COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.104  -1.920   0.283  1.00  0.00           N  
HETATM    2  N   UNL     1       6.260   2.061  -1.303  1.00  0.00           N  
HETATM    3  C   UNL     1      -1.550  -0.449  -0.755  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.064  -0.680  -0.854  1.00  0.00           C  
HETATM    5  C   UNL     1       2.986  -0.756   0.402  1.00  0.00           C  
HETATM    6  C   UNL     1       4.382  -1.168   0.940  1.00  0.00           C  
HETATM    7  C   UNL     1       5.308  -0.073   0.370  1.00  0.00           C  
HETATM    8  C   UNL     1       5.114   1.528  -1.575  1.00  0.00           C  
HETATM    9 CL   UNL     1      -5.989   0.242  -0.462  1.00  0.00          Cl  
HETATM   10  C   UNL     1      -4.277  -0.024  -0.575  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.790  -1.103  -1.292  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.427  -1.311  -1.386  1.00  0.00           C  
HETATM   13  S   UNL     1       0.473  -1.750   0.509  1.00  0.00           S  
HETATM   14  O   UNL     1      -0.043  -3.064   0.345  1.00  0.00           O  
HETATM   15  O   UNL     1       0.361  -1.069   1.752  1.00  0.00           O  
HETATM   16  N   UNL     1       4.631   0.508  -0.798  1.00  0.00           N  
HETATM   17  C   UNL     1       3.345  -0.187  -0.994  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.036   0.623  -0.029  1.00  0.00           C  
HETATM   19 BR   UNL     1      -0.837   1.799   0.840  1.00  0.00          Br  
HETATM   20  C   UNL     1      -3.400   0.836   0.062  1.00  0.00           C  
HETATM   21  H   UNL     1       2.476  -2.790   0.068  1.00  0.00           H  
HETATM   22  H   UNL     1       6.777   1.740  -0.549  1.00  0.00           H  
HETATM   23  H   UNL     1       0.167  -1.160  -1.805  1.00  0.00           H  
HETATM   24  H   UNL     1       0.457   0.275  -0.792  1.00  0.00           H  
HETATM   25  H   UNL     1       2.535   0.010   1.032  1.00  0.00           H  
HETATM   26  H   UNL     1       4.394  -1.155   2.030  1.00  0.00           H  
HETATM   27  H   UNL     1       4.665  -2.151   0.564  1.00  0.00           H  
HETATM   28  H   UNL     1       5.478   0.697   1.122  1.00  0.00           H  
HETATM   29  H   UNL     1       6.258  -0.514   0.066  1.00  0.00           H  
HETATM   30  H   UNL     1       4.537   1.885  -2.416  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.475  -1.779  -1.782  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.047  -2.148  -1.953  1.00  0.00           H  
HETATM   33  H   UNL     1       3.457  -0.996  -1.715  1.00  0.00           H  
HETATM   34  H   UNL     1       2.581   0.516  -1.326  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.780   1.678   0.621  1.00  0.00           H  
CONECT    1   13    5   21                                            
CONECT    2    8    8   22                                            
CONECT    3   12    4   18   18                                       
CONECT    4   13    3   23   24                                       
CONECT    5    1    6   17   25                                       
CONECT    6    7    5   26   27                                       
CONECT    7   16    6   28   29                                       
CONECT    8    2    2   16   30                                       
CONECT    9   10                                                      
CONECT   10   11    9   20   20                                       
CONECT   11   12   12   10   31                                       
CONECT   12   11   11    3   32                                       
CONECT   13   14   14    1    4                                       
CONECT   13   15   15                                                 
CONECT   14   13   13                                                 
CONECT   15   13   13                                                 
CONECT   16    8    7   17                                            
CONECT   17   16    5   33   34                                       
CONECT   18    3    3   20   19                                       
CONECT   19   18                                                      
CONECT   20   10   10   18   35                                       
CONECT   21    1                                                      
CONECT   22    2                                                      
CONECT   23    4                                                      
CONECT   24    4                                                      
CONECT   25    5                                                      
CONECT   26    6                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   17                                                      
CONECT   34   17                                                      
CONECT   35   20                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
