HMDB0001527
     RDKit          3D
3-Methylthiopropionic acid
 15 14  0  0  0  0  0  0  0  0999 V2000
    2.6838    0.4315   -0.3561 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9116    0.6288   -0.2892 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0031   -0.9316   -0.2396 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4845   -0.5604   -0.2296 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8139    0.2695    0.9530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4934   -0.1293    2.0802 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4742    1.4810    0.7382 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0170   -0.6148   -0.1836 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1203    1.0667    0.4573 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1387    0.7975   -1.3132 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1682   -1.5617   -1.1150 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2203   -1.4851    0.6957 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1063   -1.4824   -0.1394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7941   -0.0604   -1.1375 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0903    2.1507    0.0788 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  1  8  1  0
  1  9  1  0
  1 10  1  0
  3 11  1  0
  3 12  1  0
  4 13  1  0
  4 14  1  0
  7 15  1  0
M  END