B N 1.0000000000000000 2.5039998678570505 0.0000000000000000 -0.0000000000000000 -1.2519999339285253 2.1685274966370827 -0.0000000000000000 0.0000000000000000 0.0000000000000000 7.7824999999999989 B N 2 2 Selective dynamics Cartesian -0.0000000125199994 1.4456850049864800 1.9456249999999995 T T T 1.2519999214085262 0.7228425061074528 5.8368749999999991 T T T -0.0000000125199994 1.4456850049864800 5.8368749999999991 T T T 1.2519999214085262 0.7228425061074528 1.9456249999999995 T T T