C Pt 1.0000000000000000 2.7494249367878458 0.0000000000000000 0.0000000000000000 -0.0000000000000000 2.7494249367878458 0.0000000000000000 0.0000000000000000 0.0000000000000000 2.7494249367878458 C Pt 1 1 Selective dynamics Cartesian 0.0000000000000000 0.0000000000000000 0.0000000000000000 T T T 1.3747124683939229 1.3747124683939229 1.3747124683939229 T T T