HMDB0037493
     RDKit          3D
S-2-Propenyl propanethioate
 18 17  0  0  0  0  0  0  0  0999 V2000
   -3.5330    0.1710    0.8191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8729    0.0983   -0.3218 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4037   -0.0959   -0.2894 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5188    1.2572   -1.0915 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2252    0.9591   -1.0152 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0132    1.7406   -1.4928 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7156   -0.2665   -0.3555 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2267   -0.3717   -0.3750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6138    0.3140    0.7845 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9993    0.0888    1.7533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3624    0.1749   -1.2740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1621   -1.0307   -0.8755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0308   -0.3046    0.7360 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2885   -1.1418   -0.9054 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3007   -0.2867    0.6664 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4985   -0.8460   -1.3463 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7232    0.6046   -0.2297 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5052   -1.0646    0.4518 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  1  9  1  0
  1 10  1  0
  2 11  1  0
  3 12  1  0
  3 13  1  0
  7 14  1  0
  7 15  1  0
  8 16  1  0
  8 17  1  0
  8 18  1  0
M  END