HMDB0004094
     RDKit          3D
Indoxyl
 17 18  0  0  0  0  0  0  0  0999 V2000
    2.9861   -0.0262   -0.0708 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6995   -0.5431   -0.1282 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3838   -1.8667   -0.3413 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0427   -1.9483   -0.3250 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5185   -0.7519   -0.1135 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8255   -0.2904   -0.0077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1280    1.0327    0.2192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0947    1.9231    0.3443 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2136    1.4951    0.2440 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5215    0.1602    0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1148    0.9676    0.0916 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0826   -2.7041   -0.4962 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4693   -2.8481   -0.4633 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6024   -1.0570   -0.1179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1644    1.3270    0.2912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2911    2.9576    0.5207 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0492    2.1726    0.3380 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10  2  1  0
 10  5  1  0
  1 11  1  0
  3 12  1  0
  4 13  1  0
  6 14  1  0
  7 15  1  0
  8 16  1  0
  9 17  1  0
M  END