HMDB0041822
     RDKit          3D
Acrolein
  8  7  0  0  0  0  0  0  0  0999 V2000
    1.2077    0.0652    0.0786 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0005   -0.4024    0.3256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2115    0.1452   -0.2494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1175    1.1290   -1.0354 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0912   -0.3481    0.5093 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2708    0.9233   -0.6091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0780   -1.2401    0.9952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1622   -0.2722   -0.0150 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