COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -9.072   3.773   0.028  1.00  0.00           C  
HETATM    2  O   UNL     1      -8.267   2.595  -0.048  1.00  0.00           O  
HETATM    3  C   UNL     1      -8.027   1.972   1.215  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.159   0.728   1.014  1.00  0.00           C  
HETATM    5  O   UNL     1      -5.871   1.119   0.534  1.00  0.00           O  
HETATM    6  C   UNL     1      -4.972   0.126   0.302  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.699   0.431  -0.159  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.813  -0.626  -0.376  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.447  -0.410  -0.863  1.00  0.00           C  
HETATM   10  O   UNL     1      -1.046   0.716  -1.092  1.00  0.00           O  
HETATM   11  C   UNL     1      -5.320  -1.203   0.531  1.00  0.00           C  
HETATM   12  N   UNL     1      -4.471  -2.185   0.316  1.00  0.00           N  
HETATM   13  C   UNL     1      -3.239  -1.951  -0.121  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.286  -3.037  -0.359  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.053  -2.751  -0.806  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.641  -1.474  -1.052  1.00  0.00           N  
HETATM   17  C   UNL     1       0.724  -1.251  -1.538  1.00  0.00           C  
HETATM   18  C   UNL     1       0.916  -1.981  -2.869  1.00  0.00           C  
HETATM   19  C   UNL     1       1.709  -1.779  -0.528  1.00  0.00           C  
HETATM   20  N   UNL     1       2.834  -1.148  -0.095  1.00  0.00           N  
HETATM   21  C   UNL     1       3.408   0.055  -0.387  1.00  0.00           C  
HETATM   22  N   UNL     1       1.637  -2.926   0.097  1.00  0.00           N  
HETATM   23  N   UNL     1       2.640  -3.066   0.891  1.00  0.00           N  
HETATM   24  C   UNL     1       3.415  -1.996   0.814  1.00  0.00           C  
HETATM   25  C   UNL     1       4.617  -1.624   1.454  1.00  0.00           C  
HETATM   26  F   UNL     1       5.198  -2.452   2.349  1.00  0.00           F  
HETATM   27  C   UNL     1       5.186  -0.424   1.159  1.00  0.00           C  
HETATM   28  C   UNL     1       4.566   0.431   0.218  1.00  0.00           C  
HETATM   29  C   UNL     1       5.182   1.743  -0.109  1.00  0.00           C  
HETATM   30  C   UNL     1       5.339   2.794   0.745  1.00  0.00           C  
HETATM   31  C   UNL     1       5.714   2.124  -1.356  1.00  0.00           C  
HETATM   32  N   UNL     1       6.162   3.347  -1.249  1.00  0.00           N  
HETATM   33  N   UNL     1       5.938   3.790   0.060  1.00  0.00           N  
HETATM   34  C   UNL     1       6.296   5.107   0.594  1.00  0.00           C  
HETATM   35  H   UNL     1     -10.044   3.521   0.452  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.579   4.510   0.661  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.208   4.186  -0.972  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.512   2.672   1.873  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.977   1.683   1.664  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.049   0.204   1.963  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.633   0.068   0.287  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.404   1.453  -0.345  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.311  -1.433   0.894  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.574  -4.062  -0.176  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.361  -3.562  -0.976  1.00  0.00           H  
HETATM   46  H   UNL     1       0.888  -0.183  -1.682  1.00  0.00           H  
HETATM   47  H   UNL     1       1.931  -1.815  -3.230  1.00  0.00           H  
HETATM   48  H   UNL     1       0.752  -3.049  -2.724  1.00  0.00           H  
HETATM   49  H   UNL     1       0.204  -1.599  -3.599  1.00  0.00           H  
HETATM   50  H   UNL     1       2.940   0.712  -1.105  1.00  0.00           H  
HETATM   51  H   UNL     1       6.105  -0.127   1.640  1.00  0.00           H  
HETATM   52  H   UNL     1       5.038   2.825   1.782  1.00  0.00           H  
HETATM   53  H   UNL     1       5.747   1.512  -2.245  1.00  0.00           H  
HETATM   54  H   UNL     1       7.305   5.070   1.004  1.00  0.00           H  
HETATM   55  H   UNL     1       6.255   5.846  -0.205  1.00  0.00           H  
HETATM   56  H   UNL     1       5.594   5.382   1.381  1.00  0.00           H  
CONECT    1    2   35   36   37                                       
CONECT    2    3    1                                                 
CONECT    3    4    2   38   39                                       
CONECT    4    5    3   40   41                                       
CONECT    5    6    4                                                 
CONECT    6    7    7   11    5                                       
CONECT    7    8    6    6   42                                       
CONECT    8    9   13   13    7                                       
CONECT    9   16   10   10    8                                       
CONECT   10    9    9                                                 
CONECT   11   12   12    6   43                                       
CONECT   12   13   11   11                                            
CONECT   13   14    8    8   12                                       
CONECT   14   15   15   13   44                                       
CONECT   15   16   14   14   45                                       
CONECT   16   17   15    9                                            
CONECT   17   18   19   16   46                                       
CONECT   18   17   47   48   49                                       
CONECT   19   17   22   22   20                                       
CONECT   20   19   24   21                                            
CONECT   21   20   28   28   50                                       
CONECT   22   19   19   23                                            
CONECT   23   22   24   24                                            
CONECT   24   23   23   20   25                                       
CONECT   25   24   26   27   27                                       
CONECT   26   25                                                      
CONECT   27   25   25   28   51                                       
CONECT   28   21   21   29   27                                       
CONECT   29   28   31   30   30                                       
CONECT   30   29   29   33   52                                       
CONECT   31   29   32   32   53                                       
CONECT   32   31   31   33                                            
CONECT   33   32   30   34                                            
CONECT   34   33   54   55   56                                       
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    7                                                      
CONECT   43   11                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   21                                                      
CONECT   51   27                                                      
CONECT   52   30                                                      
CONECT   53   31                                                      
CONECT   54   34                                                      
CONECT   55   34                                                      
CONECT   56   34                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
