HBr.mol
  -ISIS-            3D

  2  1  0  0  0  0  0  0  0  0  0
   -0.0043    0.0000    0.0000 BR  0  0  0  0  0
    1.4385    0.0000    0.0000 H   0  0  0  0  0
  1  2  1  0  0  0