HMDB0304500
     RDKit          3D
thioacrolein
  8  7  0  0  0  0  0  0  0  0999 V2000
   -1.2282   -0.2027   -0.0909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1175    0.4947    0.0600 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1667   -0.2040    0.0333 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5626    0.6195    0.2160 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1978    0.2760   -0.0773 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2312   -1.2739   -0.2343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1759    1.5519    0.1983 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2213   -1.2614   -0.1051 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  1  5  1  0
  1  6  1  0
  2  7  1  0
  3  8  1  0
M  END