HMDB0000375
     RDKit          3D
3-(3-Hydroxyphenyl)propanoic acid
 22 22  0  0  0  0  0  0  0  0999 V2000
    3.6945    0.6950    1.3078 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3440    0.4683    0.1289 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2764    0.0624   -0.8015 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9385    0.6298   -0.2687 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1063   -0.2086    0.6255 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3200   -0.2112    0.4069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8187   -1.1427   -0.5080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1370   -1.2779   -0.8229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0633   -0.4563   -0.2153 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5903    0.4850    0.7055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5300    1.2948    1.3004 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2476    0.5991    1.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4093   -0.9741   -0.8568 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7334    1.7149   -0.2223 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8369    0.3429   -1.3337 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2846    0.0843    1.6971 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4878   -1.2487    0.5561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1209   -1.8154   -1.0195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5119   -2.0028   -1.5311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1141   -0.5353   -0.4327 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7730    2.1759    0.8630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8849    1.3203    1.7136 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  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 12  6  1  0
  3 13  1  0
  4 14  1  0
  4 15  1  0
  5 16  1  0
  5 17  1  0
  7 18  1  0
  8 19  1  0
  9 20  1  0
 11 21  1  0
 12 22  1  0
M  END