Cd 1.0000000000000000 2.9798089799877343 -0.0000000000000000 0.0000000000000000 -1.4899044899938672 2.5805902750943752 0.0000000000000000 0.0000000000000000 -0.0000000000000000 4.8308514986007243 Cd 2 Selective dynamics Cartesian -0.0000000148990452 1.7203935253315517 1.2077128746501808 T T T 1.4899044750948225 0.8601967669667597 3.6231386239505432 T T T