HMDB0001229
     RDKit          3D
Dopaquinone
 23 23  0  0  0  0  0  0  0  0999 V2000
   -1.8238   -1.4433    0.4865 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9287   -0.0009    0.5539 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.7513    0.6463    1.1874 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5390    0.4249    0.5311 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2356    1.4739    0.0619 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5260    1.2803   -0.5966 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2120    2.2320   -1.0510 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0601   -0.0673   -0.7437 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1807   -0.2689   -1.3123 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2573   -1.1579   -0.2140 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0787   -0.9129    0.3805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1859    0.4733   -0.8277 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3110    1.7124   -0.9895 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2944   -0.3435   -1.9251 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4253   -1.8480   -0.2642 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0093   -1.8549    1.4277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8719    0.2024    1.1195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9982    1.7446    1.2777 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7200    0.3073    2.2652 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8283    2.4664    0.1780 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5980   -2.1767   -0.2920 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4853   -1.7419    0.7788 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6813   -1.1474   -2.0322 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
  6  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  2  0
  2 12  1  0
 12 13  2  0
 12 14  1  0
 11  4  1  0
  1 15  1  0
  1 16  1  0
  2 17  1  1
  3 18  1  0
  3 19  1  0
  5 20  1  0
 10 21  1  0
 11 22  1  0
 14 23  1  0
M  END