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Parwelite |
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Marsh R E, Schomaker V |
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Inorganic Chemistry 18 (1979) 2331-2336 |
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Some incorrect space groups in Inorganic Chemistry, Volume 16 |
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Locality: Langban, Sweden |
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_database_code_amcsd 0012688 |
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10.048 19.418 9.735 90 95.83 90 A2/a |
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atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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MnM1 .5 0 .5 .81 .0119 .0217 .0131 .0017 -.0016 -.0028 |
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MgM1 .5 0 .5 .19 .0119 .0217 .0131 .0017 -.0016 -.0028 |
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MnM2 0 0 0 .90 .0100 .0213 .0133 .0002 -.0006 -.0040 |
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MgM2 0 0 0 .10 .0100 .0213 .0133 .0002 -.0006 -.0040 |
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MnM3 .25 .11018 .5 .90 .0197 .0143 .0175 0 -.0088 0 |
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MgM3 .25 .11018 .5 .10 .0197 .0143 .0175 0 -.0088 0 |
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MnM4 .75 .14234 .5 .95 .0116 .0164 .0138 0 -.0014 0 |
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MgM4 .75 .14234 .5 .05 .0116 .0164 .0138 0 -.0014 0 |
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MnM56 .49343 .10337 .74725 .84 .0111 .0140 .0129 -.0002 -.0023 -.0007 |
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MgM56 .49343 .10337 .74725 .16 .0111 .0140 .0129 -.0002 -.0023 -.0007 |
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MnM7 .25 .13091 0 .93 .0107 .0198 .0123 0 -.0021 0 |
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MgM7 .25 .13091 0 .07 .0107 .0198 .0123 0 -.0021 0 |
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MnM8 .75 .12603 0 .83 .0181 .0147 .0160 0 -.0056 0 |
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MgM8 .75 .12603 0 .17 .0181 .0147 .0160 0 -.0056 0 |
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MnM910 .51209 .25461 .46741 .58 .0117 .0152 .0121 .0010 -.0028 -.0003 |
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MgM910 .51209 .25461 .46741 .42 .0117 .0152 .0121 .0010 -.0028 -.0003 |
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Sb12 .24933 -.00460 .24947 .0098 .0128 .0103 .0004 -.0007 .0001 |
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As12 .18359 .25483 .29369 .0139 .0171 .0135 -.0001 -.0021 .0006 |
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Si12 .49334 .12043 .25398 .0092 .0140 .0106 -.0001 -.0017 .0002 |
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O1 .3894 .0668 .3248 1.01 |
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O2 .8458 .0688 .3789 .92 |
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O3 .1385 .0353 .3818 .92 |
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O4 .3457 .0614 .8803 1.04 |
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O5 .6399 .0432 .8842 1.19 |
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O6 .8971 .0722 .8206 1.06 |
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O7 .5617 .1631 .3836 1.16 |
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O8 .8259 .2411 .3785 1.37 |
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O9 .1454 .1779 .3588 1.39 |
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O10 .5750 .1896 .8581 1.23 |
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O11 .8289 .2179 .8709 1.46 |
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O12 .0891 .1629 .8692 .98 |
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