C Pt 1.0000000000000000 3.0187399917513247 0.0000000000000000 -0.0000000000000000 -1.5093699958756623 2.6143055202766736 0.0000000000000000 0.0000000000000000 -0.0000000000000000 2.9982864794374673 C Pt 1 1 Selective dynamics Cartesian 0.0000000000000000 0.0000000000000000 0.0000000000000000 T T T -0.0000000000000004 1.7428703468511153 1.4991432397187336 T T T