HMDB0059969
     RDKit          3D
3-Methoxyphenylacetic acid
 22 22  0  0  0  0  0  0  0  0999 V2000
   -3.7444    0.8981   -0.2673 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4224    1.1986    0.1097 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3920    0.2660    0.0517 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6070   -1.0236   -0.3837 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5735   -1.9170   -0.4291 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6978   -1.5340   -0.0383 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9467   -0.2470    0.4036 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    0.1443    0.8169 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1102    0.6787   -0.2980 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6242    0.7631   -1.4429 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4047    1.0865   -0.0673 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1315    0.6321    0.4351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1475   -0.0109    0.1915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3753    1.7746   -0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7891    0.7632   -1.3691 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6277   -1.2819   -0.6826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7953   -2.9178   -0.7789 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4939   -2.2600   -0.0847 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8315   -0.7088    1.3080 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2790    0.9477    1.6084 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8316    1.1206    0.8487 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0761    1.6276    0.7802 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
  8  9  1  0
  9 10  2  0
  9 11  1  0
  7 12  2  0
 12  3  1  0
  1 13  1  0
  1 14  1  0
  1 15  1  0
  4 16  1  0
  5 17  1  0
  6 18  1  0
  8 19  1  0
  8 20  1  0
 11 21  1  0
 12 22  1  0
M  END