Pyroaurite
Ingram L, Taylor H F W
Mineralogical Magazine 36 (1967) 465-479
The crystal structures of sjoegrenite and pyroaurite
Locality: Sweden
_database_code_amcsd 0014447
3.13 3.13 23.49 90 90 120 R3m
atom     x     y      z   occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mg       0     0      0   .75   .004   .004   .004      0      0      0
Fe       0     0      0   .25   .004   .004   .004      0      0      0
C        0     0    1/6  .125    .02    .02    .02      0      0      0
O1    .235 -.235    1/6  .125   .052   .052   .016   .042      0      0
Wat1  .235 -.235    1/6   1/6   .052   .052   .016   .042      0      0
O2     2/3   1/3 -.0466         .012   .012   .016      0      0      0
O3     1/3   2/3  .0446         .012   .012   .016      0      0      0
H1     2/3   1/3 -.0758         .020   .020   .020      0      0      0
H2     1/3   2/3  .0758         .020   .020   .020      0      0      0