HMDB0245456
     RDKit          3D
2,4-Dimethylphenol
 19 19  0  0  0  0  0  0  0  0999 V2000
    2.6772   -0.9635    0.3614 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4011   -0.2164    0.2091 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3188    1.1585    0.3053 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1247    1.8347    0.1610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0521    1.1631   -0.0882 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2628    1.8494   -0.2344 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9822   -0.2101   -0.1863 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2533   -0.9308   -0.4551 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2166   -0.8796   -0.0407 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6960   -1.5326    1.3363 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7716   -1.7280   -0.4232 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5226   -0.2696    0.4085 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2623    1.6772    0.5035 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0938    2.9264    0.2431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1326    1.3811   -0.4164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0554   -2.0049   -0.4763 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6363   -0.6250   -1.4504 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9675   -0.6614    0.3637 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2574   -1.9685   -0.1209 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  2  0
  5  6  1  0
  5  7  1  0
  7  8  1  0
  7  9  2  0
  9  2  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  3 13  1  0
  4 14  1  0
  6 15  1  0
  8 16  1  0
  8 17  1  0
  8 18  1  0
  9 19  1  0
M  END