BCl.mol -ISIS- 3D 2 1 0 0 0 0 0 0 0 0 0 -1.3306 0.0000 0.0000 B 0 0 0 0 0 0.4162 0.0000 0.0000 Cl 0 0 0 0 0 1 2 1 0 0 0 M END