KEGG:C10411  Tussilagine
  ISISHOST03240423252D 1   1.00000     0.00000  9453
 15 16  0     1  0            999 V2000
   14.0176  -10.4288    0.0000 C   0  0  1  0  0  0           0  0  0
   14.8182  -10.1977    0.0000 C   0  0  1  0  0  0           0  0  0
   13.9831  -11.2605    0.0000 N   0  0  3  0  0  0           0  0  0
   13.2375  -10.1322    0.0000 C   0  0  0  0  0  0           0  0  0
   15.2803  -10.8915    0.0000 C   0  0  2  0  0  0           0  0  0
   14.7699  -11.5543    0.0000 C   0  0  0  0  0  0           0  0  0
   13.1823  -11.4853    0.0000 C   0  0  0  0  0  0           0  0  0
   12.7161  -10.7949    0.0000 C   0  0  0  0  0  0           0  0  0
   15.8603  -11.4716    0.0000 C   0  0  0  0  0  0           0  0  0
   15.9845  -10.4701    0.0000 O   0  0  0  0  0  0           0  0  0
   14.0488   -9.6665    0.0000 H   0  0  0  0  0  0           0  0  0
   14.8125   -9.3667    0.0000 C   0  0  0  0  0  0           0  0  0
   15.5208   -8.9500    0.0000 O   0  0  0  0  0  0           0  0  0
   16.2417   -9.3542    0.0000 C   0  0  0  0  0  0           0  0  0
   14.0908   -8.9596    0.0000 O   0  0  0  0  0  0           0  0  0
  2  5  1  0     0  0
  3  6  1  0     0  0
  3  7  1  0     0  0
  4  8  1  0     0  0
  5  9  1  1     0  0
  5 10  1  6     0  0
  5  6  1  0     0  0
  7  8  1  0     0  0
  1 11  1  6     0  0
  2 12  1  6     0  0
  1  2  1  0     0  0
 12 13  1  0     0  0
  1  3  1  0     0  0
 13 14  1  0     0  0
  1  4  1  0     0  0
 12 15  2  0     0  0
M  END