COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.283   3.141   0.021  1.00  0.00           C  
HETATM    2  C   UNL     1       3.879   2.411  -1.185  1.00  0.00           C  
HETATM    3  C   UNL     1       4.989   1.503  -0.723  1.00  0.00           C  
HETATM    4  C   UNL     1       6.300   1.793  -0.692  1.00  0.00           C  
HETATM    5  N   UNL     1       7.003   0.717  -0.212  1.00  0.00           N  
HETATM    6  C   UNL     1       6.146  -0.308   0.082  1.00  0.00           C  
HETATM    7  N   UNL     1       6.301  -1.540   0.563  1.00  0.00           N  
HETATM    8  C   UNL     1       5.261  -2.325   0.748  1.00  0.00           C  
HETATM    9  N   UNL     1       4.025  -1.949   0.473  1.00  0.00           N  
HETATM   10  C   UNL     1       3.769  -0.737  -0.011  1.00  0.00           C  
HETATM   11  N   UNL     1       2.473  -0.347  -0.298  1.00  0.00           N  
HETATM   12  C   UNL     1       1.850  -1.259  -1.291  1.00  0.00           C  
HETATM   13  C   UNL     1       0.333  -1.019  -1.090  1.00  0.00           C  
HETATM   14  C   UNL     1       0.212  -0.833   0.440  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.187  -2.096   1.076  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.800   0.268   0.763  1.00  0.00           C  
HETATM   17  N   UNL     1      -2.140  -0.165   0.357  1.00  0.00           N  
HETATM   18  C   UNL     1      -3.197   0.649   0.546  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.039   1.743   1.053  1.00  0.00           O  
HETATM   20  C   UNL     1      -4.546   0.213   0.138  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.732  -1.046  -0.439  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.994  -1.448  -0.818  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.081  -0.607  -0.629  1.00  0.00           C  
HETATM   24  F   UNL     1      -8.315  -1.009  -1.003  1.00  0.00           F  
HETATM   25  C   UNL     1      -6.906   0.642  -0.057  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.646   1.056   0.333  1.00  0.00           C  
HETATM   27  F   UNL     1      -5.477   2.272   0.896  1.00  0.00           F  
HETATM   28  C   UNL     1       1.619  -0.420   0.908  1.00  0.00           C  
HETATM   29  C   UNL     1       4.846   0.139  -0.219  1.00  0.00           C  
HETATM   30  H   UNL     1       2.480   3.798  -0.313  1.00  0.00           H  
HETATM   31  H   UNL     1       2.886   2.412   0.727  1.00  0.00           H  
HETATM   32  H   UNL     1       4.059   3.733   0.507  1.00  0.00           H  
HETATM   33  H   UNL     1       3.104   1.820  -1.671  1.00  0.00           H  
HETATM   34  H   UNL     1       4.276   3.141  -1.891  1.00  0.00           H  
HETATM   35  H   UNL     1       6.736   2.732  -0.998  1.00  0.00           H  
HETATM   36  H   UNL     1       5.425  -3.318   1.139  1.00  0.00           H  
HETATM   37  H   UNL     1       2.152  -0.990  -2.303  1.00  0.00           H  
HETATM   38  H   UNL     1       2.109  -2.296  -1.077  1.00  0.00           H  
HETATM   39  H   UNL     1       0.012  -0.118  -1.615  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.242  -1.883  -1.423  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.089  -2.400   0.742  1.00  0.00           H  
HETATM   42  H   UNL     1       0.512  -2.809   0.933  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.791   0.467   1.834  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.533   1.177   0.222  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.266  -1.038  -0.047  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.887  -1.702  -0.588  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.137  -2.421  -1.265  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.756   1.293   0.089  1.00  0.00           H  
HETATM   49  H   UNL     1       2.014  -1.164   1.599  1.00  0.00           H  
HETATM   50  H   UNL     1       1.578   0.555   1.393  1.00  0.00           H  
HETATM   51  H   UNL     1       7.965   0.688  -0.097  1.00  0.00           H  
CONECT    1    2   30   31   32                                       
CONECT    2    1    3   33   34                                       
CONECT    3    2   29    4    4                                       
CONECT    4    3    3    5   35                                       
CONECT    5    4    6   51                                            
CONECT    6    5   29   29    7                                       
CONECT    7    6    8    8                                            
CONECT    8    7    7    9   36                                       
CONECT    9    8   10   10                                            
CONECT   10    9    9   11   29                                       
CONECT   11   10   28   12                                            
CONECT   12   11   13   37   38                                       
CONECT   13   12   14   39   40                                       
CONECT   14   13   16   15   28                                       
CONECT   15   14   41   42                                            
CONECT   16   14   17   43   44                                       
CONECT   17   16   18   45                                            
CONECT   18   17   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   21   21   26                                       
CONECT   21   20   20   22   46                                       
CONECT   22   21   23   23   47                                       
CONECT   23   22   22   25   24                                       
CONECT   24   23                                                      
CONECT   25   23   26   26   48                                       
CONECT   26   20   25   25   27                                       
CONECT   27   26                                                      
CONECT   28   11   14   49   50                                       
CONECT   29    3    6    6   10                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    8                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   25                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51    5                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
