HMDB0004045
     RDKit          3D
3-Sulfopyruvic acid
 14 13  0  0  0  0  0  0  0  0999 V2000
    1.6865    0.4149    1.4829 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8159    0.1553    0.2309 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9098    0.6384   -0.4305 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7734   -0.6353   -0.3803 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8706   -0.9050   -1.6012 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3700   -1.1016    0.4335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6378    0.1423    0.5528 S   0  0  0  0  0  6  0  0  0  0  0  0
   -1.0928    1.3770    1.2040 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8065   -0.3888    1.3569 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2374    0.5545   -0.9453 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0227    1.6464   -0.5704 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8402   -2.0274    0.0422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0803   -1.3705    1.4878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0138    1.4997   -1.1274 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  2  0
  4  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  2  0
  7 10  1  0
  3 11  1  0
  6 12  1  0
  6 13  1  0
 10 14  1  0
M  END