COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.859  -0.723  -0.975  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.126   1.496  -0.307  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.465  -2.141   0.337  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.850  -0.203   0.077  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.185  -1.470  -0.092  1.00  0.00           C  
HETATM    6  N   UNL     1       0.341  -0.467  -1.462  1.00  0.00           N  
HETATM    7  C   UNL     1       0.139   1.770  -0.828  1.00  0.00           C  
HETATM    8  C   UNL     1       0.866   0.752  -1.408  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.631   0.230  -0.384  1.00  0.00           N  
HETATM   10  O   UNL     1      -1.778   2.385   0.218  1.00  0.00           O  
HETATM   11  S   UNL     1      -1.802  -2.221  -0.907  1.00  0.00           S  
HETATM   12  F   UNL     1      -4.164  -3.284   1.085  1.00  0.00           F  
HETATM   13  F   UNL     1      -5.215  -1.256   1.119  1.00  0.00           F  
HETATM   14  F   UNL     1      -5.203  -2.504  -0.794  1.00  0.00           F  
HETATM   15  C   UNL     1      -3.799   0.756   0.748  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.206   0.884   0.162  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.193   2.016  -0.024  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.403   3.250   0.750  1.00  0.00           C  
HETATM   19  N   UNL     1      -4.566   4.202   1.348  1.00  0.00           N  
HETATM   20  C   UNL     1       2.238   1.018  -1.970  1.00  0.00           C  
HETATM   21  N   UNL     1       3.251   0.692  -0.963  1.00  0.00           N  
HETATM   22  C   UNL     1       3.751   1.538  -0.038  1.00  0.00           C  
HETATM   23  C   UNL     1       4.659   0.853   0.698  1.00  0.00           C  
HETATM   24  C   UNL     1       4.714  -0.455   0.205  1.00  0.00           C  
HETATM   25  N   UNL     1       3.866  -0.554  -0.786  1.00  0.00           N  
HETATM   26  C   UNL     1       5.593  -1.561   0.730  1.00  0.00           C  
HETATM   27  F   UNL     1       5.914  -2.437  -0.313  1.00  0.00           F  
HETATM   28  F   UNL     1       6.767  -1.013   1.257  1.00  0.00           F  
HETATM   29  F   UNL     1       4.913  -2.260   1.734  1.00  0.00           F  
HETATM   30 CL   UNL     1       3.312   3.204   0.170  1.00  0.00          Cl  
HETATM   31  H   UNL     1       0.548   2.768  -0.772  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.694   0.840   1.830  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.445   0.275  -0.710  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.028   1.053   0.857  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.766   2.151  -1.018  1.00  0.00           H  
HETATM   36  H   UNL     1       2.394   0.400  -2.855  1.00  0.00           H  
HETATM   37  H   UNL     1       2.322   2.070  -2.242  1.00  0.00           H  
HETATM   38  H   UNL     1       5.238   1.247   1.520  1.00  0.00           H  
CONECT    1    9   11    6    6                                       
CONECT    2   10   10    9    7                                       
CONECT    3   12   14    5   13                                       
CONECT    4   15    5    5    9                                       
CONECT    5    3    4    4   11                                       
CONECT    6    1    1    8                                            
CONECT    7    2    8    8   31                                       
CONECT    8    7    7    6   20                                       
CONECT    9    4    2    1                                            
CONECT   10    2    2                                                 
CONECT   11    5    1                                                 
CONECT   12    3                                                      
CONECT   13    3                                                      
CONECT   14    3                                                      
CONECT   15   16    4   17   32                                       
CONECT   16   15   17   33   34                                       
CONECT   17   16   15   18   35                                       
CONECT   18   19   19   19   17                                       
CONECT   19   18   18   18                                            
CONECT   20    8   21   36   37                                       
CONECT   21   20   22   25                                            
CONECT   22   30   21   23   23                                       
CONECT   23   22   22   24   38                                       
CONECT   24   23   25   25   26                                       
CONECT   25   21   24   24                                            
CONECT   26   24   27   29   28                                       
CONECT   27   26                                                      
CONECT   28   26                                                      
CONECT   29   26                                                      
CONECT   30   22                                                      
CONECT   31    7                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
CONECT   38   23                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
