American Mineralogist Crystal Structure Database

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Ullmannite
Download hom/ullmannite.pdf
Bayliss P
American Mineralogist 62 (1977) 369-373
Crystal structure refinement of arsenian ullmannite
approximate cubic structure
_database_code_amcsd 0000576
5.886 5.886 5.886 90 90 90 P2_13
atom      x      y      z occ Biso
Ni   -.0171 -.0171 -.0171 .97  .65
Co   -.0171 -.0171 -.0171 .03  .65
S     .3817  .3817  .3817 .98  .80
As    .3817  .3817  .3817 .02  .80
Sb    .6256  .6256  .6256 .91  .62
As    .6256  .6256  .6256 .08  .62
Bi    .6256  .6256  .6256 .01  .62
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