TJLLIN0014
 OpenBabel09292510402D

 50 52  0  0  1  0  0  0  0  0999 V2000
  236.9700  122.5400    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  249.7100  116.0500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  262.1400  123.2300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  274.5600  116.0500    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  286.9900  123.2300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  299.4200  116.0500    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  311.8500  123.2300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  324.2700  116.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  336.7400  123.2500    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  324.2700  101.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  356.4500  116.0500    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  367.4500  125.2600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  380.9800  120.3200    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  358.9200  101.9200    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  347.9200   92.7100    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  372.4000   96.9900    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  364.9800  139.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  396.3800  133.3500    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  409.8800  128.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  420.8700  137.8000    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  393.8300  147.4700    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  404.7800  156.7400    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  402.2300  170.8700    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  413.1800  180.1400    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  410.6300  194.2600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  421.5800  203.5300    0.0000 N   0  0  0  0  0  1  0  0  0  0  0  0
  397.1300  199.1100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  412.4300  114.3800    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  439.9100  128.9900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  451.6400  137.2600    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  464.6700  131.2300    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  465.9600  116.9400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  454.2300  108.6800    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  441.2000  114.7000    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  478.9800  110.9100    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  490.7100  119.1800    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  262.1400  137.5800    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  248.9600  101.7200    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  236.1700   95.2100    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  224.1400  103.0200    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  224.8900  117.3500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  212.8500  125.1700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  200.0700  118.6500    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  212.8500  139.5200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  199.3200  104.3200    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  235.4200   80.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  247.8500   73.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  222.6400   74.3600    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  206.5200   91.8500    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  208.7300   78.0900    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2 38  1  0  0  0  0
  3  4  1  0  0  0  0
  3 37  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
 11  9  1  6  0  0  0
 11 12  1  0  0  0  0
 11 14  1  0  0  0  0
 12 13  1  0  0  0  0
 12 17  2  0  0  0  0
 13 18  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 18 19  1  0  0  0  0
 18 21  1  0  0  0  0
 19 20  1  0  0  0  0
 19 28  2  0  0  0  0
 20 29  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  2  0  0  0  0
 29 30  2  0  0  0  0
 30 31  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
 32 35  1  0  0  0  0
 33 34  2  0  0  0  0
 34 29  1  0  0  0  0
 35 36  1  0  0  0  0
 38 39  1  0  0  0  0
 39 40  1  0  0  0  0
 39 46  1  0  0  0  0
 40 41  1  0  0  0  0
 41  1  1  0  0  0  0
 41 42  1  0  0  0  0
 42 43  1  0  0  0  0
 42 44  2  0  0  0  0
 43 45  1  0  0  0  0
 45 49  1  0  0  0  0
 46 47  2  0  0  0  0
 46 48  1  0  0  0  0
 48 50  1  0  0  0  0
 50 49  1  0  0  0  0
M  END
>  <Formula>
C33N8O8S

$$$$
