Ti 1.0000000000000000 2.9304937210413340 0.0000000000000000 -0.0000000000000000 -1.4652468605206670 2.5378820080525841 -0.0000000000000000 -0.0000000000000000 -0.0000000000000000 4.6782861036853420 Ti 2 Selective dynamics Cartesian -0.0000000146524691 1.6919213471613295 1.1695715259213353 T T T 1.4652468458681986 0.8459606778104684 3.5087145777640067 T T T