Si 1.0000000000000000 2.1441872739103860 0.0000000000000001 0.0000000000000000 -1.0720936369551930 1.8569206496776969 0.0000000000000000 0.0000000000000000 0.0000000000000000 2.0988350042945343 Si 1 Selective dynamics Cartesian 0.0000000000000000 0.0000000000000000 0.0000000000000000 T T T