KEGG:C05603  2-Hydroxy-3-(4-hydroxyphenyl)propanoate
  ISISHOST03240423122D 1   1.00000     0.00000  4744
 13 13  0     0  0            999 V2000
    2.0483   -0.2379    0.0000 C   0  0  0  0  0  0           0  0  0
    3.4138    0.1276    0.0000 C   0  0  0  0  0  0           0  0  0
    0.8241    0.4690    0.0000 C   0  0  0  0  0  0           0  0  0
    2.0448   -1.6552    0.0000 O   0  0  0  0  0  0           0  0  0
    4.4138   -0.8724    0.0000 O   0  0  0  0  0  0           0  0  0
    3.7793    1.4966    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.5414    0.1000    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.2483   -1.1276    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.2517    1.3241    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.6621   -1.1345    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.6655    1.3207    0.0000 C   0  0  0  0  0  0           0  0  0
   -3.3724    0.0897    0.0000 C   0  0  0  0  0  0           0  0  0
   -4.7897    0.0966    0.0000 O   0  0  0  0  0  0           0  0  0
  1  2  1  0     0  0
  1  3  2  0     0  0
  1  4  1  0     0  0
  2  5  1  0     0  0
  2  6  2  0     0  0
  3  7  1  0     0  0
  7  8  1  0     0  0
  7  9  2  0     0  0
  8 10  2  0     0  0
  9 11  1  0     0  0
 10 12  1  0     0  0
 12 13  1  0     0  0
 11 12  2  0     0  0
M  END