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 #034 at P = 4.89 GPa, T = 656 K
_database_code_amcsd 0002557
6.9443 8.6582 6.4621 90 113.327 90 A2/a
atom    x    y    z
Ca    .25 .164    0
Ti    1/2    0  1/2
Si    3/4 .192    0
O1    3/4 .056  1/2
O3   .919 .069 .178
O5   .394 .218 .388