Si 1.0000000000000000 2.7204524970857964 0.0000000000000001 0.0000000000000000 -1.3602262485428982 2.3559809722651104 -0.0000000000000000 -0.0000000000000000 0.0000000000000000 1.9036698017050375 Si 1 Selective dynamics Cartesian 0.0000000000000000 0.0000000000000000 0.0000000000000000 T T T