HMDB0041604
     RDKit          3D
3-Mercaptopropanoic acid
 12 11  0  0  0  0  0  0  0  0999 V2000
    1.2304    1.3309    1.4185 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2929    0.6945    0.3384 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5374    0.3764   -0.1772 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0804    0.2914   -0.3738 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8448   -0.5621    0.4729 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2884   -0.9690   -0.5448 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.0605   -0.4807    0.0676 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4991    1.1993   -0.7059 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2850   -0.2896   -1.2947 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3085   -1.5008    0.7802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2111   -0.0518    1.3813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3346   -0.0385   -0.3096 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  3  7  1  0
  4  8  1  0
  4  9  1  0
  5 10  1  0
  5 11  1  0
  6 12  1  0
M  END