TJLPAY0162
 OpenBabel09292510482D

 13 14  0  0  0  0  0  0  0  0999 V2000
  664.7400   51.1900    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  650.8500   54.9700    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  675.0800   61.6400    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  671.3000   75.5300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  697.7600   79.3100    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
  657.4100   79.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  681.4200   85.5300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  653.9600   93.2100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  678.3000   99.4300    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  663.6300  103.3200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  647.1800   68.4200    0.0000 N   0  3  0  0  0  3  0  0  0  0  0  0
  636.4000   96.3200    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  655.6300  117.5500    0.0000 N   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  2 11  2  0  0  0  0
  3  4  1  0  0  0  0
  4  6  1  0  0  0  0
  4  7  2  0  0  0  0
  5  7  1  0  0  0  0
  6  8  2  0  0  0  0
  6 11  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 12  1  0  0  0  0
  9 10  2  0  0  0  0
 10 13  1  0  0  0  0
M  CHG  1  11   1
M  END
>  <Formula>
C9IN2O+

$$$$
