TJL0159
 OpenBabel09292510182D

 95  4  0  0  0  0  0  0  0  0999 V2000
  432.4800   96.6400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  504.9100   96.6400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  553.6800   96.3000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  578.1200   96.6400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  626.1000   96.6400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  650.9900   96.6400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  481.1400   96.6400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  407.6000   97.6400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  445.0900  103.2200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  469.2000  103.6700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  517.1800  103.2200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  541.7400  103.6700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  589.7200  103.2200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  614.6100  103.6700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  663.2700  103.6700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  398.4400  108.4700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  418.7600  117.9500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  468.8600  117.9500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  405.4800  121.0800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  481.1400  125.3200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  480.8000  139.3800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  548.4300  142.1700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  524.5500  156.9000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  548.7700  156.5700    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  598.8700  160.3600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  512.2700  163.8200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  560.6000  163.8200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  585.4800  165.6100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  623.6500  166.7200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  610.0300  169.1800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  511.9400  178.8900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  630.3400  179.3300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  583.8100  180.0000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  607.9100  183.1300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  849.3000  184.1300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  776.4300  184.1300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  800.6400  184.5800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  886.1300  185.5800    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  595.3000  188.7100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  836.6900  191.1600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  861.5700  191.1600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  788.7000  191.1600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  812.8100  191.1600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  892.0400  198.5300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  905.9900  200.6500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  755.4500  203.4400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  621.1900  204.8900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  837.0200  205.5600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  861.5700  205.5600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  675.8800  207.3400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  690.2700  207.3400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  646.0800  209.0200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  849.3000  213.2600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  633.1300  213.5900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  872.4000  214.7100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  908.1100  214.7100    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  761.3600  216.7200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  668.8500  219.6200    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  655.2300  220.2900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  696.8600  220.2900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  738.9300  219.9500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  895.8400  221.2900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  921.8400  220.9600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  725.9800  226.5400    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  647.2000  232.2300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  676.2100  232.5600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  690.2700  232.5600    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  622.3100  236.6900    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  753.3300  240.6000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  480.0200   81.6800    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  553.4500   81.9100    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  626.3300   81.9100    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  404.5800   83.2500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  456.8100   91.8400    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  529.1300   91.8400    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  602.0000   91.8400    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  675.7600   94.8500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  419.8700  103.1100    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  492.6300  107.4600    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  565.7300  107.4600    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  638.2700  107.4600    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  382.3700  108.4700    0.0000 S   0  0  0  0  0 15  0  0  0  0  0  0
  444.2000  117.6200    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  517.1800  117.8400    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  589.5000  117.8400    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  428.9100  127.2200    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  523.6600  141.5000    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  467.8600  145.9700    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  574.6600  152.1000    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  495.9800  156.6800    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  895.1700  171.9700    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  883.2100  164.0300    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  907.1200  179.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  903.1000  160.0100    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  887.2300  183.9200    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
 91 92  2  0  0  0  0
 91 93  2  0  0  0  0
 91 94  1  0  0  0  0
 95 91  1  0  0  0  0
M  CHG  1  94  -1
M  END
>  <Formula>
C70N9O14S2-

$$$$
TJL0159
 OpenBabel09292510183D

 21  1  0  0  0  0  0  0  0  0999 V2000
  887.2300  183.9200    0.0000 *   0  0  0  0  0  0  0  0  0  0  0  0
  536.1600  168.0600    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  775.7600  169.2900    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  872.0600  178.2200    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  560.1500  178.1100    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  824.0800  184.1300    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  901.5300  188.6000    0.0000 H   0  0  0  0  0 15  0  0  0  0  0  0
  620.1900  189.2600    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  757.6800  190.7200    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  741.0500  205.0000    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  710.0300  215.7100    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  885.2300  211.1400    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  608.1400  212.0300    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  817.3800  212.9200    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  750.9800  226.2000    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  633.0200  228.1000    0.0000 N   0  0  0  0  0 15  0  0  0  0  0  0
  868.6100  228.5500    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  724.9800  240.2700    0.0000 O   0  0  0  0  0 15  0  0  0  0  0  0
  808.5700  205.7800    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  688.2400  102.0500    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
  305.3100  107.1300    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
 14 19  1  0  0  0  0
M  END
>  <Formula>
C3N9O7

$$$$
