Katoite
Lager G A, Von Dreele R B
American Mineralogist 81 (1996) 1097-1104
Neutron powder diffraction study of hydrogarnet to 9.0 GPa
P = 0.0001 GPa
_database_code_amcsd 0001827
12.5695 12.5695 12.5695 90 90 90 Ia-3d
atom     x     y     z Uiso
Ca    .125     0   .25 .006
Al       0     0    .5 .016
H    .1517 .0919 .7939 .031
O    .0278 .0525 .6392 .012