Ti 1.0000000000000000 2.9527473403935391 0.0000000000000000 0.0000000000000000 -1.4763736701967696 2.5571542077377414 0.0000000000000000 0.0000000000000000 -0.0000000000000000 4.6808080501943623 Ti 2 Selective dynamics Cartesian -0.0000000147637372 1.7047694803490079 1.1702020125485906 T T T 1.4763736554330338 0.8523847444364280 3.5106060376457719 T T T