HMDB0032151
     RDKit          3D
3,4-Dimethylphenol
 19 19  0  0  0  0  0  0  0  0999 V2000
    2.2068    0.7780    0.1678 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7210    0.5708    0.0744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1622    1.6161    0.2287 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5394    1.4394    0.1450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0562    0.1839   -0.1000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4399   -0.0116   -0.1873 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1645   -0.8588   -0.2535 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2015   -0.6833   -0.1704 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0855   -1.8617   -0.3487 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4168    1.7791    0.5952 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6735    0.7591   -0.8409 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6691    0.0477    0.8676 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2446    2.6038    0.4214 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1946    2.2899    0.2729 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9594   -0.2367    0.6529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6042   -1.8427   -0.4467 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1378   -1.6399   -0.1465 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7503   -2.6178    0.4162 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0136   -2.3153   -1.3483 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  2  0
  8  9  1  0
  8  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
  7 16  1  0
  9 17  1  0
  9 18  1  0
  9 19  1  0
M  END