HMDB0029686
     RDKit          3D
4-Methoxybenzaldehyde
 18 18  0  0  0  0  0  0  0  0999 V2000
    3.2176   -0.3624   -0.0212 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2992    0.7158   -0.0340 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9242    0.4756   -0.0156 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0289    1.5257   -0.0280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3346    1.3046   -0.0101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8669    0.0320    0.0209 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3121   -0.1835    0.0394 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8257   -1.3269    0.0675 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9738   -1.0225    0.0333 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3892   -0.7965    0.0154 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2343    0.0052   -0.1511 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0842   -0.9852    0.9064 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9876   -1.0749   -0.8620 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4117    2.5383   -0.0522 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0569    2.1256   -0.0195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9715    0.6701    0.0287 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3525   -2.0276    0.0574 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1170   -1.6133    0.0247 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  2  0
  6  9  1  0
  9 10  2  0
 10  3  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  4 14  1  0
  5 15  1  0
  7 16  1  0
  9 17  1  0
 10 18  1  0
M  END