CH2OOt.mol
  -ISIS-            3D

  5  4  0  0  0  0  0  0  0  0  0
   -1.1443    0.3990   -0.1384 C   0  0  0  0  0
    0.1310    0.1666   -0.6193 O   0  0  0  0  0
   -1.2810    1.2948    0.4740 H   0  0  0  0  0
   -1.8474   -0.4378   -0.1888 H   0  0  0  0  0
    0.8445   -0.4611    0.4151 O   0  0  0  0  0
  1  2  1  0  0  0
  1  3  1  0  0  0
  1  4  1  0  0  0
  2  5  1  0  0  0
<MULTIPLICITY>
 3