NCO.mol
  -ISIS-            3D

  3  2  0  0  0  0  0  0  0  0  0
   -0.0437   -0.0001   -0.0001 C   0  0  0  0  0
    1.1552   -0.0001    0.0001 O   0  0  0  0  0
   -1.2793    0.0005    0.0001 N   0  0  0  0  0
  1  2  2  0  0  0
  1  3  2  0  0  0
<MULTIPLICITY>
 2