Titanite
Troitzsch U, Ellis D J, Thompson J, Fitz-Gerald J
European Journal of Mineralogy 11 (1999) 955-965
Crystal structural changes in titanite along the join TiO-AlF
Sample: AlF100
_database_code_amcsd 0006806
6.9157 8.5076 6.4391 90 114.683 90 A2/a
atom      x     y     z Biso
Ca      .25 .1642     0 1.34
Aloct    .5     0    .5 1.40
Si      .75 .1867     0 1.03
F1      .75 .0694    .5  .56
O2    .9048 .0662 .1877  .56
O3    .3898 .2020 .4054  .56