KEGG:C00606  3-Sulfino-L-alanine
  ISISHOST03240423022D 1   1.00000     0.00000   582
  9  8  0     1  0            999 V2000
   -0.3172   -0.0931    0.0000 C   0  0  1  0  0  0           0  0  0
    0.3966    0.3207    0.0000 C   0  0  0  0  0  0           0  0  0
   -1.0310    0.3207    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.3172   -0.9172    0.0000 N   0  0  0  0  0  0           0  0  0
    1.1103   -0.0931    0.0000 S   0  0  3  0  0  0           0  0  0
   -1.7448   -0.0931    0.0000 O   0  0  0  0  0  0           0  0  0
   -1.0310    1.1448    0.0000 O   0  0  0  0  0  0           0  0  0
    1.8276    0.3207    0.0000 O   0  0  0  0  0  0           0  0  0
    1.1103   -0.9172    0.0000 O   0  0  0  0  0  0           0  0  0
  1  2  1  0     0  0
  1  3  1  0     0  0
  1  4  1  6     0  0
  2  5  1  0     0  0
  3  6  1  0     0  0
  3  7  2  0     0  0
  5  8  2  0     0  0
  5  9  2  0     0  0
M  END