Andradite
Galuskina I O, Galuskin E V, Dzierzanowski P, Armbruster T, Kozanecki M
American Mineralogist 90 (2005) 1688-1692
A natural scandian garnet
_database_code_amcsd 0003948
12.331 12.331 12.331 90 90 90 Ia-3d
atom      x     y     z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CaA    .875     0   .75  .99 .0174  .0131  .0195  .0195      0      0  .0047
MgA    .875     0   .75  .01 .0174  .0131  .0195  .0195      0      0  .0047
Fe3+B     0     0     0 .332 .0119  .0119  .0119  .0119  .0006  .0006  .0006
ZrB       0     0     0 .292 .0119  .0119  .0119  .0119  .0006  .0006  .0006
Ti4+B     0     0     0 .147 .0119  .0119  .0119  .0119  .0006  .0006  .0006
ScB       0     0     0 .077 .0119  .0119  .0119  .0119  .0006  .0006  .0006
CrB       0     0     0 .076 .0119  .0119  .0119  .0119  .0006  .0006  .0006
MgB       0     0     0 .047 .0119  .0119  .0119  .0119  .0006  .0006  .0006
Fe2+B     0     0     0 .020 .0119  .0119  .0119  .0119  .0006  .0006  .0006
HfB       0     0     0 .004 .0119  .0119  .0119  .0119  .0006  .0006  .0006
VB        0     0     0 .002 .0119  .0119  .0119  .0119  .0006  .0006  .0006
SiT    .125     0   .75 .633 .0100  .0069  .0115  .0115      0      0      0
AlT    .125     0   .75 .140 .0100  .0069  .0115  .0115      0      0      0
Ti4+T  .125     0   .75 .120 .0100  .0069  .0115  .0115      0      0      0
Fe3+T  .125     0   .75 .107 .0100  .0069  .0115  .0115      0      0      0
O     .0366 .0493 .6539      .0194  .0210  .0132  .0241 -.0027  .0057 -.0015