KEGG:C06337  Terephthalate
  ISISHOST03240423142D 1   1.00000     0.00000  5409
 12 12  0     0  0            999 V2000
    0.0000   -0.8172    0.0000 C   0  0  0  0  0  0           0  0  0
    0.0034   -1.6552    0.0000 C   0  0  0  0  0  0           0  0  0
   -0.7172   -0.4069    0.0000 C   0  0  0  0  0  0           0  0  0
    0.7069   -0.4069    0.0000 C   0  0  0  0  0  0           0  0  0
    0.7310   -2.0690    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.7241   -2.0724    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.7172    0.4138    0.0000 C   0  0  0  0  0  0           0  0  0
    0.7069    0.4138    0.0000 C   0  0  0  0  0  0           0  0  0
    0.0000    0.8241    0.0000 C   0  0  0  0  0  0           0  0  0
    0.0000    1.6448    0.0000 C   0  0  0  0  0  0           0  0  0
    0.7276    2.0655    0.0000 O   0  0  0  0  0  0           0  0  0
   -0.7241    2.0690    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  2  0     0  0
  2  5  1  0     0  0
  2  6  2  0     0  0
  3  7  2  0     0  0
  4  8  1  0     0  0
  7  9  1  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 10 12  2  0     0  0
  8  9  2  0     0  0
M  END