Ca(Ti,Zr)OGeO4 Ellemann-Olesen R, Malcherek T American Mineralogist 90 (2005) 687-694 Temperature and composition dependence of structural phase transitions in Ca(TixZr1-x)OGeO4. Sample: Ti10, triclinically distorted titanite structure _database_code_amcsd 0003766 7.38422 9.12413 6.76031 88.765 112.877 91.297 A-1 atom x y z occ Uiso Ca .2289 .6666 .5071 .025 Ti1 .5 .5 0 .114 .012 Zr1 .5 .5 0 .885 .012 Ti2 0 .5 0 .114 .013 Zr2 0 .5 0 .885 .013 Ge .7481 .6811 .4959 .016 O1 .7492 .5831 .9941 .008 O2A .9176 .5667 .6739 .008 O2B .6083 .5515 .3273 .008 O3A .3824 .7061 .8947 .008 O3B .1111 .6982 .1128 .008