HMDB0032617
     RDKit          3D
Methyl phenylacetate
 21 21  0  0  0  0  0  0  0  0999 V2000
   -3.5936    0.8167   -0.1408 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5303    0.3409    0.6904 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6994   -0.6594    0.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9266   -1.1196   -0.9304 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5612   -1.1512    1.0845 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7146   -0.5673    0.5683 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8617    0.8299    0.5977 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0028    1.4465    0.1757 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1002    0.7001   -0.3211 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9432   -0.6687   -0.3442 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7591   -1.3017    0.0994 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9172    0.0371   -0.8452 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4019    1.2716    0.4601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1706    1.6795   -0.7332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4703   -2.2579    1.0549 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6916   -0.8258    2.1017 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0273    1.4136    0.9746 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1121    2.5176    0.1954 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9879    1.2129   -0.6498 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7641   -1.3136   -0.7096 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6898   -2.4014    0.0603 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
  3  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11  6  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  5 15  1  0
  5 16  1  0
  7 17  1  0
  8 18  1  0
  9 19  1  0
 10 20  1  0
 11 21  1  0
M  END