CH2ClBr.mol -ISIS- 3D 5 4 0 0 0 0 0 0 0 0 0 0.5554 0.0230 -1.0001 C 0 0 0 0 0 1.6511 0.0520 -0.9806 H 0 0 0 0 0 -0.0605 1.7006 -1.1786 CL 0 0 0 0 0 0.1552 -0.5828 -1.8217 H 0 0 0 0 0 -0.0165 -0.8601 0.6778 BR 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