ClNO2.mol
  -ISIS-            3D

  4  3  0  0  0  0  0  0  0  0  0
    0.1323   -0.2144    0.0001 N   0  0  0  0  0
    1.3274   -0.0564    0.0000 O   0  0  0  0  0
   -0.8719    1.4622   -0.0001 CL  0  0  0  0  0
   -0.5736   -1.1910    0.0002 O   0  0  0  0  0
  1  2  2  0  0  0
  1  3  1  0  0  0
  1  4  2  0  0  0