HMDB0000763
     RDKit          3D
5-Hydroxyindoleacetic acid
 23 24  0  0  0  0  0  0  0  0999 V2000
   -2.0462    0.4140   -1.6745 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6793    0.7166   -0.6363 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7937    1.5231   -0.7717 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1870    0.1877    0.6580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9708   -0.6456    0.4777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9490   -2.0219    0.5232 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3322   -2.4104    0.3147 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1271   -1.3402    0.1386 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4929   -1.1624   -0.1043 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0417    0.0925   -0.2441 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2304    1.2030   -0.1431 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7344    2.4929   -0.2764 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8745    1.0277    0.0982 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3169   -0.2236    0.2393 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0261    2.1453   -0.0254 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9685    1.0872    1.2969 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0067   -0.3876    1.1453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7820   -2.6964    0.6925 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6849   -3.3949    0.2887 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1112   -2.0395   -0.1799 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1150    0.2329   -0.4349 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1103    3.2787   -0.1962 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2378    1.9210    0.1765 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  2  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 11 13  1  0
 13 14  2  0
 14  5  1  0
 14  8  1  0
  3 15  1  0
  4 16  1  0
  4 17  1  0
  6 18  1  0
  7 19  1  0
  9 20  1  0
 10 21  1  0
 12 22  1  0
 13 23  1  0
M  END