C 1.0000000000000000 4.3990814717690592 -0.0000000000000000 -0.0000000000000000 0.0000000000000000 4.3990814717690592 -0.0000000000000000 0.0000000000000000 -0.0000000000000000 4.3990814717690592 C 8 Selective dynamics Cartesian 0.5498851839711322 0.5498851839711322 0.5498851839711322 T T T 1.6496555519133962 3.8491962877979251 2.7494259198556610 T T T 3.8491962877979251 2.7494259198556610 1.6496555519133966 T T T 2.7494259198556610 1.6496555519133964 3.8491962877979251 T T T 3.8491962877979251 1.6496555519133964 0.5498851839711320 T T T 2.7494259198556610 2.7494259198556610 2.7494259198556610 T T T 1.6496555519133962 0.5498851839711322 3.8491962877979251 T T T 0.5498851839711322 3.8491962877979251 1.6496555519133964 T T T