HMDB0029757
     RDKit          3D
4-Hydroxybenzeneacetonitrile
 17 17  0  0  0  0  0  0  0  0999 V2000
   -3.5064    1.1717    1.0784 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9271    0.4102    0.4234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1934   -0.5638   -0.3835 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7417   -0.2898   -0.1903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0358    0.5799   -0.9955 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3106    0.8221   -0.8018 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9823    0.1846    0.2205 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3555    0.4350    0.4140 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2934   -0.6800    1.0255 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0580   -0.9239    0.8322 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4418   -0.4653   -1.4612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4287   -1.5851   -0.0075 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5723    1.0823   -1.8037 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8393    1.5232   -1.4656 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8303    1.0815   -0.2027 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8332   -1.1715    1.8218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5395   -1.6112    1.4962 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  7  9  1  0
  9 10  2  0
 10  4  1  0
  3 11  1  0
  3 12  1  0
  5 13  1  0
  6 14  1  0
  8 15  1  0
  9 16  1  0
 10 17  1  0
M  END