KEGG:C12117  Saphenic acid
  ISISHOST05180423312D 1   1.00000     0.00000 14206
 20 22  0     0  0            999 V2000
    5.6116  -11.8576    0.0000 C   0  0  0  0  0  0           0  0  0
    4.9004  -12.2627    0.0000 C   0  0  0  0  0  0           0  0  0
    4.8958  -13.0811    0.0000 C   0  0  0  0  0  0           0  0  0
    5.6022  -13.4944    0.0000 C   0  0  0  0  0  0           0  0  0
    6.3180  -12.2708    0.0000 C   0  0  0  0  0  0           0  0  0
    6.3124  -13.0873    0.0000 C   0  0  0  0  0  0           0  0  0
    7.0167  -13.5004    0.0000 N   0  0  0  0  0  0           0  0  0
    7.0279  -11.8674    0.0000 N   0  0  0  0  0  0           0  0  0
    7.7322  -12.2805    0.0000 C   0  0  0  0  0  0           0  0  0
    7.7248  -13.0957    0.0000 C   0  0  0  0  0  0           0  0  0
    8.4271  -13.5097    0.0000 C   0  0  0  0  0  0           0  0  0
    9.1368  -13.1085    0.0000 C   0  0  0  0  0  0           0  0  0
    9.1442  -12.2933    0.0000 C   0  0  0  0  0  0           0  0  0
    8.4419  -11.8793    0.0000 C   0  0  0  0  0  0           0  0  0
    8.4494  -11.0544    0.0000 C   0  0  3  0  0  0           0  0  0
    9.1675  -10.6483    0.0000 O   0  0  0  0  0  0           0  0  0
    7.7387  -10.6354    0.0000 C   0  0  0  0  0  0           0  0  0
    5.5985  -14.3194    0.0000 C   0  0  0  0  0  0           0  0  0
    4.8822  -14.7287    0.0000 O   0  0  0  0  0  0           0  0  0
    6.3112  -14.7351    0.0000 O   0  0  0  0  0  0           0  0  0
  1  2  2  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  6  1  0     0  0
  5  1  1  0     0  0
  5  6  1  0     0  0
  6  7  2  0     0  0
  7 10  1  0     0  0
  9  8  1  0     0  0
  8  5  2  0     0  0
  9 10  2  0     0  0
 10 11  1  0     0  0
 11 12  2  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14  9  1  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 15 17  1  0     0  0
  4 18  1  0     0  0
 18 19  2  0     0  0
 18 20  1  0     0  0
M  END