HMDB0032639
     RDKit          3D
Methyl 4-methoxybenzoate
 22 22  0  0  0  0  0  0  0  0999 V2000
    4.5438    0.4866   -0.1246 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1489    0.6039   -0.2261 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2441   -0.3745    0.1202 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6904   -1.4617    0.5629 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7987   -0.1594   -0.0216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1169   -1.1319    0.3219 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4737   -0.9146    0.1828 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9714    0.2768   -0.3027 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3170    0.5435   -0.4607 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3505   -0.3348   -0.1587 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0506    1.2456   -0.6446 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3052    1.0316   -0.5068 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0483    0.5854   -1.1275 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8959   -0.4273    0.3529 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8901    1.3470    0.5100 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2746   -2.0730    0.7054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1824   -1.6845    0.4554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7402   -0.0902    0.8710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0733   -1.3995   -0.2549 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2091   -0.0821   -0.8473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3825    2.2122   -1.0357 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0277    1.8010   -0.7787 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  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
  8 11  1  0
 11 12  2  0
 12  5  1  0
  1 13  1  0
  1 14  1  0
  1 15  1  0
  6 16  1  0
  7 17  1  0
 10 18  1  0
 10 19  1  0
 10 20  1  0
 11 21  1  0
 12 22  1  0
M  END