COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.435  -1.171  -2.057  1.00  0.00           C  
HETATM    2  O   UNL     1      -2.141  -1.824  -1.309  1.00  0.00           O  
HETATM    3  C   UNL     1      -2.029  -0.260  -3.043  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.162   0.477  -3.880  1.00  0.00           C  
HETATM    5  C   UNL     1       0.280   0.289  -3.731  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.409  -0.104  -3.167  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.909   0.764  -4.111  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.054   1.483  -4.937  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.698   1.346  -4.833  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.091  -1.271  -1.993  1.00  0.00           N  
HETATM   11  N   UNL     1       0.740  -0.534  -2.837  1.00  0.00           N  
HETATM   12  C   UNL     1       0.511  -2.177  -1.013  1.00  0.00           C  
HETATM   13  C   UNL     1       0.750  -1.435   0.276  1.00  0.00           C  
HETATM   14  C   UNL     1       1.579  -0.034   2.357  1.00  0.00           C  
HETATM   15  C   UNL     1       0.286  -0.606   2.398  1.00  0.00           C  
HETATM   16  C   UNL     1       2.089   0.708   3.394  1.00  0.00           C  
HETATM   17  C   UNL     1       1.320   0.911   4.525  1.00  0.00           C  
HETATM   18  C   UNL     1       0.048   0.362   4.592  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.465  -0.375   3.571  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.054  -1.298   1.291  1.00  0.00           N  
HETATM   21  S   UNL     1       2.163  -0.549   0.762  1.00  0.00           S  
HETATM   22  C   UNL     1       1.234   1.055  -4.611  1.00  0.00           C  
HETATM   23  C   UNL     1       2.652   0.688  -4.254  1.00  0.00           C  
HETATM   24  O   UNL     1       2.865  -0.113  -3.376  1.00  0.00           O  
HETATM   25  O   UNL     1       3.677   1.251  -4.913  1.00  0.00           O  
HETATM   26  C   UNL     1      -0.784   0.587   5.828  1.00  0.00           C  
HETATM   27  F   UNL     1      -0.064   1.365   6.740  1.00  0.00           F  
HETATM   28  F   UNL     1      -1.965   1.251   5.479  1.00  0.00           F  
HETATM   29  F   UNL     1      -1.097  -0.645   6.411  1.00  0.00           F  
HETATM   30  H   UNL     1      -4.080  -0.661  -2.529  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.977   0.888  -4.211  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.466   2.159  -5.671  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.044   1.910  -5.481  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.162  -3.015  -0.830  1.00  0.00           H  
HETATM   35  H   UNL     1       1.459  -2.552  -1.398  1.00  0.00           H  
HETATM   36  H   UNL     1       3.081   1.129   3.326  1.00  0.00           H  
HETATM   37  H   UNL     1       1.707   1.493   5.349  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.459  -0.788   3.658  1.00  0.00           H  
HETATM   39  H   UNL     1       1.088   2.125  -4.461  1.00  0.00           H  
HETATM   40  H   UNL     1       1.046   0.805  -5.655  1.00  0.00           H  
HETATM   41  H   UNL     1       4.586   1.015  -4.684  1.00  0.00           H  
CONECT    1    2    2    3   10                                       
CONECT    2    1    1                                                 
CONECT    3    1    4    4    6                                       
CONECT    4    3    3    5    9                                       
CONECT    5    4   11   11   22                                       
CONECT    6    3    7    7   30                                       
CONECT    7    6    6    8   31                                       
CONECT    8    7    9    9   32                                       
CONECT    9    4    8    8   33                                       
CONECT   10    1   11   12                                            
CONECT   11    5    5   10                                            
CONECT   12   10   13   34   35                                       
CONECT   13   12   20   20   21                                       
CONECT   14   15   15   16   21                                       
CONECT   15   14   14   19   20                                       
CONECT   16   14   17   17   36                                       
CONECT   17   16   16   18   37                                       
CONECT   18   17   19   19   26                                       
CONECT   19   15   18   18   38                                       
CONECT   20   13   13   15                                            
CONECT   21   13   14                                                 
CONECT   22    5   23   39   40                                       
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   41                                                 
CONECT   26   18   27   28   29                                       
CONECT   27   26                                                      
CONECT   28   26                                                      
CONECT   29   26                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   19                                                      
CONECT   39   22                                                      
CONECT   40   22                                                      
CONECT   41   25                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
