KEGG:C06677  Toluene-4-sulfonate
  ISISHOST03240423152D 1   1.00000     0.00000  5740
 11 11  0     0  0            999 V2000
    0.0000   -1.0724    0.0000 S   0  0  3  0  0  0           0  0  0
    0.0000   -0.2310    0.0000 C   0  0  0  0  0  0           0  0  0
    0.0034   -1.8966    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.6966   -1.4966    0.0000 O   0  0  0  0  0  0           0  0  0
    0.7034   -1.4931    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.7000    0.1897    0.0000 C   0  0  0  0  0  0           0  0  0
    0.6966    0.1897    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7000    1.0310    0.0000 C   0  0  0  0  0  0           0  0  0
    0.6966    1.0310    0.0000 C   0  0  0  0  0  0           0  0  0
    0.0000    1.4517    0.0000 C   0  0  0  0  0  0           0  0  0
    0.0000    2.2931    0.0000 C   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
  1  5  2  0     0  0
  2  6  1  0     0  0
  2  7  2  0     0  0
  6  8  2  0     0  0
  7  9  1  0     0  0
  8 10  1  0     0  0
 10 11  1  0     0  0
  9 10  2  0     0  0
M  END