B N 1.0000000000000000 2.5155098367654949 0.0000000000000000 -0.0000000000000000 -1.2577549183827474 2.1784954221085644 0.0000000000000000 0.0000000000000000 0.0000000000000000 4.1078103620225166 B N 2 2 Selective dynamics Cartesian -0.0000000125775495 1.4523302886673615 2.0539051810181679 T T T 1.2577549058051984 0.7261651479645063 0.0000000000069102 T T T -0.0000000125775495 1.4523302886673615 3.5943340667627948 T T T 1.2577549058051984 0.7261651479645063 1.5404288857515378 T T T