TJLLIN0123
 OpenBabel09292510412D

 45 46  0  0  1  0  0  0  0  0999 V2000
  420.1800   57.2500    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  445.3400   57.2500    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  520.1400   57.2500    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  544.9600   57.2500    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  432.4300   64.1500    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  532.3800   64.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  507.5600   64.6000    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  357.6300   78.1700    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  432.7600   78.1700    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  532.7100   78.5100    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  407.9400   78.5100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  482.7400   78.1700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  507.5600   78.5100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  370.5400   84.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  445.3400   85.1900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  395.3600   85.1900    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  470.1600   85.1900    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  519.8000   85.5200    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  470.4900   99.1000    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  395.7000   99.1000    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  457.9200  106.4500    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  457.9200  120.4700    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  357.9700  125.0300    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  383.1200  125.0300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  370.5400  132.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  445.3400  141.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  345.3900  145.9600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  370.5400  145.9600    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  407.3800   64.1500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  481.8500   64.0400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  556.5300   64.3700    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  456.9100   74.1700    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  382.5600   74.2800    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  420.1800   89.5300    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  494.6500   89.4200    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  369.6500   99.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  444.6700   99.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  378.7800  111.2300    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  441.0000  127.5900    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  345.0500  131.8200    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  394.7000  132.3800    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  426.6400  149.5200    0.0000 N   0  0  0  0  0  1  0  0  0  0  0  0
  457.2500  148.7400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  332.2500  152.8600    0.0000 S   0  0  0  0  0  1  0  0  0  0  0  0
  357.3000  153.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  6  1  0  0  0  0
  4 31  1  0  0  0  0
  6 10  1  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  6  0  0  0
  9 34  1  0  0  0  0
  9  5  1  0  0  0  0
 10 18  2  0  0  0  0
 11 16  1  0  0  0  0
 11 29  2  0  0  0  0
 11 34  1  0  0  0  0
 12 17  1  0  0  0  0
 12 30  2  0  0  0  0
 12 35  1  0  0  0  0
 13 18  1  0  0  0  0
 13 35  1  0  0  0  0
 14 33  1  0  0  0  0
 14 36  2  0  0  0  0
 15 32  1  0  0  0  0
 15 37  2  0  0  0  0
 16 20  1  1  0  0  0
 16 33  1  0  0  0  0
 17 19  1  1  0  0  0
 17 32  1  0  0  0  0
 19 21  1  0  0  0  0
 20 38  1  0  0  0  0
 21 22  1  0  0  0  0
 22 39  1  0  0  0  0
 23 25  2  0  0  0  0
 23 40  1  0  0  0  0
 24 25  1  0  0  0  0
 24 38  1  0  0  0  0
 24 41  2  0  0  0  0
 25 28  1  0  0  0  0
 26 39  1  0  0  0  0
 26 42  1  0  0  0  0
 26 43  2  0  0  0  0
 27 40  2  0  0  0  0
 27 44  1  0  0  0  0
 27 45  1  0  0  0  0
 28 45  2  0  0  0  0
M  END
>  <Formula>
C28N9O7S

$$$$
