Si 1.0000000000000000 2.7147182672257473 -0.0000000000000000 0.0000000000000000 -1.3573591336128736 2.3510149835351695 0.0000000000000000 0.0000000000000000 -0.0000000000000000 4.4621086066227198 Si 2 Selective dynamics Cartesian -0.0000000135735918 1.5673433301934965 1.1155271516556799 T T T 1.3573591200392823 0.7836716690151067 3.3465814549670405 T T T