COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.132  -2.647  -1.472  1.00  0.00           C  
HETATM    2  C   UNL     1       1.048  -1.268  -2.090  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.123  -0.727  -1.868  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.985  -0.279  -0.568  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.818   0.388   0.307  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.541   0.397   1.661  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.423  -0.259   2.136  1.00  0.00           C  
HETATM    8  C   UNL     1       1.682  -1.299   0.654  1.00  0.00           C  
HETATM    9  C   UNL     1       2.974  -1.793   0.650  1.00  0.00           C  
HETATM   10  C   UNL     1       4.039  -0.941   0.425  1.00  0.00           C  
HETATM   11  C   UNL     1       3.812   0.405   0.202  1.00  0.00           C  
HETATM   12  C   UNL     1       2.520   0.899   0.206  1.00  0.00           C  
HETATM   13  C   UNL     1       1.455   0.045   0.426  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.991  -1.669  -1.074  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.030  -2.672  -0.440  1.00  0.00           C  
HETATM   16  C   UNL     1       0.522  -2.228   0.899  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.577  -0.924   1.256  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.861  -0.946  -0.102  1.00  0.00           C  
HETATM   19  N   UNL     1      -6.494   0.151  -0.290  1.00  0.00           N  
HETATM   20  N   UNL     1      -0.437  -1.552   1.744  1.00  0.00           N  
HETATM   21  O   UNL     1      -5.557   2.230   0.656  1.00  0.00           O  
HETATM   22  O   UNL     1      -4.976   1.523  -1.670  1.00  0.00           O  
HETATM   23  S   UNL     1      -5.239   1.232  -0.305  1.00  0.00           S  
HETATM   24 BR   UNL     1       5.269   1.572  -0.098  1.00  0.00          Br  
HETATM   25  H   UNL     1       0.985  -3.415  -2.231  1.00  0.00           H  
HETATM   26  H   UNL     1       2.090  -2.782  -0.971  1.00  0.00           H  
HETATM   27  H   UNL     1       1.847  -0.795  -2.641  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.424   0.254  -2.205  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.209  -0.283  -1.625  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.197   0.915   2.345  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.205  -0.255   3.194  1.00  0.00           H  
HETATM   32  H   UNL     1       3.151  -2.844   0.824  1.00  0.00           H  
HETATM   33  H   UNL     1       5.048  -1.327   0.423  1.00  0.00           H  
HETATM   34  H   UNL     1       2.343   1.950   0.033  1.00  0.00           H  
HETATM   35  H   UNL     1       0.446   0.430   0.429  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.630  -2.214  -1.769  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.482  -3.663  -0.378  1.00  0.00           H  
HETATM   38  H   UNL     1       0.889  -3.106   1.431  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.350  -0.756   0.021  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.374   0.426  -0.593  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.277  -1.535   2.701  1.00  0.00           H  
CONECT    1   15    2   25   26                                       
CONECT    2    1    3    3   27                                       
CONECT    3    2    2   14   28                                       
CONECT    4   18   18    5   29                                       
CONECT    5    6    6    4   23                                       
CONECT    6    7    5    5   30                                       
CONECT    7   17   17    6   31                                       
CONECT    8   13   13    9   16                                       
CONECT    9   10   10    8   32                                       
CONECT   10   11    9    9   33                                       
CONECT   11   24   12   12   10                                       
CONECT   12   11   11   13   34                                       
CONECT   13   12    8    8   35                                       
CONECT   14   15    3   18   36                                       
CONECT   15    1   16   14   37                                       
CONECT   16    8   20   15   38                                       
CONECT   17   20    7    7   18                                       
CONECT   18   17   14    4    4                                       
CONECT   19   23   39   40                                            
CONECT   20   16   17   41                                            
CONECT   21   23   23                                                 
CONECT   22   23   23                                                 
CONECT   23    5   22   22   21                                       
CONECT   23   21   19                                                 
CONECT   24   11                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
