COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.995  -2.962   0.882  1.00  0.00           C  
HETATM    2  C   UNL     1       5.585  -2.505   0.604  1.00  0.00           C  
HETATM    3  C   UNL     1       4.533  -3.391   0.746  1.00  0.00           C  
HETATM    4  C   UNL     1       3.241  -2.980   0.493  1.00  0.00           C  
HETATM    5  C   UNL     1       2.992  -1.665   0.094  1.00  0.00           C  
HETATM    6  C   UNL     1       4.055  -0.772  -0.048  1.00  0.00           C  
HETATM    7  C   UNL     1       5.348  -1.194   0.213  1.00  0.00           C  
HETATM    8  O   UNL     1       6.386  -0.327   0.076  1.00  0.00           O  
HETATM    9  C   UNL     1       6.122   0.909  -0.417  1.00  0.00           C  
HETATM   10  C   UNL     1       6.197   1.168  -1.779  1.00  0.00           C  
HETATM   11  C   UNL     1       5.922   2.442  -2.244  1.00  0.00           C  
HETATM   12  N   UNL     1       5.589   3.418  -1.425  1.00  0.00           N  
HETATM   13  C   UNL     1       5.500   3.233  -0.113  1.00  0.00           C  
HETATM   14  C   UNL     1       5.760   1.964   0.433  1.00  0.00           C  
HETATM   15  C   UNL     1       5.578   2.095   1.880  1.00  0.00           C  
HETATM   16  C   UNL     1       5.236   3.372   2.115  1.00  0.00           C  
HETATM   17  N   UNL     1       5.181   4.063   0.933  1.00  0.00           N  
HETATM   18  C   UNL     1       1.609  -1.221  -0.177  1.00  0.00           C  
HETATM   19  N   UNL     1       0.584  -2.086  -0.040  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.707  -1.706  -0.417  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.890  -0.733  -1.391  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.166  -0.360  -1.762  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.263  -0.954  -1.165  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.085  -1.923  -0.195  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.283  -2.568   0.453  1.00  0.00           C  
HETATM   26  F   UNL     1      -5.055  -3.205  -0.524  1.00  0.00           F  
HETATM   27  F   UNL     1      -3.853  -3.510   1.395  1.00  0.00           F  
HETATM   28  F   UNL     1      -5.052  -1.589   1.090  1.00  0.00           F  
HETATM   29  C   UNL     1      -1.811  -2.305   0.176  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.655  -0.545  -1.572  1.00  0.00           C  
HETATM   31  N   UNL     1      -5.198   0.396  -0.584  1.00  0.00           N  
HETATM   32  C   UNL     1      -6.629   0.634  -0.814  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.173   1.555   0.282  1.00  0.00           C  
HETATM   34  N   UNL     1      -6.424   2.819   0.272  1.00  0.00           N  
HETATM   35  C   UNL     1      -4.992   2.580   0.503  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.448   1.660  -0.593  1.00  0.00           C  
HETATM   37  C   UNL     1      -6.967   3.760   1.261  1.00  0.00           C  
HETATM   38  C   UNL     1      -8.380   4.175   0.848  1.00  0.00           C  
HETATM   39  O   UNL     1       1.395  -0.076  -0.525  1.00  0.00           O  
HETATM   40  H   UNL     1       7.437  -3.352  -0.035  1.00  0.00           H  
HETATM   41  H   UNL     1       7.585  -2.120   1.241  1.00  0.00           H  
HETATM   42  H   UNL     1       6.980  -3.745   1.639  1.00  0.00           H  
HETATM   43  H   UNL     1       4.724  -4.408   1.054  1.00  0.00           H  
HETATM   44  H   UNL     1       2.422  -3.675   0.604  1.00  0.00           H  
HETATM   45  H   UNL     1       3.869   0.246  -0.356  1.00  0.00           H  
HETATM   46  H   UNL     1       6.469   0.382  -2.469  1.00  0.00           H  
HETATM   47  H   UNL     1       5.981   2.641  -3.304  1.00  0.00           H  
HETATM   48  H   UNL     1       5.696   1.314   2.616  1.00  0.00           H  
HETATM   49  H   UNL     1       5.031   3.790   3.089  1.00  0.00           H  
HETATM   50  H   UNL     1       4.955   5.003   0.849  1.00  0.00           H  
HETATM   51  H   UNL     1       0.743  -2.973   0.321  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.034  -0.268  -1.858  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.309   0.397  -2.519  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.672  -3.062   0.934  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.621  -0.065  -2.550  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.293  -1.427  -1.623  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.768   1.106  -1.787  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.165  -0.315  -0.790  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.229   1.756   0.097  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.060   1.071   1.252  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.457   3.530   0.479  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.854   2.109   1.476  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.393   1.459  -0.408  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.562   2.143  -1.563  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.001   3.279   2.239  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.328   4.642   1.312  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.018   3.293   0.797  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.783   4.873   1.582  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.346   4.655  -0.130  1.00  0.00           H  
CONECT    1    2   40   41   42                                       
CONECT    2    7    7    3    1                                       
CONECT    3    4    4    2   43                                       
CONECT    4    5    3    3   44                                       
CONECT    5   18    6    6    4                                       
CONECT    6    5    5    7   45                                       
CONECT    7    6    8    2    2                                       
CONECT    8    9    7                                                 
CONECT    9   14    8   10   10                                       
CONECT   10    9    9   11   46                                       
CONECT   11   12   12   10   47                                       
CONECT   12   13   11   11                                            
CONECT   13   17   14   14   12                                       
CONECT   14   15   13   13    9                                       
CONECT   15   16   16   14   48                                       
CONECT   16   15   15   17   49                                       
CONECT   17   16   13   50                                            
CONECT   18   39   39   19    5                                       
CONECT   19   20   18   51                                            
CONECT   20   29   29   21   19                                       
CONECT   21   22   22   20   52                                       
CONECT   22   23   21   21   53                                       
CONECT   23   30   24   24   22                                       
CONECT   24   25   23   23   29                                       
CONECT   25   28   26   27   24                                       
CONECT   26   25                                                      
CONECT   27   25                                                      
CONECT   28   25                                                      
CONECT   29   24   20   20   54                                       
CONECT   30   31   23   55   56                                       
CONECT   31   36   32   30                                            
CONECT   32   33   31   57   58                                       
CONECT   33   34   32   59   60                                       
CONECT   34   37   35   33                                            
CONECT   35   34   36   61   62                                       
CONECT   36   35   31   63   64                                       
CONECT   37   38   34   65   66                                       
CONECT   38   37   67   68   69                                       
CONECT   39   18   18                                                 
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    6                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   19                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
CONECT   59   33                                                      
CONECT   60   33                                                      
CONECT   61   35                                                      
CONECT   62   35                                                      
CONECT   63   36                                                      
CONECT   64   36                                                      
CONECT   65   37                                                      
CONECT   66   37                                                      
CONECT   67   38                                                      
CONECT   68   38                                                      
CONECT   69   38                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
