CHOSH.mol
  -ISIS-            3D

  5  4  0  0  0  0  0  0  0  0  0
   -0.7843   -0.2181   -0.0007 C   0  0  0  0  0
    1.0292   -0.1767   -0.0022 S   0  0  0  0  0
   -1.4620    0.7898    0.0018 O   0  0  0  0  0
   -1.2050   -1.2518   -0.0013 H   0  0  0  0  0
    1.1777   -1.5332    0.0023 H   0  0  0  0  0
  1  2  1  0  0  0
  1  3  2  0  0  0
  1  4  1  0  0  0
  2  5  1  0  0  0
M  END