Ti 1.0000000000000000 2.9510005622489275 0.0000000000000000 0.0000000000000000 -1.4755002811244637 2.5556414534897329 -0.0000000000000000 0.0000000000000000 -0.0000000000000000 4.6861810559449486 Ti 2 Selective dynamics Cartesian -0.0000000147550030 1.7037609775119604 1.1715452639862372 T T T 1.4755002663694612 0.8518804930153828 3.5146357919587112 T T T