COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.790   0.163   0.018  1.00  0.00           C  
HETATM    2  N   UNL     1      -2.737   1.568  -0.062  1.00  0.00           N  
HETATM    3 BR   UNL     1       3.101  -1.200  -0.005  1.00  0.00          Br  
HETATM    4  C   UNL     1       2.186   1.496   0.095  1.00  0.00           C  
HETATM    5  N   UNL     1      -1.045   3.144   0.069  1.00  0.00           N  
HETATM    6  C   UNL     1       1.266   2.502   0.114  1.00  0.00           C  
HETATM    7  N   UNL     1      -2.339  -0.749  -0.162  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.099   2.193   0.054  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.500   0.836  -0.025  1.00  0.00           C  
HETATM   10  C   UNL     1       0.468  -0.172  -0.047  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.887   0.551  -0.084  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.315   2.821   0.012  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.777  -1.021  -0.223  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.004  -2.509  -0.303  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.776  -3.102   0.573  1.00  0.00           C  
HETATM   16  H   UNL     1       3.238   1.736   0.142  1.00  0.00           H  
HETATM   17  H   UNL     1       1.587   3.531   0.175  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.705  -1.483  -0.177  1.00  0.00           H  
HETATM   19  H   UNL     1       0.173  -1.209  -0.111  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.049   3.612   0.027  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.260  -0.628   0.672  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.201  -0.541  -1.105  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.530  -3.086  -1.083  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.250  -2.525   1.354  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.938  -4.168   0.516  1.00  0.00           H  
CONECT    1    3    4    4   10                                       
CONECT    2   11   11   12                                            
CONECT    3    1                                                      
CONECT    4    1    1    6   16                                       
CONECT    5    8   12   12                                            
CONECT    6    4    8    8   17                                       
CONECT    7   11   13   18                                            
CONECT    8    5    6    6    9                                       
CONECT    9    8   10   10   11                                       
CONECT   10    1    9    9   19                                       
CONECT   11    2    2    7    9                                       
CONECT   12    2    5    5   20                                       
CONECT   13    7   14   21   22                                       
CONECT   14   13   15   15   23                                       
CONECT   15   14   14   24   25                                       
CONECT   16    4                                                      
CONECT   17    6                                                      
CONECT   18    7                                                      
CONECT   19   10                                                      
CONECT   20   12                                                      
CONECT   21   13                                                      
CONECT   22   13                                                      
CONECT   23   14                                                      
CONECT   24   15                                                      
CONECT   25   15                                                      
MASTER        0    0    0    0    0    0    0    0   25    0   25    0
END
