HMDB0040177
     RDKit          3D
3-Ethyl-1,2-benzenediol
 20 20  0  0  0  0  0  0  0  0999 V2000
   -1.5046    1.1714   -1.8174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0431    1.0308   -1.5575 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3022    0.0060   -0.5601 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8220   -1.2298   -0.9388 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1460   -2.1913   -0.0079 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9310   -1.8719    1.3213 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4183   -0.6560    1.7151 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2062   -0.3465    3.0613 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0934    0.3102    0.7685 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4269    1.5444    1.1694 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1143    1.0165   -0.9148 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6752    2.2447   -2.1165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8517    0.5769   -2.6850 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3675    2.0028   -1.1944 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4530    0.8279   -2.5345 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9863   -1.4695   -1.9921 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5507   -3.1580   -0.2721 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1808   -2.6196    2.0788 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1660    0.5387    3.3408 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6756    2.2722    0.5329 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  7  9  2  0
  9 10  1  0
  9  3  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  2 15  1  0
  4 16  1  0
  5 17  1  0
  6 18  1  0
  8 19  1  0
 10 20  1  0
M  END