COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.005   1.105  -0.424  1.00  0.00           C  
HETATM    2  C   UNL     1       0.735  -0.023  -0.097  1.00  0.00           C  
HETATM    3  C   UNL     1       0.065  -1.187   0.276  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.319  -1.169   0.305  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.987  -0.006  -0.035  1.00  0.00           C  
HETATM    6  N   UNL     1      -1.323   1.079  -0.384  1.00  0.00           N  
HETATM    7 BR   UNL     1      -3.877   0.028   0.001  1.00  0.00          Br  
HETATM    8  N   UNL     1       2.132   0.007  -0.141  1.00  0.00           N  
HETATM    9  C   UNL     1       2.699  -1.346   0.054  1.00  0.00           C  
HETATM   10  C   UNL     1       4.040  -1.468  -0.512  1.00  0.00           C  
HETATM   11  N   UNL     1       4.998  -0.527   0.113  1.00  0.00           N  
HETATM   12  C   UNL     1       4.845   0.785  -0.466  1.00  0.00           C  
HETATM   13  C   UNL     1       3.895   1.686   0.350  1.00  0.00           C  
HETATM   14  C   UNL     1       2.660   0.909   0.852  1.00  0.00           C  
HETATM   15  H   UNL     1       0.503   2.013  -0.710  1.00  0.00           H  
HETATM   16  H   UNL     1       0.613  -2.081   0.536  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.871  -2.053   0.589  1.00  0.00           H  
HETATM   18  H   UNL     1       2.744  -1.561   1.121  1.00  0.00           H  
HETATM   19  H   UNL     1       2.046  -2.076  -0.426  1.00  0.00           H  
HETATM   20  H   UNL     1       4.397  -2.487  -0.362  1.00  0.00           H  
HETATM   21  H   UNL     1       3.993  -1.264  -1.582  1.00  0.00           H  
HETATM   22  H   UNL     1       4.874  -0.497   1.114  1.00  0.00           H  
HETATM   23  H   UNL     1       1.884   1.622   1.129  1.00  0.00           H  
HETATM   24  H   UNL     1       2.940   0.335   1.735  1.00  0.00           H  
HETATM   25  H   UNL     1       5.824   1.262  -0.520  1.00  0.00           H  
HETATM   26  H   UNL     1       4.449   0.680  -1.476  1.00  0.00           H  
HETATM   27  H   UNL     1       4.436   2.087   1.208  1.00  0.00           H  
HETATM   28  H   UNL     1       3.564   2.513  -0.278  1.00  0.00           H  
CONECT    1    6   15    2    2                                       
CONECT    2    1    1    3    8                                       
CONECT    3    4    4    2   16                                       
CONECT    4    3    3    5   17                                       
CONECT    5    4    6    6    7                                       
CONECT    6    1    5    5                                            
CONECT    7    5                                                      
CONECT    8    2    9   14                                            
CONECT    9    8   18   19   10                                       
CONECT   10    9   20   21   11                                       
CONECT   11   10   22   12                                            
CONECT   12   11   13   25   26                                       
CONECT   13   12   14   27   28                                       
CONECT   14   13    8   23   24                                       
CONECT   15    1                                                      
CONECT   16    3                                                      
CONECT   17    4                                                      
CONECT   18    9                                                      
CONECT   19    9                                                      
CONECT   20   10                                                      
CONECT   21   10                                                      
CONECT   22   11                                                      
CONECT   23   14                                                      
CONECT   24   14                                                      
CONECT   25   12                                                      
CONECT   26   12                                                      
CONECT   27   13                                                      
CONECT   28   13                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
