COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -5.691  -2.276   1.331  1.00  0.00          Cl  
HETATM    2  S   UNL     1       2.327   0.147  -0.221  1.00  0.00           S  
HETATM    3  C   UNL     1       1.821   1.144   1.089  1.00  0.00           C  
HETATM    4  N   UNL     1       2.890   1.242   1.913  1.00  0.00           N  
HETATM    5  C   UNL     1       4.021   0.582   1.540  1.00  0.00           C  
HETATM    6  C   UNL     1       3.968  -0.097   0.400  1.00  0.00           C  
HETATM    7 BR   UNL     1       5.353  -1.112  -0.392  1.00  0.00          Br  
HETATM    8  N   UNL     1       0.624   1.703   1.256  1.00  0.00           N  
HETATM    9  S   UNL     1      -2.737   1.839  -0.611  1.00  0.00           S  
HETATM   10  N   UNL     1      -1.547   2.077   0.516  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.336   1.511   0.347  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.116   0.824  -0.636  1.00  0.00           O  
HETATM   13  O   UNL     1      -3.885   2.527  -0.133  1.00  0.00           O  
HETATM   14  O   UNL     1      -2.147   2.097  -1.878  1.00  0.00           O  
HETATM   15  C   UNL     1      -3.141   0.124  -0.589  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.131  -0.342   0.254  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.470  -0.754  -1.421  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.447  -1.689   0.271  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.786  -2.099  -1.405  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.772  -2.568  -0.557  1.00  0.00           C  
HETATM   21  H   UNL     1       2.853   1.760   2.733  1.00  0.00           H  
HETATM   22  H   UNL     1       4.918   0.610   2.141  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.722   2.624   1.298  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.657   0.345   0.900  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.699  -0.388  -2.083  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.262  -2.785  -2.055  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.019  -3.619  -0.544  1.00  0.00           H  
CONECT    1   18                                                      
CONECT    2    3    6                                                 
CONECT    3    2    4    8    8                                       
CONECT    4    3    5   21                                            
CONECT    5    4    6    6   22                                       
CONECT    6    2    5    5    7                                       
CONECT    7    6                                                      
CONECT    8    3    3   11                                            
CONECT    9   10   13   13   14                                       
CONECT    9   14   15                                                 
CONECT   10    9   11   23                                            
CONECT   11    8   10   12   12                                       
CONECT   12   11   11                                                 
CONECT   13    9    9                                                 
CONECT   14    9    9                                                 
CONECT   15    9   16   16   17                                       
CONECT   16   15   15   18   24                                       
CONECT   17   15   19   19   25                                       
CONECT   18    1   16   20   20                                       
CONECT   19   17   17   20   26                                       
CONECT   20   18   18   19   27                                       
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23   10                                                      
CONECT   24   16                                                      
CONECT   25   17                                                      
CONECT   26   19                                                      
CONECT   27   20                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
