HMDB0002334
     RDKit          3D
Benzoquinoneacetic acid
 18 18  0  0  0  0  0  0  0  0999 V2000
   -2.9854   -1.3736    1.1411 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1400   -0.6731    0.5127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6291    0.6147    0.0021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7504    1.3666   -0.6637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3828    0.9026   -0.8561 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4221    1.6592   -1.5020 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1124   -0.3727   -0.3543 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4782   -0.8720   -0.5042 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5032    0.0046    0.0535 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1925    0.7047   -0.7463 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7637    0.1168    1.3944 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7690   -1.1140    0.3070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6553    0.9189    0.1651 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1025    2.3338   -1.0489 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5277   -1.8931   -0.0376 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6244   -1.0896   -1.6040 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3108    0.8580    1.8064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5205   -2.0916    0.7303 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
  7 12  2  0
 12  2  1  0
  3 13  1  0
  4 14  1  0
  8 15  1  0
  8 16  1  0
 11 17  1  0
 12 18  1  0
M  END