Si 1.0000000000000000 2.7873214409110698 -0.0000000000000000 0.0000000000000000 -1.3936607204555349 2.4138911763420321 0.0000000000000000 -0.0000000000000000 -0.0000000000000000 4.8564581844083134 Si 2 Selective dynamics Cartesian -0.0000000139366075 1.6092607922743247 1.2141145461020784 T T T 1.3936607065189279 0.8046304001603146 3.6423436383062349 T T T