B N 1.0000000000000000 2.4978644621764357 0.0000000000000000 -0.0000000000000000 -1.2489322310882178 2.1632140794551464 0.0000000000000000 0.0000000000000000 -0.0000000000000000 7.8848999999999991 B N 2 2 Selective dynamics Cartesian 0.0000000000000000 -0.0000000000000000 1.9712250000000000 T T T -0.0000000000000000 0.0000000000000000 5.9136749999999996 T T T 0.0000000000000000 1.4421427196367644 1.9712250000000000 T T T 1.2489322310882183 0.7210713598183823 5.9136749999999996 T T T