CBr2s.mol -ISIS- 3D 3 2 0 0 0 0 0 0 0 0 0 -0.6919 -0.8006 0.0001 C 0 0 0 0 0 1.2371 -1.0030 0.0000 BR 0 0 0 0 0 -1.1728 1.0768 0.0000 BR 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0