KEGG:C03003  N-Glucosylnicotinate
  ISISHOST03240423072D 1   1.00000     0.00000  2651
 20 21  0     1  0            999 V2000
   -0.0310   -0.5207    0.0000 C   0  0  2  0  0  0           0  0  0
    0.7241    0.2241    0.0000 N   0  3  0  0  0  0           0  0  0
   -0.7379   -0.1138    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.0310   -1.3379    0.0000 C   0  0  1  0  0  0           0  0  0
    1.4552    0.6759    0.0000 C   0  0  0  0  0  0           0  0  0
    0.0241    0.6310    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.4448   -0.5207    0.0000 C   0  0  1  0  0  0           0  0  0
   -0.7379   -1.7379    0.0000 C   0  0  2  0  0  0           0  0  0
    0.6724   -1.7379    0.0000 O   0  0  0  0  0  0           0  0  0
    1.4448    1.4517    0.0000 C   0  0  0  0  0  0           0  0  0
    0.0172    1.4483    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.4448   -1.3379    0.0000 C   0  0  2  0  0  0           0  0  0
   -2.1379   -0.1138    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7379   -2.5483    0.0000 O   0  0  0  0  0  0           0  0  0
    0.7276    1.8586    0.0000 C   0  0  0  0  0  0           0  0  0
    2.1379    1.8690    0.0000 C   0  0  0  0  0  0           0  0  0
   -2.1379   -1.7379    0.0000 O   0  0  0  0  0  0           0  0  0
   -2.7621   -0.6379    0.0000 O   0  0  0  0  0  0           0  0  0
    2.8448    1.4621    0.0000 O   0  0  0  0  0  0           0  0  0
    2.1552    2.7241    0.0000 O   0  0  0  0  0  0           0  0  0
  1  2  1  1     0  0
  1  3  1  0     0  0
  1  4  1  0     0  0
  2  5  1  0     0  0
  2  6  2  0     0  0
  3  7  1  0     0  0
  4  8  1  0     0  0
  4  9  1  6     0  0
  5 10  2  0     0  0
  6 11  1  0     0  0
  7 12  1  0     0  0
  7 13  1  1     0  0
  8 14  1  1     0  0
 10 15  1  0     0  0
 10 16  1  0     0  0
 12 17  1  6     0  0
 13 18  1  0     0  0
 16 19  1  0     0  0
 16 20  2  0     0  0
  8 12  1  0     0  0
 11 15  2  0     0  0
M  CHG  1   2   1
M  END