HMDB0033970
     RDKit          3D
4-Ethoxybenzaldehyde
 21 21  0  0  0  0  0  0  0  0999 V2000
   -3.0729    0.4446    0.0520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6331   -0.8896   -0.4460 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4336   -1.3580    0.0768 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2011   -0.7783   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0067    0.4099   -0.6769 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2490    1.0142   -0.7762 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3394    0.4063   -0.1914 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6639    1.0407   -0.2943 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7881    2.1214   -0.9091 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1730   -0.7861    0.4808 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9158   -1.3568    0.5599 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2199    1.1451   -0.7996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3428    0.9358    0.7424 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0134    0.3640    0.6685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4268   -1.6370   -0.1543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5854   -0.9345   -1.5712 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8612    0.8917   -1.1396 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3543    1.9629   -1.3165 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5334    0.5835    0.1557 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0113   -1.2710    0.9408 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7690   -2.3088    1.0936 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  7 10  1  0
 10 11  2  0
 11  4  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  2 16  1  0
  5 17  1  0
  6 18  1  0
  8 19  1  0
 10 20  1  0
 11 21  1  0
M  END