B5617.sdf
  ChemDraw07171714532D

 14 15  0  0  0  0  0  0  0  0999 V2000
    1.6179    1.4392    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8639    1.1044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7769    0.2841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0228   -0.0507    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.4628   -0.7177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2831   -0.6306    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9428   -1.3594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1424   -1.4392    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3352   -0.7920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0011   -0.4860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1323    0.7903    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3119    0.7033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6179    0.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7899   -0.3545    0.0000 Br  0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0      
  2  3  1  0      
  3  4  1  0      
  4  5  1  0      
  5  6  1  0      
  6  7  1  0      
  7  8  1  0      
  8  9  1  0      
  4  9  1  0      
  8 10  1  0      
 10 11  1  0      
 11 12  1  0      
  4 12  1  0      
 11 13  1  0      
  6 13  1  0      
M  CHG  2   4   1  14  -1
M  END
$$$$
