COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.978   1.518  -0.872  1.00  0.00           C  
HETATM    2  C   UNL     1       5.671  -0.201  -0.247  1.00  0.00           C  
HETATM    3  C   UNL     1       8.769  -2.499  -2.007  1.00  0.00           C  
HETATM    4  C   UNL     1       7.833  -0.215   0.535  1.00  0.00           C  
HETATM    5  C   UNL     1       3.243  -0.737  -0.420  1.00  0.00           C  
HETATM    6  F   UNL     1      -8.698  -1.882   1.884  1.00  0.00           F  
HETATM    7  C   UNL     1      -7.681  -1.254   1.254  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.370  -1.554   1.591  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.328  -0.918   0.951  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.596   0.032  -0.039  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.485   0.717  -0.728  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.090   0.401  -0.373  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.078   1.025  -1.001  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.682   0.708  -0.645  1.00  0.00           C  
HETATM   15  N   UNL     1       0.332   1.333  -1.275  1.00  0.00           N  
HETATM   16  C   UNL     1       1.652   0.954  -1.020  1.00  0.00           C  
HETATM   17  C   UNL     1       2.675   1.890  -1.124  1.00  0.00           C  
HETATM   18  C   UNL     1       4.271   0.201  -0.518  1.00  0.00           C  
HETATM   19  N   UNL     1       6.266  -1.288  -0.679  1.00  0.00           N  
HETATM   20  N   UNL     1       7.586  -1.324  -0.218  1.00  0.00           N  
HETATM   21  C   UNL     1       8.551  -2.390  -0.497  1.00  0.00           C  
HETATM   22  C   UNL     1       8.011  -3.719   0.038  1.00  0.00           C  
HETATM   23  N   UNL     1       8.892   0.244   1.201  1.00  0.00           N  
HETATM   24  C   UNL     1       8.831   1.382   1.857  1.00  0.00           C  
HETATM   25  N   UNL     1       7.740   2.126   1.895  1.00  0.00           N  
HETATM   26  C   UNL     1       6.632   1.753   1.263  1.00  0.00           C  
HETATM   27  N   UNL     1       5.494   2.534   1.306  1.00  0.00           N  
HETATM   28  C   UNL     1       6.648   0.544   0.548  1.00  0.00           C  
HETATM   29  C   UNL     1       1.942  -0.361  -0.672  1.00  0.00           C  
HETATM   30  O   UNL     1      -0.447  -0.118   0.216  1.00  0.00           O  
HETATM   31  O   UNL     1      -4.721   1.543  -1.589  1.00  0.00           O  
HETATM   32  C   UNL     1      -6.921   0.330  -0.374  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.953  -0.316   0.268  1.00  0.00           C  
HETATM   34  C   UNL     1      -9.381   0.004  -0.092  1.00  0.00           C  
HETATM   35  F   UNL     1      -9.402   0.979  -1.095  1.00  0.00           F  
HETATM   36  F   UNL     1     -10.016  -1.154  -0.554  1.00  0.00           F  
HETATM   37  F   UNL     1     -10.051   0.484   1.039  1.00  0.00           F  
HETATM   38  H   UNL     1       4.773   2.245  -0.953  1.00  0.00           H  
HETATM   39  H   UNL     1       9.487  -3.293  -2.214  1.00  0.00           H  
HETATM   40  H   UNL     1       7.822  -2.729  -2.495  1.00  0.00           H  
HETATM   41  H   UNL     1       9.154  -1.553  -2.388  1.00  0.00           H  
HETATM   42  H   UNL     1       3.468  -1.758  -0.151  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.164  -2.288   2.356  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.308  -1.151   1.215  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.881  -0.333   0.392  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.287   1.758  -1.765  1.00  0.00           H  
HETATM   47  H   UNL     1       0.146   2.047  -1.905  1.00  0.00           H  
HETATM   48  H   UNL     1       2.449   2.908  -1.402  1.00  0.00           H  
HETATM   49  H   UNL     1       9.498  -2.160  -0.008  1.00  0.00           H  
HETATM   50  H   UNL     1       8.729  -4.512  -0.170  1.00  0.00           H  
HETATM   51  H   UNL     1       7.855  -3.641   1.114  1.00  0.00           H  
HETATM   52  H   UNL     1       7.064  -3.949  -0.451  1.00  0.00           H  
HETATM   53  H   UNL     1       9.709   1.723   2.386  1.00  0.00           H  
HETATM   54  H   UNL     1       5.534   3.428   1.683  1.00  0.00           H  
HETATM   55  H   UNL     1       4.656   2.190   0.961  1.00  0.00           H  
HETATM   56  H   UNL     1       1.146  -1.087  -0.596  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.134   1.063  -1.139  1.00  0.00           H  
CONECT    1   18   18   17   38                                       
CONECT    2   28   19   19   18                                       
CONECT    3   21   39   40   41                                       
CONECT    4   23   23   28   20                                       
CONECT    5   29   29   18   42                                       
CONECT    6    7                                                      
CONECT    7    8    8   33    6                                       
CONECT    8    9    7    7   43                                       
CONECT    9   10   10    8   44                                       
CONECT   10   11    9    9   32                                       
CONECT   11   31   31   12   10                                       
CONECT   12   13   13   11   45                                       
CONECT   13   14   12   12   46                                       
CONECT   14   15   13   30   30                                       
CONECT   15   16   14   47                                            
CONECT   16   29   15   17   17                                       
CONECT   17   16   16    1   48                                       
CONECT   18    5    2    1    1                                       
CONECT   19   20    2    2                                            
CONECT   20    4   21   19                                            
CONECT   21    3   20   22   49                                       
CONECT   22   21   50   51   52                                       
CONECT   23   24    4    4                                            
CONECT   24   25   25   23   53                                       
CONECT   25   24   24   26                                            
CONECT   26   25   27   28   28                                       
CONECT   27   26   54   55                                            
CONECT   28   26   26    4    2                                       
CONECT   29    5    5   16   56                                       
CONECT   30   14   14                                                 
CONECT   31   11   11                                                 
CONECT   32   10   33   33   57                                       
CONECT   33   32   32    7   34                                       
CONECT   34   33   36   35   37                                       
CONECT   35   34                                                      
CONECT   36   34                                                      
CONECT   37   34                                                      
CONECT   38    1                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    5                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   17                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   24                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   29                                                      
CONECT   57   32                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
