
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HW1a .105 0 .598 .015 |
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HW1b .057 .015 .639 .015 |
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HW2a .023 .434 .355 .015 |
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HW2b 0 .237 .415 .015 |
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HW3 .460 .268 .227 .015 |
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