COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.323   3.401  -0.550  1.00  0.00           O  
HETATM    2  C   UNL     1       3.632   2.502  -0.109  1.00  0.00           C  
HETATM    3  C   UNL     1       4.097   1.109  -0.189  1.00  0.00           C  
HETATM    4  C   UNL     1       5.064   0.648  -1.026  1.00  0.00           C  
HETATM    5  N   UNL     1       3.627   0.063   0.578  1.00  0.00           N  
HETATM    6  C   UNL     1       4.299  -1.085   0.222  1.00  0.00           C  
HETATM    7  C   UNL     1       5.213  -0.740  -0.790  1.00  0.00           C  
HETATM    8  C   UNL     1       6.040  -1.727  -1.347  1.00  0.00           C  
HETATM    9  C   UNL     1       5.952  -3.025  -0.900  1.00  0.00           C  
HETATM   10  F   UNL     1       6.747  -3.975  -1.441  1.00  0.00           F  
HETATM   11  C   UNL     1       4.228  -2.409   0.664  1.00  0.00           C  
HETATM   12  N   UNL     1       3.327  -2.764   1.673  1.00  0.00           N  
HETATM   13  C   UNL     1       3.254  -4.152   2.135  1.00  0.00           C  
HETATM   14  C   UNL     1       5.049  -3.368   0.100  1.00  0.00           C  
HETATM   15  N   UNL     1       2.441   2.783   0.456  1.00  0.00           N  
HETATM   16  C   UNL     1       1.523   1.717   0.871  1.00  0.00           C  
HETATM   17  C   UNL     1       0.119   2.060   0.440  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.225   3.310  -0.027  1.00  0.00           C  
HETATM   19  C   UNL     1       0.774   4.427  -0.178  1.00  0.00           C  
HETATM   20  C   UNL     1       2.013   4.173   0.688  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.842   1.065   0.527  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.159   1.322   0.154  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.504   2.593  -0.309  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.541   3.572  -0.395  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.182   0.259   0.247  1.00  0.00           C  
HETATM   26  O   UNL     1      -2.875  -0.846   0.650  1.00  0.00           O  
HETATM   27  N   UNL     1      -4.454   0.514  -0.116  1.00  0.00           N  
HETATM   28  C   UNL     1      -5.468  -0.540  -0.025  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.817   0.008  -0.493  1.00  0.00           C  
HETATM   30  N   UNL     1      -7.831  -1.045  -0.402  1.00  0.00           N  
HETATM   31  C   UNL     1      -8.613  -1.303   0.685  1.00  0.00           C  
HETATM   32  C   UNL     1      -9.418  -2.343   0.388  1.00  0.00           C  
HETATM   33  C   UNL     1      -9.123  -2.742  -0.931  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.152  -1.927  -1.391  1.00  0.00           C  
HETATM   35  H   UNL     1       5.619   1.235  -1.742  1.00  0.00           H  
HETATM   36  H   UNL     1       2.937   0.126   1.257  1.00  0.00           H  
HETATM   37  H   UNL     1       6.743  -1.468  -2.125  1.00  0.00           H  
HETATM   38  H   UNL     1       2.749  -2.091   2.066  1.00  0.00           H  
HETATM   39  H   UNL     1       2.984  -4.800   1.301  1.00  0.00           H  
HETATM   40  H   UNL     1       4.224  -4.455   2.530  1.00  0.00           H  
HETATM   41  H   UNL     1       2.500  -4.236   2.918  1.00  0.00           H  
HETATM   42  H   UNL     1       4.991  -4.391   0.441  1.00  0.00           H  
HETATM   43  H   UNL     1       1.826   0.778   0.409  1.00  0.00           H  
HETATM   44  H   UNL     1       1.554   1.614   1.956  1.00  0.00           H  
HETATM   45  H   UNL     1       1.075   4.501  -1.224  1.00  0.00           H  
HETATM   46  H   UNL     1       0.312   5.366   0.128  1.00  0.00           H  
HETATM   47  H   UNL     1       1.764   4.311   1.740  1.00  0.00           H  
HETATM   48  H   UNL     1       2.812   4.857   0.404  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.568   0.084   0.887  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.523   2.807  -0.598  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.810   4.555  -0.753  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.699   1.396  -0.438  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.177  -1.379  -0.656  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.551  -0.874   1.009  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.108   0.848   0.138  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.734   0.343  -1.527  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.591  -0.767   1.622  1.00  0.00           H  
HETATM   58  H   UNL     1     -10.155  -2.788   1.040  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.591  -3.549  -1.474  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.704  -1.967  -2.373  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   15                                       
CONECT    3    4    4    5    2                                       
CONECT    4    7    3    3   35                                       
CONECT    5    6    3   36                                            
CONECT    6   11   11    7    5                                       
CONECT    7    8    8    6    4                                       
CONECT    8    9    7    7   37                                       
CONECT    9   10   14   14    8                                       
CONECT   10    9                                                      
CONECT   11   14   12    6    6                                       
CONECT   12   13   11   38                                            
CONECT   13   12   39   40   41                                       
CONECT   14    9    9   11   42                                       
CONECT   15    2   16   20                                            
CONECT   16   15   17   43   44                                       
CONECT   17   21   16   18   18                                       
CONECT   18   17   17   24   19                                       
CONECT   19   18   20   45   46                                       
CONECT   20   15   19   47   48                                       
CONECT   21   22   22   17   49                                       
CONECT   22   25   21   21   23                                       
CONECT   23   22   24   24   50                                       
CONECT   24   23   23   18   51                                       
CONECT   25   27   26   26   22                                       
CONECT   26   25   25                                                 
CONECT   27   28   25   52                                            
CONECT   28   29   27   53   54                                       
CONECT   29   28   30   55   56                                       
CONECT   30   29   31   34                                            
CONECT   31   30   32   32   57                                       
CONECT   32   31   31   33   58                                       
CONECT   33   34   34   32   59                                       
CONECT   34   30   33   33   60                                       
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    8                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   29                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   33                                                      
CONECT   60   34                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
