COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 BR   UNL     1       3.549  -1.184  -0.416  1.00  0.00          Br  
HETATM    2  C   UNL     1       2.363   0.219   0.030  1.00  0.00           C  
HETATM    3  C   UNL     1       1.078   0.216  -0.470  1.00  0.00           C  
HETATM    4  C   UNL     1       2.788   1.243   0.863  1.00  0.00           C  
HETATM    5  C   UNL     1       1.932   2.273   1.196  1.00  0.00           C  
HETATM    6  C   UNL     1       0.635   2.289   0.698  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.228   3.325   1.033  1.00  0.00           N  
HETATM    8  C   UNL     1       0.200   1.252  -0.142  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.175   1.255  -0.674  1.00  0.00           C  
HETATM   10  O   UNL     1      -1.618   2.254  -1.206  1.00  0.00           O  
HETATM   11  N   UNL     1      -1.940   0.150  -0.570  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.467  -1.020   0.181  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.525  -1.399   1.222  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.112  -2.696   1.921  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.872  -1.603   0.524  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.266   0.097  -1.201  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.301  -0.297  -0.149  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.663  -0.492  -0.819  1.00  0.00           C  
HETATM   19  H   UNL     1       0.751  -0.586  -1.115  1.00  0.00           H  
HETATM   20  H   UNL     1       3.795   1.234   1.253  1.00  0.00           H  
HETATM   21  H   UNL     1       2.270   3.067   1.845  1.00  0.00           H  
HETATM   22  H   UNL     1       0.100   4.086   1.537  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.159   3.287   0.762  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.312  -1.855  -0.503  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.529  -0.779   0.681  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.614  -0.600   1.958  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.151  -2.551   2.416  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.865  -2.965   2.662  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.024  -3.494   1.185  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.776  -2.385  -0.230  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.621  -1.896   1.259  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.516   1.076  -1.610  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.260  -0.643  -2.001  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.373   0.492   0.600  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.401  -0.773  -0.067  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.969   0.438  -1.298  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.590  -1.280  -1.569  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    4    4    3                                       
CONECT    3    2    8    8   19                                       
CONECT    4    2    2    5   20                                       
CONECT    5    4    6    6   21                                       
CONECT    6    5    5    8    7                                       
CONECT    7    6   22   23                                            
CONECT    8    3    3    6    9                                       
CONECT    9    8   11   10   10                                       
CONECT   10    9    9                                                 
CONECT   11    9   12   16                                            
CONECT   12   11   13   24   25                                       
CONECT   13   12   14   15   26                                       
CONECT   14   13   27   28   29                                       
CONECT   15   13   17   30   31                                       
CONECT   16   11   17   32   33                                       
CONECT   17   15   16   18   34                                       
CONECT   18   17   35   36   37                                       
CONECT   19    3                                                      
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24   12                                                      
CONECT   25   12                                                      
CONECT   26   13                                                      
CONECT   27   14                                                      
CONECT   28   14                                                      
CONECT   29   14                                                      
CONECT   30   15                                                      
CONECT   31   15                                                      
CONECT   32   16                                                      
CONECT   33   16                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
