COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -4.786  -2.188   0.303  1.00  0.00          Cl  
HETATM    2  C   UNL     1       2.002  -3.178   1.855  1.00  0.00           C  
HETATM    3  C   UNL     1       0.484  -3.159  -0.178  1.00  0.00           C  
HETATM    4  O   UNL     1      -0.147   3.345  -0.652  1.00  0.00           O  
HETATM    5  O   UNL     1       2.591  -2.195  -1.783  1.00  0.00           O  
HETATM    6  O   UNL     1       4.181  -2.460   0.127  1.00  0.00           O  
HETATM    7  O   UNL     1       4.691   2.309   1.602  1.00  0.00           O  
HETATM    8  O   UNL     1       2.465   3.715   0.802  1.00  0.00           O  
HETATM    9  F   UNL     1      -5.767   0.214   1.704  1.00  0.00           F  
HETATM   10  C   UNL     1      -4.336   1.770   0.632  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.331   2.033  -0.279  1.00  0.00           C  
HETATM   12  C   UNL     1       3.801   0.327   0.640  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.220  -0.295  -0.833  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.678   1.290  -2.005  1.00  0.00           C  
HETATM   15  C   UNL     1       0.438  -0.021  -1.227  1.00  0.00           C  
HETATM   16  C   UNL     1       0.268   2.205  -0.732  1.00  0.00           C  
HETATM   17  C   UNL     1       3.694   1.678   0.925  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.785   0.472   0.813  1.00  0.00           C  
HETATM   19  C   UNL     1       2.570   2.391   0.521  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.773   1.001  -1.011  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.225  -0.561   0.079  1.00  0.00           C  
HETATM   22  C   UNL     1       1.679   0.373  -0.464  1.00  0.00           C  
HETATM   23  C   UNL     1       2.791  -0.322  -0.055  1.00  0.00           C  
HETATM   24  C   UNL     1       1.548   1.735  -0.175  1.00  0.00           C  
HETATM   25  N   UNL     1       1.762  -2.823   0.455  1.00  0.00           N  
HETATM   26  N   UNL     1      -0.377   1.194  -1.340  1.00  0.00           N  
HETATM   27  S   UNL     1       2.935  -2.041  -0.414  1.00  0.00           S  
HETATM   28  H   UNL     1       2.446  -4.173   1.907  1.00  0.00           H  
HETATM   29  H   UNL     1       2.681  -2.453   2.303  1.00  0.00           H  
HETATM   30  H   UNL     1       1.057  -3.174   2.398  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.245  -2.378   0.039  1.00  0.00           H  
HETATM   32  H   UNL     1       0.622  -3.237  -1.257  1.00  0.00           H  
HETATM   33  H   UNL     1       0.124  -4.110   0.213  1.00  0.00           H  
HETATM   34  H   UNL     1       5.377   2.684   1.033  1.00  0.00           H  
HETATM   35  H   UNL     1       2.832   4.292   0.118  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.769   2.576   1.207  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.981   3.045  -0.420  1.00  0.00           H  
HETATM   38  H   UNL     1       4.675  -0.222   0.955  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.783  -1.100  -1.406  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.725   0.565  -2.818  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.808   2.295  -2.407  1.00  0.00           H  
HETATM   42  H   UNL     1       0.707  -0.385  -2.218  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.109  -0.790  -0.681  1.00  0.00           H  
CONECT    1   21                                                      
CONECT    2   25   28   29   30                                       
CONECT    3   25   31   32   33                                       
CONECT    4   16   16                                                 
CONECT    5   27   27                                                 
CONECT    6   27   27                                                 
CONECT    7   17   34                                                 
CONECT    8   19   35                                                 
CONECT    9   18                                                      
CONECT   10   11   11   18   36                                       
CONECT   11   10   10   20   37                                       
CONECT   12   23   23   17   38                                       
CONECT   13   20   20   21   39                                       
CONECT   14   20   26   40   41                                       
CONECT   15   26   22   42   43                                       
CONECT   16    4    4   26   24                                       
CONECT   17    7   12   19   19                                       
CONECT   18    9   10   21   21                                       
CONECT   19    8   17   17   24                                       
CONECT   20   11   13   13   14                                       
CONECT   21    1   13   18   18                                       
CONECT   22   15   23   24   24                                       
CONECT   23   12   12   22   27                                       
CONECT   24   16   19   22   22                                       
CONECT   25    2    3   27                                            
CONECT   26   14   15   16                                            
CONECT   27    5    5    6    6                                       
CONECT   27   23   25                                                 
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
