KEGG:C10343  Emodin
  ISISHOST03240423252D 1   1.00000     0.00000  9385
 20 22  0     0  0            999 V2000
    0.7207    0.3345    0.0000 C   0  0  0  0  0  0           0  0  0
    0.7138   -0.4931    0.0000 C   0  0  0  0  0  0           0  0  0
    0.0034    0.7483    0.0000 C   0  0  0  0  0  0           0  0  0
    1.4414    0.7379    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.0034   -0.9103    0.0000 C   0  0  0  0  0  0           0  0  0
    1.4276   -0.9172    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7172    0.3379    0.0000 C   0  0  0  0  0  0           0  0  0
    0.0069    1.5759    0.0000 O   0  0  0  0  0  0           0  0  0
    2.1552    0.3207    0.0000 C   0  0  0  0  0  0           0  0  0
    1.4483    1.5655    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.7207   -0.4897    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.0034   -1.7379    0.0000 O   0  0  0  0  0  0           0  0  0
    2.1483   -0.5069    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.4310    0.7517    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.4310   -0.9069    0.0000 C   0  0  0  0  0  0           0  0  0
    2.8586   -0.9310    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.1517    0.3379    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.4310    1.5793    0.0000 O   0  0  0  0  0  0           0  0  0
   -2.1517   -0.4897    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.8724   -0.9069    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
  3  8  2  0     0  0
  4  9  2  0     0  0
  4 10  1  0     0  0
  5 11  1  0     0  0
  5 12  2  0     0  0
  6 13  2  0     0  0
  7 14  1  0     0  0
 11 15  1  0     0  0
 13 16  1  0     0  0
 14 17  2  0     0  0
 14 18  1  0     0  0
 15 19  2  0     0  0
 19 20  1  0     0  0
  7 11  2  0     0  0
  9 13  1  0     0  0
 17 19  1  0     0  0
M  END