Cd S 1.0000000000000000 2.1516296047799868 0.0000000000000000 0.0000000000000000 0.0000000000000000 3.3973941767795353 0.0000000000000000 0.0000000000000000 0.0000000000000000 4.9740020491842349 Cd S 2 2 Selective dynamics Cartesian 0.0000000000000000 0.0000000000000000 4.3662781641975767 T T T 1.0758148023899927 1.6986970883897676 0.6077238849866593 T T T 0.0000000000000000 1.6986970883897676 2.7775114003170542 T T T 1.0758148023899927 0.0000000000000000 2.1964906488671878 T T T