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 #035 at P = 4.34 GPa, T = 660 K
_database_code_amcsd 0002558
6.9534 8.6641 6.4730 90 113.361 90 A2/a
atom    x    y    z
Ca    .25 .165    0
Ti    1/2    0  1/2
Si    3/4 .194    0
O1    3/4 .057  1/2
O3   .917 .068 .171
O5   .391 .211 .389