Pyrope
Pavese A, Artioli G, Prencipe M
American Mineralogist 80 (1995) 457-464
X-ray single-crystal diffraction study of pyrope in the temperature range
30-973 K
T = 300 K
_database_code_amcsd 0001741
11.4544 11.4544 11.4544 90 90 90 Ia-3d
atom      x      y      z  B(1,1)  B(2,2)  B(3,3)   B(1,2)   B(1,3)   B(2,3)
Si     .375      0    .25 .000410 .000550 .000550        0        0        0
Al        0      0      0 .000520 .000520 .000520 -.000002 -.000002 -.000002
Mg        0    .25   .125 .001622 .001622 .000738  .000483        0        0
O    .03295 .05032 .65334 .000757 .000939 .000589  .000133 -.000174 -.000029