cxylin0553
 OpenBabel09292510402D

 45 47  0  0  1  0  0  0  0  0999 V2000
  261.9600   46.0500    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  286.2100   45.6100    0.0000 C   0  0  0  0  0  1  0  0  0  0  0  0
  360.3900   45.6100    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  384.9700   45.6100    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  273.8100   52.4200    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  372.9000   52.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  348.3200   52.7500    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  274.1400   67.0100    0.0000 C   0  0  3  0  0  3  0  0  0  0  0  0
  347.8800   67.0100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  145.7600   67.4500    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  222.0200   67.7800    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  247.0400   67.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  323.6300   67.0100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  372.9000   67.0100    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  286.9800   74.1400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  132.9200   74.9100    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  158.9200   74.9100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  185.3700   74.9100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  209.9500   74.9100    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  234.8600   74.9100    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  311.5600   74.1400    0.0000 C   0  0  2  0  0  3  0  0  0  0  0  0
  360.7200   74.1400    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  311.2300   88.4100    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  132.5900   89.8400    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  158.9200   89.8400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  184.9300   89.8400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  323.3000   95.9800    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  146.4200   97.4100    0.0000 C   0  0  0  0  0  3  0  0  0  0  0  0
  198.5400   98.8300    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  323.3000  109.8100    0.0000 C   0  0  0  0  0  2  0  0  0  0  0  0
  335.8100  131.2100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  246.1600   52.9700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  322.7500   52.4200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  396.6000   52.6400    0.0000 O   0  0  0  0  0  1  0  0  0  0  0  0
  298.3900   62.9500    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  171.2100   67.0100    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  196.3400   67.4500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  260.9800   78.0900    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  335.0400   78.0900    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  285.6700   88.4100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  171.4300   97.4100    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  197.4400  111.2300    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
  338.8900  116.8300    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
  322.6400  138.2300    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  353.2600  139.4400    0.0000 N   0  0  0  0  0  1  0  0  0  0  0  0
  1  5  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  6  1  0  0  0  0
  4 34  1  0  0  0  0
  5  8  1  0  0  0  0
  6 14  2  0  0  0  0
  7  9  1  0  0  0  0
  8 15  1  0  0  0  0
  8 38  1  0  0  0  0
  9 22  2  0  0  0  0
  9 39  1  0  0  0  0
 10 16  2  0  0  0  0
 10 17  1  0  0  0  0
 11 19  1  0  0  0  0
 11 20  1  0  0  0  0
 12 20  1  0  0  0  0
 12 32  2  0  0  0  0
 12 38  1  0  0  0  0
 13 21  1  0  0  0  0
 13 33  2  0  0  0  0
 13 39  1  0  0  0  0
 14 22  1  0  0  0  0
 15 35  1  0  0  0  0
 15 40  2  0  0  0  0
 16 24  1  0  0  0  0
 17 25  2  0  0  0  0
 17 36  1  0  0  0  0
 18 26  1  0  0  0  0
 18 36  2  0  0  0  0
 18 37  1  0  0  0  0
 19 37  1  0  0  0  0
 21 23  1  1  0  0  0
 21 35  1  0  0  0  0
 23 27  1  0  0  0  0
 24 28  2  0  0  0  0
 25 28  1  0  0  0  0
 25 41  1  0  0  0  0
 26 29  1  0  0  0  0
 26 41  2  0  0  0  0
 27 30  1  0  0  0  0
 29 42  1  0  0  0  0
 30 43  1  0  0  0  0
 31 43  1  0  0  0  0
 31 44  2  0  0  0  0
 31 45  1  0  0  0  0
M  END
>  <Formula>
C31BrN7O6

$$$$
