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 #003 at P = 0.71 GPa, T = 483 K
_database_code_amcsd 0002526
7.0494 8.7102 6.5484 90 113.742 90 P2_1/a
atom    x    y    z
Ca   .255 .919 .757
Ti   .499 .748 .256
Si   .735 .929 .752
O1   .755 .806 .251
O2   .920 .817 .923
O3   .386 .947 .162
O4   .918 .308 .438
O5   .370 .468 .656