TJL0540
 OpenBabel09292510192D

 68 72  0  0  1  0  0  0  0  0999 V2000
  540.6400  138.2800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  339.1000  142.6300    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  352.7100  145.0300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  528.5500  145.0300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  331.3600  153.9600    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  379.4000  159.6300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  403.9200  159.6300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  453.8100  159.6300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  478.6500  159.6300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  503.6000  159.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  528.5500  159.6300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  340.9500  165.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  366.5500  166.8200    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  416.3400  166.8200    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  441.2900  166.8200    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  490.7400  166.8200    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  540.1000  123.3500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  362.9500  135.6600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  502.8400  144.9200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  353.9100  159.1900    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  428.5400  159.6300    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  515.3700  169.1100    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  390.9500  166.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  465.4700  166.4900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  337.6800  179.2400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  236.4600  153.4600    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  234.7000  144.1300    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  575.1900  139.7600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  562.6800  148.7500    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  587.6600  146.9600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  600.1300  139.7600    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  600.1300  125.3600    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  587.6600  118.1600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  575.1900  125.3600    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  587.6600  161.3600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  587.6600  103.7600    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  600.1300   96.5600    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
  613.5000  164.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  601.0300  171.2000    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  601.0300  185.6000    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  613.5000  192.8000    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  625.9700  185.6000    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  625.9700  171.2000    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  638.4400  164.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  613.5000  207.2000    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  590.8500  195.7800    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  636.1500  195.7800    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  612.6000  103.7600    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  625.0700   96.5600    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  625.0700   82.1600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  612.6000   74.9600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  600.1300   82.1600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  587.6600   74.9600    0.0000 N   0  0  0  0  0  1  0  0  0  0  0  0
  612.6000   60.5600    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
  637.5400   74.9600    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  649.5000   90.5000    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  661.9700   97.7000    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  672.6700   88.0600    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  666.8200   74.9100    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  652.4900   76.4100    0.0000 C   0  0  1  0  0  3  0  0  0  0  0  0
  670.5400   61.0000    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  687.0700   88.0600    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  600.1300   53.3600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  625.0700   53.3600    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  665.7000  111.6100    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  655.5200  121.7900    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  650.9100  171.2000    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  638.4400  149.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1 17  2  0  0  0  0
  1 29  1  0  0  0  0
  2  3  1  0  0  0  0
  2  5  1  0  0  0  0
  2 27  1  0  0  0  0
  3 18  2  0  0  0  0
  3 20  1  0  0  0  0
  4 11  1  0  0  0  0
  5 12  1  0  0  0  0
  5 26  1  0  0  0  0
  6 13  1  0  0  0  0
  6 23  1  0  0  0  0
  7 14  1  0  0  0  0
  7 23  1  0  0  0  0
  8 15  1  0  0  0  0
  8 24  1  0  0  0  0
  9 16  1  0  0  0  0
  9 24  1  0  0  0  0
 10 16  1  0  0  0  0
 10 19  2  0  0  0  0
 10 22  1  0  0  0  0
 11 22  1  0  0  0  0
 12 20  1  0  0  0  0
 12 25  2  0  0  0  0
 13 20  1  0  0  0  0
 14 21  1  0  0  0  0
 15 21  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  2  0  0  0  0
 30 31  1  0  0  0  0
 30 35  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 33 36  1  0  0  0  0
 34 28  1  0  0  0  0
 36 37  1  0  0  0  0
 37 48  2  0  0  0  0
 38 39  1  0  0  0  0
 39 40  1  0  0  0  0
 39 35  1  1  0  0  0
 40 41  1  0  0  0  0
 40 46  1  6  0  0  0
 41 42  1  0  0  0  0
 41 45  1  1  0  0  0
 42 43  1  0  0  0  0
 42 47  1  6  0  0  0
 43 38  1  0  0  0  0
 43 44  1  1  0  0  0
 44 67  1  0  0  0  0
 44 68  2  0  0  0  0
 48 49  1  0  0  0  0
 49 50  2  0  0  0  0
 50 51  1  0  0  0  0
 50 55  1  0  0  0  0
 51 52  2  0  0  0  0
 51 54  1  0  0  0  0
 52 37  1  0  0  0  0
 52 53  1  0  0  0  0
 54 63  2  0  0  0  0
 54 64  1  0  0  0  0
 56 57  1  0  0  0  0
 57 58  1  0  0  0  0
 57 65  1  6  0  0  0
 58 59  1  0  0  0  0
 58 62  1  1  0  0  0
 59 60  1  0  0  0  0
 59 61  1  1  0  0  0
 60 56  1  0  0  0  0
 60 55  1  1  0  0  0
 65 66  1  0  0  0  0
M  CHG  3  37   1  54   1  64  -1
M  END
>  <Formula>
C41N8O19+

$$$$
