C 1.0000000000000000 2.4555707196014813 0.0000000000000000 0.0000000000000000 -1.2277853598007407 2.1265866239641174 -0.0000000000000000 0.0000000000000000 -0.0000000000000000 3.6683584739665922 C 2 Selective dynamics Cartesian -0.0000000122778537 1.4177244230647001 0.0000000000000000 T T T 1.2277853475228868 0.7088622150766613 0.0000000000000000 T T T