American Mineralogist Crystal Structure Database

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Reppiaite
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Barbier J
 
European Journal of Mineralogy 8 (1996) 77-84
Crystal structure of Ni5(AsO4)2(OH)4 and its comparison to other
M5(XO4)2(OH)4 compounds
_database_code_amcsd 0006613
9.291 9.008 5.149 90 98.70 90 C2/m
atom      x      y       z   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
Ni1      .5 .31952       0 .00603 .00710 .00766 .00447       0  .00012       0
Ni2      .5 .15535      .5 .00584 .00674 .00701 .00516       0  .00094       0
Ni3       0      0      .5 .00623 .00830 .00625 .00534       0  .00048       0
As   .68716      0  .05532 .00465 .00422 .00702 .00393       0  .00012       0
O1    .3690  .1521   .1252  .0078 .00874 .00834 .00728 -.00133  .00016 -.00222
O2    .8736      0   .1139  .0067 .00470 .00994 .00627       0 -.00079       0
O3    .6305      0   .3532  .0070 .00680 .00898 .00701       0  .00223       0
OH4   .3957  .3272  -.3628  .0064 .00690 .00736 .00625 -.00027  .00050  .00080
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