Ti 1.0000000000000000 2.9453374042777334 0.0000000000000000 -0.0000000000000000 -1.4726687021388667 2.5507370148210344 0.0000000000000000 0.0000000000000000 0.0000000000000000 4.6874080315506932 Ti 2 Selective dynamics Cartesian -0.0000000147266875 1.7004913517164797 1.1718520078876733 T T T 1.4726686874121797 0.8502456801094682 3.5155560236630188 T T T