COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.172   2.696   1.168  1.00  0.00           C  
HETATM    2  O   UNL     1      -0.766   1.894   0.447  1.00  0.00           O  
HETATM    3  C   UNL     1       1.401   1.854   1.517  1.00  0.00           C  
HETATM    4  N   UNL     1       2.093   1.462   0.282  1.00  0.00           N  
HETATM    5  C   UNL     1       3.281   0.651   0.578  1.00  0.00           C  
HETATM    6  C   UNL     1       3.973   0.263  -0.730  1.00  0.00           C  
HETATM    7  N   UNL     1      -3.128   3.056  -1.968  1.00  0.00           N  
HETATM    8  C   UNL     1       5.192  -0.570  -0.426  1.00  0.00           C  
HETATM    9  C   UNL     1       6.414   0.043  -0.223  1.00  0.00           C  
HETATM   10  C   UNL     1       7.533  -0.723   0.057  1.00  0.00           C  
HETATM   11  F   UNL     1       8.728  -0.125   0.255  1.00  0.00           F  
HETATM   12  C   UNL     1       7.427  -2.101   0.134  1.00  0.00           C  
HETATM   13  C   UNL     1       6.203  -2.711  -0.069  1.00  0.00           C  
HETATM   14  C   UNL     1       5.085  -1.946  -0.343  1.00  0.00           C  
HETATM   15  N   UNL     1      -4.898  -0.491   0.998  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.794   3.211  -1.332  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.857  -0.752   0.232  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.957   2.589   0.071  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.839  -1.866  -0.585  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.134   1.601  -0.063  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.935  -2.718  -0.595  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.583   1.710  -1.536  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.012  -2.419   0.219  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.962  -1.280   1.016  1.00  0.00           C  
HETATM   25  N   UNL     1      -7.038  -0.967   1.839  1.00  0.00           N  
HETATM   26  C   UNL     1      -2.670   0.177   0.248  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.950  -3.942  -1.474  1.00  0.00           C  
HETATM   28  H   UNL     1       0.475   3.543   0.552  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.291   3.061   2.085  1.00  0.00           H  
HETATM   30  H   UNL     1       2.076   2.438   2.142  1.00  0.00           H  
HETATM   31  H   UNL     1       1.088   0.961   2.057  1.00  0.00           H  
HETATM   32  H   UNL     1       1.469   0.975  -0.344  1.00  0.00           H  
HETATM   33  H   UNL     1       3.969   1.227   1.197  1.00  0.00           H  
HETATM   34  H   UNL     1       2.980  -0.251   1.112  1.00  0.00           H  
HETATM   35  H   UNL     1       3.285  -0.313  -1.349  1.00  0.00           H  
HETATM   36  H   UNL     1       4.273   1.165  -1.263  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.764   3.772  -1.651  1.00  0.00           H  
HETATM   38  H   UNL     1       6.496   1.118  -0.284  1.00  0.00           H  
HETATM   39  H   UNL     1       8.299  -2.698   0.352  1.00  0.00           H  
HETATM   40  H   UNL     1       6.120  -3.786  -0.009  1.00  0.00           H  
HETATM   41  H   UNL     1       4.129  -2.423  -0.497  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.036   2.673  -1.901  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.530   4.266  -1.254  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.190   3.362   0.803  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.982  -2.071  -1.209  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.947   1.889   0.604  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.668   1.634  -1.609  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.106   0.936  -2.137  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.881  -3.060   0.235  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.008  -0.174   2.396  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.819  -1.542   1.856  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.203   0.153   1.232  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.949  -0.142  -0.504  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.533  -4.788  -0.928  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.976  -4.168  -1.765  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.353  -3.756  -2.367  1.00  0.00           H  
CONECT    1    3    2   28   29                                       
CONECT    2    1   18                                                 
CONECT    3    1    4   30   31                                       
CONECT    4    3    5   32                                            
CONECT    5    4    6   33   34                                       
CONECT    6    5    8   35   36                                       
CONECT    7   16   22   37                                            
CONECT    8    6    9    9   14                                       
CONECT    9    8    8   10   38                                       
CONECT   10    9   11   12   12                                       
CONECT   11   10                                                      
CONECT   12   10   10   13   39                                       
CONECT   13   12   14   14   40                                       
CONECT   14    8   13   13   41                                       
CONECT   15   17   17   24                                            
CONECT   16    7   18   42   43                                       
CONECT   17   15   15   26   19                                       
CONECT   18    2   16   20   44                                       
CONECT   19   17   21   21   45                                       
CONECT   20   18   26   22   46                                       
CONECT   21   19   19   23   27                                       
CONECT   22    7   20   47   48                                       
CONECT   23   21   24   24   49                                       
CONECT   24   15   23   23   25                                       
CONECT   25   24   50   51                                            
CONECT   26   17   20   52   53                                       
CONECT   27   21   54   55   56                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    9                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
