American Mineralogist Crystal Structure Database

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Titanite
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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 #006 at P = 1.23 GPa, T = 628 K
_database_code_amcsd 0002529
7.0411 8.7106 6.5441 90 113.682 90 P2_1/a
atom    x    y    z
Ca   .265 .915 .739
Ti   .512 .746 .244
Si   .728 .935 .756
O1   .736 .818 .249
O2   .902 .813 .918
O3   .367 .944 .124
O4   .920 .316 .442
O5   .373 .462 .672
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