BeO.mol
  -ISIS-            3D

  2  1  0  0  0  0  0  0  0  0  0
   -0.9078    0.0000    0.0000 BE  0  0  0  0  0
    0.5348    0.0000    0.0000 O   0  0  0  0  0
  1  2  2  0  0  0