CH3CN.mol 6 5 0 0 0 0 0 0 0 0 0 -1.2872 -0.0002 -0.0005 C 0 0 0 0 0 0.1714 -0.0003 -0.0008 C 0 0 0 0 0 -1.6706 1.0342 0.0001 H 0 0 0 0 0 -1.6714 -0.5168 -0.8960 H 0 0 0 0 0 -1.6702 -0.5174 0.8953 H 0 0 0 0 0 1.3404 0.0003 0.0012 N 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 1 5 1 0 0 0 2 6 3 0 0 0