Titanite
Kunz M, Arlt T, Stolz J
American Mineralogist 85 (2000) 1465-1473
In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure
and high temperature
Sample #029 at P = 4.80 GPa, T = 522 K
_database_code_amcsd 0002552
6.9409 8.6532 6.4551 90 113.331 90 A2/a
atom    x    y    z
Ca    .25 .160    0
Ti    1/2    0  1/2
Si    3/4 .194    0
O1    3/4 .049  1/2
O3   .920 .073 .177
O5   .388 .216 .381