COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.886  -0.732   1.742  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.707   0.308   0.666  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.590   1.347   0.479  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.283   2.182  -0.520  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.652   0.301  -0.198  1.00  0.00           C  
HETATM    6  C   UNL     1       0.275  -2.560  -1.517  1.00  0.00           C  
HETATM    7  C   UNL     1       2.636   1.870   0.581  1.00  0.00           C  
HETATM    8  S   UNL     1      -3.795   1.664  -1.301  1.00  0.00           S  
HETATM    9  C   UNL     1      -2.570  -0.689  -0.209  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.455  -1.698   0.596  1.00  0.00           N  
HETATM   11  O   UNL     1      -1.305  -2.480   0.334  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.423  -1.692  -0.477  1.00  0.00           C  
HETATM   13  C   UNL     1       1.394  -3.346  -0.821  1.00  0.00           C  
HETATM   14  C   UNL     1       2.461  -2.362  -0.342  1.00  0.00           C  
HETATM   15  N   UNL     1       1.860  -1.283   0.432  1.00  0.00           N  
HETATM   16  C   UNL     1       2.722  -0.517   1.335  1.00  0.00           C  
HETATM   17  C   UNL     1       3.306   0.659   0.595  1.00  0.00           C  
HETATM   18  F   UNL     1       1.462   2.000   1.237  1.00  0.00           F  
HETATM   19  C   UNL     1       3.172   2.950  -0.100  1.00  0.00           C  
HETATM   20  C   UNL     1       4.376   2.818  -0.766  1.00  0.00           C  
HETATM   21  C   UNL     1       5.046   1.610  -0.753  1.00  0.00           C  
HETATM   22  C   UNL     1       4.511   0.528  -0.073  1.00  0.00           C  
HETATM   23  F   UNL     1       5.166  -0.653  -0.060  1.00  0.00           F  
HETATM   24  C   UNL     1       0.567  -0.953   0.366  1.00  0.00           C  
HETATM   25  O   UNL     1       0.177  -0.009   1.020  1.00  0.00           O  
HETATM   26  C   UNL     1      -1.391  -0.708  -1.165  1.00  0.00           C  
HETATM   27  H   UNL     1      -5.473  -1.563   1.349  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.910  -1.096   2.062  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.406  -0.290   2.592  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.468   1.478   1.094  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.865   3.046  -0.806  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.442  -3.255  -1.955  1.00  0.00           H  
HETATM   33  H   UNL     1       0.697  -1.929  -2.298  1.00  0.00           H  
HETATM   34  H   UNL     1       0.985  -3.886   0.033  1.00  0.00           H  
HETATM   35  H   UNL     1       1.837  -4.052  -1.524  1.00  0.00           H  
HETATM   36  H   UNL     1       3.184  -2.891   0.280  1.00  0.00           H  
HETATM   37  H   UNL     1       2.974  -1.940  -1.206  1.00  0.00           H  
HETATM   38  H   UNL     1       2.136  -0.159   2.181  1.00  0.00           H  
HETATM   39  H   UNL     1       3.529  -1.156   1.696  1.00  0.00           H  
HETATM   40  H   UNL     1       2.650   3.895  -0.110  1.00  0.00           H  
HETATM   41  H   UNL     1       4.793   3.661  -1.297  1.00  0.00           H  
HETATM   42  H   UNL     1       5.986   1.508  -1.274  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.692  -1.082  -2.144  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.943   0.282  -1.247  1.00  0.00           H  
CONECT    1    2   27   28   29                                       
CONECT    2    5    5    1    3                                       
CONECT    3    2    4    4   30                                       
CONECT    4    8    3    3   31                                       
CONECT    5    9    8    2    2                                       
CONECT    6   13   12   32   33                                       
CONECT    7   18   19   19   17                                       
CONECT    8    5    4                                                 
CONECT    9   26   10   10    5                                       
CONECT   10   11    9    9                                            
CONECT   11   12   10                                                 
CONECT   12    6   24   26   11                                       
CONECT   13   14    6   34   35                                       
CONECT   14   13   15   36   37                                       
CONECT   15   14   16   24                                            
CONECT   16   15   17   38   39                                       
CONECT   17    7   16   22   22                                       
CONECT   18    7                                                      
CONECT   19    7    7   20   40                                       
CONECT   20   19   21   21   41                                       
CONECT   21   20   20   22   42                                       
CONECT   22   17   17   21   23                                       
CONECT   23   22                                                      
CONECT   24   15   12   25   25                                       
CONECT   25   24   24                                                 
CONECT   26   12    9   43   44                                       
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34   13                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   26                                                      
CONECT   44   26                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
