KEGG:C10092  Swertianin
  ISISHOST03240423242D 1   1.00000     0.00000  9134
 20 22  0     0  0            999 V2000
    0.5414    0.6414    0.0000 C   0  0  0  0  0  0           0  0  0
    0.5345   -0.1828    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.1759    1.0621    0.0000 O   0  0  0  0  0  0           0  0  0
    1.2621    1.0517    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.1828   -0.5966    0.0000 C   0  0  0  0  0  0           0  0  0
    1.2448   -0.6034    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.8931    0.6483    0.0000 C   0  0  0  0  0  0           0  0  0
    1.9724    0.6310    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.8966   -0.1793    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.1862   -1.4241    0.0000 O   0  0  0  0  0  0           0  0  0
    1.9655   -0.1966    0.0000 C   0  0  0  0  0  0           0  0  0
    1.2379   -1.4310    0.0000 O   0  0  0  0  0  0           0  0  0
   -1.6103    1.0655    0.0000 C   0  0  0  0  0  0           0  0  0
    2.6966    1.0414    0.0000 O   0  0  0  0  0  0           0  0  0
   -1.6103   -0.5931    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.3276    0.6483    0.0000 C   0  0  0  0  0  0           0  0  0
    3.4103    0.6172    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.3276   -0.1793    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.6069   -1.4207    0.0000 O   0  0  0  0  0  0           0  0  0
   -3.0483   -0.5931    0.0000 O   0  0  0  0  0  0           0  0  0
  1  2  2  0     0  0
  1  3  1  0     0  0
  1  4  1  0     0  0
  2  5  1  0     0  0
  2  6  1  0     0  0
  3  7  1  0     0  0
  4  8  2  0     0  0
  5  9  1  0     0  0
  5 10  2  0     0  0
  6 11  2  0     0  0
  6 12  1  0     0  0
  7 13  1  0     0  0
  8 14  1  0     0  0
  9 15  1  0     0  0
 13 16  2  0     0  0
 14 17  1  0     0  0
 15 18  2  0     0  0
 15 19  1  0     0  0
 18 20  1  0     0  0
  7  9  2  0     0  0
  8 11  1  0     0  0
 16 18  1  0     0  0
M  END