HMDB0041683
     RDKit          3D
4-Hydroxyphenyl-2-propionic acid
 22 22  0  0  0  0  0  0  0  0999 V2000
   -1.9271    0.2079   -1.3895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5156    0.5603    0.0417 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3149   -0.1413    1.0347 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0200    0.4877    1.8532 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3143   -1.5195    1.0973 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0669    0.3012    0.1308 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7942    1.3625    0.2691 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1567    1.1683    0.3563 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6848   -0.0980    0.3064 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0698   -0.2707    0.3967 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8353   -1.1660    0.1684 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4511   -0.9690    0.0798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0345    0.3629   -1.4709 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4146    0.9485   -2.0399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6143   -0.8200   -1.5866 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7113    1.6723    0.1052 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9432   -2.1070    0.5396 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4499    2.3970    0.3164 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8316    2.0014    0.4649 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5437   -0.3971    1.2784 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2498   -2.1542    0.1296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1903   -1.8272   -0.0281 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  2  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  2  0
 12  6  1  0
  1 13  1  0
  1 14  1  0
  1 15  1  0
  2 16  1  0
  5 17  1  0
  7 18  1  0
  8 19  1  0
 10 20  1  0
 11 21  1  0
 12 22  1  0
M  END