KEGG:C06678  4-Sulfobenzyl alcohol
  ISISHOST03240423152D 1   1.00000     0.00000  5741
 12 12  0     0  0            999 V2000
   -0.0586   -0.4379    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7759   -0.0241    0.0000 C   0  0  0  0  0  0           0  0  0
    0.6517   -0.0241    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.0586   -1.2621    0.0000 S   0  0  3  0  0  0           0  0  0
   -0.7759    0.8000    0.0000 C   0  0  0  0  0  0           0  0  0
    0.6517    0.8000    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.0552   -2.2069    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.7724   -1.6759    0.0000 O   0  0  0  0  0  0           0  0  0
    0.6552   -1.6724    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.0586    1.2138    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.0586    2.0379    0.0000 C   0  0  0  0  0  0           0  0  0
    0.6552    2.4483    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
 10 11  1  0     0  0
 11 12  1  0     0  0
  6 10  2  0     0  0
M  END