HMDB0011663
     RDKit          3D
3-Hydroxyphenylpyruvic acid
 21 21  0  0  0  0  0  0  0  0999 V2000
    3.9560   -0.7113    0.5806 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4514    0.0221   -0.3256 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3763    0.6887   -1.1324 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0107    0.1595   -0.5119 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6177    0.9036   -1.4299 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1283   -0.5910    0.3985 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3004   -0.3911    0.1356 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9215   -1.2412   -0.7556 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2494   -1.1636   -1.0896 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0073   -0.1598   -0.4846 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4021    0.6975    0.4078 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1514    1.7062    1.0196 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0648    0.5882    0.7184 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6626    1.6325   -0.9838 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3564   -1.6693    0.2776 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3940   -0.3643    1.4721 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3354   -2.0345   -1.2376 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6965   -1.8410   -1.7855 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0553   -0.0878   -0.7393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1977    2.6057    0.5447 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5715    1.2511    1.4161 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  2  0
  4  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  1  0
 11 13  2  0
 13  7  1  0
  3 14  1  0
  6 15  1  0
  6 16  1  0
  8 17  1  0
  9 18  1  0
 10 19  1  0
 12 20  1  0
 13 21  1  0
M  END