KEGG:C09936  Heritonin
  ISISHOST03240423242D 1   1.00000     0.00000  8978
 20 22  0     1  0            999 V2000
    0.6655    0.4862    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.0345    0.0483    0.0000 C   0  0  0  0  0  0           0  0  0
    1.3897    0.0931    0.0000 C   0  0  2  0  0  0           0  0  0
    0.8103    1.3000    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.0034   -0.7759    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7690    0.4379    0.0000 C   0  0  0  0  0  0           0  0  0
    1.4172   -0.7241    0.0000 C   0  0  0  0  0  0           0  0  0
    1.9897    0.6690    0.0000 O   0  0  0  0  0  0           0  0  0
    1.6310    1.4138    0.0000 C   0  0  0  0  0  0           0  0  0
    0.2379    1.8966    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7069   -1.2172    0.0000 C   0  0  0  0  0  0           0  0  0
    0.7241   -1.1586    0.0000 C   0  0  1  0  0  0           0  0  0
   -1.4724   -0.0034    0.0000 C   0  0  0  0  0  0           0  0  0
    2.0207    2.1448    0.0000 O   0  0  0  0  0  0           0  0  0
   -1.4379   -0.8345    0.0000 C   0  0  0  0  0  0           0  0  0
    0.7517   -1.9897    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.2034    0.3828    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.1414   -1.2759    0.0000 O   0  0  0  0  0  0           0  0  0
   -2.8759   -0.8931    0.0000 C   0  0  0  0  0  0           0  0  0
    2.1069   -0.3172    0.0000 H   0  0  0  0  0  0           0  0  0
  1  2  1  0     0  0
  1  3  1  0     0  0
  1  4  2  0     0  0
  2  5  2  0     0  0
  2  6  1  0     0  0
  3  7  1  0     0  0
  3  8  1  0     0  0
  4  9  1  0     0  0
  4 10  1  0     0  0
  5 11  1  0     0  0
  5 12  1  0     0  0
  6 13  2  0     0  0
  9 14  2  0     0  0
 11 15  2  0     0  0
 12 16  1  1     0  0
 13 17  1  0     0  0
 15 18  1  0     0  0
 18 19  1  0     0  0
  7 12  1  0     0  0
  8  9  1  0     0  0
 13 15  1  0     0  0
  3 20  1  6     0  0
M  END