BeCH2CH2+.mol
  -ISIS-            3D

  7  5  0  0  0  0  0  0  0  0  0
   -0.0183   -0.0168    0.0001 C   0  0  0  0  0
    1.3607   -0.0242   -0.0001 C   0  0  0  0  0
    1.9336    1.9376    0.0010 BE  0  0  0  0  0
    1.8983   -0.2456   -0.9398 H   0  0  0  0  0
    1.8994   -0.2453    0.9390 H   0  0  0  0  0
   -0.5899   -0.0083   -0.9371 H   0  0  0  0  0
   -0.5905   -0.0064    0.9369 H   0  0  0  0  0
  1  2  2  0  0  0
  2  3  1  0  0  0
  1  6  1  0  0  0
  1  7  1  0  0  0
  2  4  1  0  0  0
  2  5  1  0  0  0
<CHARGE>
1
<MULTIPLICITY>
2
M  END