COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.500  -0.505   0.510  1.00  0.00           C  
HETATM    2  O   UNL     1       4.541  -1.573   1.089  1.00  0.00           O  
HETATM    3  O   UNL     1       5.624   0.018  -0.016  1.00  0.00           O  
HETATM    4  C   UNL     1       6.846  -0.748   0.146  1.00  0.00           C  
HETATM    5  C   UNL     1       7.991  -0.012  -0.502  1.00  0.00           C  
HETATM    6  C   UNL     1       8.734   0.893   0.231  1.00  0.00           C  
HETATM    7  C   UNL     1       9.783   1.569  -0.363  1.00  0.00           C  
HETATM    8  C   UNL     1      10.090   1.338  -1.691  1.00  0.00           C  
HETATM    9  C   UNL     1       9.347   0.432  -2.425  1.00  0.00           C  
HETATM   10  C   UNL     1       8.300  -0.247  -1.829  1.00  0.00           C  
HETATM   11  N   UNL     1       3.330   0.153   0.389  1.00  0.00           N  
HETATM   12  C   UNL     1       2.107  -0.419   0.957  1.00  0.00           C  
HETATM   13  C   UNL     1       0.910   0.116   0.213  1.00  0.00           C  
HETATM   14  O   UNL     1       0.993   1.161  -0.396  1.00  0.00           O  
HETATM   15  C   UNL     1       2.002  -0.036   2.434  1.00  0.00           C  
HETATM   16  C   UNL     1       3.142  -0.693   3.214  1.00  0.00           C  
HETATM   17  C   UNL     1       2.099   1.485   2.574  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.251  -0.568   0.225  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.382  -0.105  -0.584  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.670  -0.601   0.022  1.00  0.00           C  
HETATM   21  O   UNL     1      -2.645  -1.274   1.031  1.00  0.00           O  
HETATM   22  C   UNL     1      -1.247  -0.648  -2.008  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.383  -2.172  -0.461  1.00  0.00           C  
HETATM   24  N   UNL     1      -3.848  -0.295  -0.556  1.00  0.00           N  
HETATM   25  O   UNL     1      -4.786  -2.607  -1.416  1.00  0.00           O  
HETATM   26  C   UNL     1      -5.100  -0.777   0.033  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.246   0.151  -0.374  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.149   2.451  -0.169  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.020   1.537   0.233  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.280   4.549  -0.174  1.00  0.00           C  
HETATM   31  O   UNL     1      -8.042   2.037  -0.868  1.00  0.00           O  
HETATM   32  O   UNL     1      -7.161   3.726   0.251  1.00  0.00           O  
HETATM   33  C   UNL     1      -6.411  -3.024   0.237  1.00  0.00           C  
HETATM   34  F   UNL     1      -6.497  -4.268  -0.399  1.00  0.00           F  
HETATM   35  H   UNL     1       7.054  -0.880   1.208  1.00  0.00           H  
HETATM   36  H   UNL     1       6.729  -1.724  -0.325  1.00  0.00           H  
HETATM   37  H   UNL     1       8.495   1.073   1.269  1.00  0.00           H  
HETATM   38  H   UNL     1      10.364   2.277   0.210  1.00  0.00           H  
HETATM   39  H   UNL     1      10.909   1.866  -2.156  1.00  0.00           H  
HETATM   40  H   UNL     1       9.586   0.252  -3.462  1.00  0.00           H  
HETATM   41  H   UNL     1       7.722  -0.957  -2.401  1.00  0.00           H  
HETATM   42  H   UNL     1       3.298   1.005  -0.073  1.00  0.00           H  
HETATM   43  H   UNL     1       2.136  -1.505   0.865  1.00  0.00           H  
HETATM   44  H   UNL     1       1.046  -0.377   2.831  1.00  0.00           H  
HETATM   45  H   UNL     1       4.098  -0.352   2.817  1.00  0.00           H  
HETATM   46  H   UNL     1       3.067  -0.420   4.267  1.00  0.00           H  
HETATM   47  H   UNL     1       3.073  -1.777   3.114  1.00  0.00           H  
HETATM   48  H   UNL     1       3.015   1.836   2.100  1.00  0.00           H  
HETATM   49  H   UNL     1       1.239   1.950   2.092  1.00  0.00           H  
HETATM   50  H   UNL     1       2.112   1.752   3.631  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.339  -1.366   0.769  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.388   0.985  -0.610  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.240  -1.738  -1.982  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.088  -0.303  -2.610  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.315  -0.289  -2.447  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.867   0.243  -1.362  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.010  -0.788   1.120  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.280   0.231  -1.461  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.189  -0.255  -0.010  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.986   1.457   1.319  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.076   1.944  -0.131  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.167   5.554   0.233  1.00  0.00           H  
HETATM   63  H   UNL     1      -8.300   4.599  -1.263  1.00  0.00           H  
HETATM   64  H   UNL     1      -9.210   4.112   0.187  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.119  -3.168   1.277  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.382  -2.529   0.198  1.00  0.00           H  
CONECT    1    2    2    3   11                                       
CONECT    2    1    1                                                 
CONECT    3    1    4                                                 
CONECT    4    3    5   35   36                                       
CONECT    5    4    6    6   10                                       
CONECT    6    5    5    7   37                                       
CONECT    7    6    8    8   38                                       
CONECT    8    7    7    9   39                                       
CONECT    9    8   10   10   40                                       
CONECT   10    5    9    9   41                                       
CONECT   11   12   42    1                                            
CONECT   12   11   13   15   43                                       
CONECT   13   12   14   14   18                                       
CONECT   14   13   13                                                 
CONECT   15   12   16   17   44                                       
CONECT   16   15   45   46   47                                       
CONECT   17   15   48   49   50                                       
CONECT   18   19   51   13                                            
CONECT   19   18   20   22   52                                       
CONECT   20   19   21   21   24                                       
CONECT   21   20   20                                                 
CONECT   22   19   53   54   55                                       
CONECT   23   25   25   26   33                                       
CONECT   24   56   26   20                                            
CONECT   25   23   23                                                 
CONECT   26   24   23   27   57                                       
CONECT   27   26   59   29   58                                       
CONECT   28   32   29   31   31                                       
CONECT   29   27   28   60   61                                       
CONECT   30   32   62   63   64                                       
CONECT   31   28   28                                                 
CONECT   32   28   30                                                 
CONECT   33   34   65   66   23                                       
CONECT   34   33                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   24                                                      
CONECT   57   26                                                      
CONECT   58   27                                                      
CONECT   59   27                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   30                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
CONECT   65   33                                                      
CONECT   66   33                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
