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Bieberite |
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Kellersohn T, Delaplane R G, Olovsson I |
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Zeitschrift fur Naturforschung B46 (1991) 1635-1640 |
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Disorder of a trigonally planar coordinated water molecule in cobalt sulfate |
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heptahydrate, CoSO4*7D2O |
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_database_code_amcsd 0015843 |
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14.048 6.4941 10.925 90 105.232 90 P2_1/c |
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atom x y z occ Uiso |
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Co1 0 0 0 .0211 |
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Co2 .5 .5 0 .0208 |
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S .22675 .47241 .17647 .0196 |
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O1 .20467 .47122 .03652 .0289 |
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O2 .13814 .54217 .21371 .0315 |
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O3 .30951 .61333 .22694 .0327 |
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O4 .25251 .26351 .22663 .0309 |
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O5a .1229 .4045 .4434 .5 .031 |
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O5b .0992 .3642 .4231 .5 .041 |
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O6 .09718 .96137 .18159 .0362 |
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O7 .02906 .79182 .43215 .0337 |
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O8 .47956 .44943 .17767 .0306 |
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O9 .43148 .27931 .44138 .0329 |
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O10 .35744 .85773 .44239 .0339 |
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O11 .36435 .00542 .11696 .0338 |
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D51 .138 .293 .455 .040 |
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D52 .117 .432 .369 .053 |
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D61 .114 .850 .199 .059 |
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D62 .145 .035 .209 .046 |
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D71 .077 .866 .462 .031 |
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D72 -.010 .859 .389 .060 |
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D81 .428 .514 .187 .050 |
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D82 .522 .474 .225 .058 |
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D91 .380 .281 .377 .071 |
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D92 .420 .340 .486 .065 |
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D101 .307 .923 .455 .063 |
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D102 .341 .792 .379 .061 |
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D111 .324 .067 .139 .043 |
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D112 .347 -.088 .096 .052 |
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