Ti 1.0000000000000000 2.9453373891479453 -0.0000000000000000 0.0000000000000000 -1.4726686945739726 2.5507370017182547 -0.0000000000000000 0.0000000000000000 -0.0000000000000000 4.6874080412528549 Ti 2 Selective dynamics Cartesian -0.0000000147266876 1.7004913429812922 1.1718520103132137 T T T 1.4726686798472861 0.8502456757418750 3.5155560309396408 T T T