HMDB0001253
     RDKit          3D
5,6-Dihydroxyindole-2-carboxylic acid
 21 22  0  0  0  0  0  0  0  0999 V2000
    4.3279   -0.8115    0.0547 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6145    0.1809   -0.1555 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1977    1.3953   -0.4429 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1622    0.0874   -0.1042 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2569    1.1319   -0.3222 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0220    0.6560   -0.1878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2641    1.2377   -0.2939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4199    0.4746   -0.0970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6540    1.0853   -0.2098 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3295   -0.8651    0.2048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5030   -1.6098    0.3980 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0814   -1.4329    0.3077 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0866   -0.6830    0.1135 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3930   -0.9836    0.1545 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1070    2.1834    0.2112 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5874    2.1363   -0.5567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3107    2.2830   -0.5299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4843    0.5407   -0.0692 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4660   -2.5915    0.6197 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9996   -2.4773    0.5427 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8013   -1.9380    0.3624 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
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  8 10  2  0
 10 11  1  0
 10 12  1  0
 12 13  2  0
 13 14  1  0
 14  4  1  0
 13  6  1  0
  3 15  1  0
  5 16  1  0
  7 17  1  0
  9 18  1  0
 11 19  1  0
 12 20  1  0
 14 21  1  0
M  END