HMDB0094709
     RDKit          3D
3, 5-Dihydroxyphenylacetic acid
 20 20  0  0  0  0  0  0  0  0999 V2000
    1.8302    0.4002   -1.9072 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5355    0.2169   -0.8836 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9068    0.2982   -1.0551 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8725   -0.0630    0.3872 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3984   -0.0785    0.2162 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2818   -1.2294   -0.0988 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6472   -1.2123   -0.2506 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2943   -2.3928   -0.5679 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3991   -0.0643   -0.0991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7213    1.0882    0.2160 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4520    2.2542    0.3736 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3530    1.0873    0.3714 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5416   -0.4837   -0.9777 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2014   -1.0030    0.8704 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1140    0.7676    1.1114 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3107   -2.1276   -0.2168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2962   -2.4623   -0.6963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4836   -0.0980   -0.2294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9737    3.1069    0.6041 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1912    1.9954    0.6209 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  7  9  2  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 12  5  1  0
  3 13  1  0
  4 14  1  0
  4 15  1  0
  6 16  1  0
  8 17  1  0
  9 18  1  0
 11 19  1  0
 12 20  1  0
M  END