COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.181  -1.166  -0.662  1.00  0.00           C  
HETATM    2  C   UNL     1       2.125  -0.342   0.105  1.00  0.00           C  
HETATM    3  C   UNL     1       2.892   0.110   1.376  1.00  0.00           C  
HETATM    4  C   UNL     1       3.789  -1.122   1.652  1.00  0.00           C  
HETATM    5  N   UNL     1       4.185  -1.608   0.318  1.00  0.00           N  
HETATM    6  N   UNL     1       1.700   0.817  -0.684  1.00  0.00           N  
HETATM    7  S   UNL     1       0.337   0.726  -1.621  1.00  0.00           S  
HETATM    8  C   UNL     1      -1.031   0.508  -0.532  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.364   1.503   0.368  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.438   1.332   1.223  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.178   0.165   1.177  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.845  -0.830   0.277  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.774  -0.656  -0.582  1.00  0.00           C  
HETATM   14 BR   UNL     1      -3.857  -2.426   0.214  1.00  0.00          Br  
HETATM   15 BR   UNL     1      -0.352   3.099   0.431  1.00  0.00          Br  
HETATM   16  O   UNL     1       0.175   2.006  -2.218  1.00  0.00           O  
HETATM   17  O   UNL     1       0.447  -0.474  -2.373  1.00  0.00           O  
HETATM   18  C   UNL     1       5.302  -2.350   0.037  1.00  0.00           C  
HETATM   19  N   UNL     1       5.544  -2.720  -1.178  1.00  0.00           N  
HETATM   20  C   UNL     1       5.023  -0.712   2.457  1.00  0.00           C  
HETATM   21  H   UNL     1       2.710  -2.032  -1.127  1.00  0.00           H  
HETATM   22  H   UNL     1       3.655  -0.545  -1.423  1.00  0.00           H  
HETATM   23  H   UNL     1       1.269  -0.963   0.368  1.00  0.00           H  
HETATM   24  H   UNL     1       3.495   0.995   1.174  1.00  0.00           H  
HETATM   25  H   UNL     1       2.205   0.287   2.204  1.00  0.00           H  
HETATM   26  H   UNL     1       3.227  -1.889   2.186  1.00  0.00           H  
HETATM   27  H   UNL     1       2.216   1.638  -0.657  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.698   2.109   1.926  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.016   0.031   1.845  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.514  -1.434  -1.285  1.00  0.00           H  
HETATM   31  H   UNL     1       5.980  -2.626   0.831  1.00  0.00           H  
HETATM   32  H   UNL     1       6.334  -3.246  -1.377  1.00  0.00           H  
HETATM   33  H   UNL     1       4.710  -0.280   3.408  1.00  0.00           H  
HETATM   34  H   UNL     1       5.644  -1.589   2.644  1.00  0.00           H  
HETATM   35  H   UNL     1       5.596   0.025   1.894  1.00  0.00           H  
CONECT    1    2    5   21   22                                       
CONECT    2    1    6    3   23                                       
CONECT    3    2    4   24   25                                       
CONECT    4    3    5   20   26                                       
CONECT    5    1    4   18                                            
CONECT    6    2    7   27                                            
CONECT    7    6    8   16   16                                       
CONECT    7   17   17                                                 
CONECT    8    7    9    9   13                                       
CONECT    9    8    8   10   15                                       
CONECT   10    9   11   11   28                                       
CONECT   11   10   10   12   29                                       
CONECT   12   11   14   13   13                                       
CONECT   13    8   12   12   30                                       
CONECT   14   12                                                      
CONECT   15    9                                                      
CONECT   16    7    7                                                 
CONECT   17    7    7                                                 
CONECT   18    5   19   19   31                                       
CONECT   19   18   18   32                                            
CONECT   20    4   33   34   35                                       
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    6                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   13                                                      
CONECT   31   18                                                      
CONECT   32   19                                                      
CONECT   33   20                                                      
CONECT   34   20                                                      
CONECT   35   20                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
