KEGG:C02470  Xanthurenic acid
  ISISHOST03240423062D 1   1.00000     0.00000  2211
 15 16  0     0  0            999 V2000
   -0.4414   -0.2034    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.4414    0.5552    0.0000 C   0  0  0  0  0  0           0  0  0
    0.2241   -0.5828    0.0000 N   0  0  0  0  0  0           0  0  0
   -1.0966   -0.5862    0.0000 C   0  0  0  0  0  0           0  0  0
    0.2172    0.9414    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.0966    0.9310    0.0000 C   0  0  0  0  0  0           0  0  0
    0.8862   -0.2069    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.7483   -0.2034    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.1000   -1.3379    0.0000 O   0  0  0  0  0  0           0  0  0
    0.8793    0.5586    0.0000 C   0  0  0  0  0  0           0  0  0
    0.2138    1.6897    0.0000 O   0  0  0  0  0  0           0  0  0
   -1.7483    0.5552    0.0000 C   0  0  0  0  0  0           0  0  0
    1.5345   -0.5793    0.0000 C   0  0  0  0  0  0           0  0  0
    1.5345   -1.3310    0.0000 O   0  0  0  0  0  0           0  0  0
    2.1828   -0.2034    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  2  0     0  0
  4  8  2  0     0  0
  4  9  1  0     0  0
  5 10  2  0     0  0
  5 11  1  0     0  0
  6 12  2  0     0  0
  7 13  1  0     0  0
 13 14  1  0     0  0
 13 15  2  0     0  0
  7 10  1  0     0  0
  8 12  1  0     0  0
M  END