Ti 1.0000000000000000 2.9506912724209875 0.0000000000000000 0.0000000000000000 -1.4753456362104937 2.5553736006416043 0.0000000000000000 0.0000000000000000 0.0000000000000000 4.6878818311223069 Ti 2 Selective dynamics Cartesian -0.0000000147534573 1.7035824089456486 1.1719704577805763 T T T 1.4753456214570380 0.8517912087317804 3.5159113733417295 T T T