KEGG:C06675  3-Sulfomuconate
  ISISHOST03240423152D 1   1.00000     0.00000  5738
 14 13  0     0  0            999 V2000
   -0.5483   -0.1069    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.5483    0.7172    0.0000 C   0  0  0  0  0  0           0  0  0
    0.1655   -0.5172    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.2655   -0.5207    0.0000 S   0  0  3  0  0  0           0  0  0
    0.1655    1.1310    0.0000 C   0  0  0  0  0  0           0  0  0
    0.8793   -0.1069    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.8483   -1.1035    0.0000 O   0  0  0  0  0  0           0  0  0
   -1.9793   -0.1069    0.0000 O   0  0  0  0  0  0           0  0  0
   -1.2621   -1.3448    0.0000 O   0  0  0  0  0  0           0  0  0
    0.8759    0.7172    0.0000 C   0  0  0  0  0  0           0  0  0
    1.5931   -0.5172    0.0000 O   0  0  0  0  0  0           0  0  0
    1.0931   -0.8966    0.0000 O   0  0  0  0  0  0           0  0  0
    1.5931    1.1310    0.0000 O   0  0  0  0  0  0           0  0  0
    1.0862    1.5172    0.0000 O   0  0  0  0  0  0           0  0  0
  1  2  1  0     0  0
  1  3  2  0     0  0
  1  4  1  0     0  0
  2  5  2  0     0  0
  3  6  1  0     0  0
  4  7  1  0     0  0
  4  8  2  0     0  0
  4  9  2  0     0  0
  5 10  1  0     0  0
  6 11  1  0     0  0
  6 12  2  0     0  0
 10 13  1  0     0  0
 10 14  2  0     0  0
M  END