HMDB0252031
     RDKit          3D
Ethyl 3,4-dihydroxybenzoate
 23 23  0  0  0  0  0  0  0  0999 V2000
    3.9139    0.3651   -0.4581 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2404   -0.8726    0.0566 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8514   -0.8708   -0.0908 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0197    0.0712    0.4783 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5621    0.9732    1.1668 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4273    0.0241    0.2904 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9855   -0.9798   -0.4707 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3470   -1.0669   -0.6774 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1838   -0.1296   -0.1123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5680   -0.1947   -0.3060 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6351    0.8764    0.6494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5120    1.8024    1.2024 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2731    0.9573    0.8519 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9357    1.1290    0.3488 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9805    0.0998   -0.6631 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4961    0.7363   -1.4025 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6292   -1.7721   -0.4734 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4701   -0.9605    1.1404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3336   -1.7311   -0.9258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7882   -1.8691   -1.2852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9911   -0.9253   -0.8617 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2031    2.5810    1.7795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8511    1.7568    1.4557 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
  4  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
  9 11  1  0
 11 12  1  0
 11 13  2  0
 13  6  1  0
  1 14  1  0
  1 15  1  0
  1 16  1  0
  2 17  1  0
  2 18  1  0
  7 19  1  0
  8 20  1  0
 10 21  1  0
 12 22  1  0
 13 23  1  0
M  END