COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.122  -3.189  -0.651  1.00  0.00           C  
HETATM    2  C   UNL     1       3.747  -3.079  -0.460  1.00  0.00           C  
HETATM    3  N   UNL     1       2.773  -3.954  -0.054  1.00  0.00           N  
HETATM    4  N   UNL     1       1.539  -3.296  -0.042  1.00  0.00           N  
HETATM    5  C   UNL     1       1.691  -2.054  -0.419  1.00  0.00           C  
HETATM    6  N   UNL     1       0.678  -1.095  -0.528  1.00  0.00           N  
HETATM    7  C   UNL     1      -0.595  -1.422  -0.229  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.863  -2.552   0.135  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.659  -0.414  -0.344  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.339   0.915  -0.642  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.327   1.850  -0.748  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.661   1.492  -0.561  1.00  0.00           C  
HETATM   13  N   UNL     1      -4.659   2.455  -0.671  1.00  0.00           N  
HETATM   14  C   UNL     1      -4.088   3.771  -0.989  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.220   4.782  -1.180  1.00  0.00           C  
HETATM   16  N   UNL     1      -6.030   4.845   0.044  1.00  0.00           N  
HETATM   17  C   UNL     1      -7.084   5.861  -0.072  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.601   3.528   0.362  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.469   2.517   0.553  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.997   0.178  -0.264  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.004  -0.782  -0.159  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.333  -2.100   0.133  1.00  0.00           N  
HETATM   23  C   UNL     1      -4.739  -2.505   0.206  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.857  -4.004  -0.084  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.318  -4.433   0.071  1.00  0.00           C  
HETATM   26  O   UNL     1      -6.769  -4.115   1.389  1.00  0.00           O  
HETATM   27  C   UNL     1      -6.727  -2.721   1.700  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.282  -2.223   1.610  1.00  0.00           C  
HETATM   29  C   UNL     1       3.111  -1.848  -0.707  1.00  0.00           C  
HETATM   30  C   UNL     1       3.865  -0.754  -1.141  1.00  0.00           C  
HETATM   31  C   UNL     1       5.212  -0.890  -1.320  1.00  0.00           C  
HETATM   32  C   UNL     1       6.026   0.289  -1.787  1.00  0.00           C  
HETATM   33  C   UNL     1       6.516   1.066  -0.592  1.00  0.00           C  
HETATM   34  C   UNL     1       7.731   0.750  -0.014  1.00  0.00           C  
HETATM   35  C   UNL     1       8.182   1.463   1.084  1.00  0.00           C  
HETATM   36  F   UNL     1       9.370   1.154   1.649  1.00  0.00           F  
HETATM   37  C   UNL     1       7.416   2.493   1.602  1.00  0.00           C  
HETATM   38  C   UNL     1       6.199   2.808   1.022  1.00  0.00           C  
HETATM   39  F   UNL     1       5.451   3.813   1.527  1.00  0.00           F  
HETATM   40  C   UNL     1       5.752   2.097  -0.079  1.00  0.00           C  
HETATM   41  C   UNL     1       5.838  -2.105  -1.075  1.00  0.00           C  
HETATM   42  H   UNL     1       5.622  -4.127  -0.461  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.308   1.201  -0.789  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.074   2.875  -0.979  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.445   4.095  -0.171  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.503   3.702  -1.906  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.799   5.766  -1.388  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.848   4.472  -2.016  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.736   5.614  -0.910  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.669   5.886   0.847  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.630   6.838  -0.241  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.186   3.597   1.279  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.244   3.204  -0.456  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.891   1.533   0.761  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.841   2.827   1.389  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.032  -0.096  -0.119  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.632  -2.752   0.289  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.318  -1.945  -0.529  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.524  -4.205  -1.103  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.237  -4.561   0.619  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.931  -3.906  -0.660  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.400  -5.508  -0.093  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.345  -2.172   0.990  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.104  -2.562   2.710  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.670  -2.744   2.348  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.253  -1.151   1.804  1.00  0.00           H  
HETATM   67  H   UNL     1       3.385   0.194  -1.333  1.00  0.00           H  
HETATM   68  H   UNL     1       6.879  -0.065  -2.365  1.00  0.00           H  
HETATM   69  H   UNL     1       5.407   0.934  -2.411  1.00  0.00           H  
HETATM   70  H   UNL     1       8.328  -0.054  -0.419  1.00  0.00           H  
HETATM   71  H   UNL     1       7.767   3.049   2.459  1.00  0.00           H  
HETATM   72  H   UNL     1       4.805   2.346  -0.534  1.00  0.00           H  
HETATM   73  H   UNL     1       6.905  -2.195  -1.222  1.00  0.00           H  
HETATM   74  H   UNL     1       0.892  -0.195  -0.818  1.00  0.00           H  
HETATM   75  H   UNL     1       2.917  -4.883   0.186  1.00  0.00           H  
CONECT    1    2    2   41   42                                       
CONECT    2    1    1    3   29                                       
CONECT    3    2    4   75                                            
CONECT    4    3    5    5                                            
CONECT    5    4    4    6   29                                       
CONECT    6    5    7   74                                            
CONECT    7    6    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   10   10   21                                       
CONECT   10    9    9   11   43                                       
CONECT   11   10   12   12   44                                       
CONECT   12   11   11   13   20                                       
CONECT   13   12   14   19                                            
CONECT   14   13   15   45   46                                       
CONECT   15   14   16   47   48                                       
CONECT   16   15   17   18                                            
CONECT   17   16   49   50   51                                       
CONECT   18   16   19   52   53                                       
CONECT   19   13   18   54   55                                       
CONECT   20   12   21   21   56                                       
CONECT   21    9   20   20   22                                       
CONECT   22   21   23   57                                            
CONECT   23   22   24   28   58                                       
CONECT   24   23   25   59   60                                       
CONECT   25   24   26   61   62                                       
CONECT   26   25   27                                                 
CONECT   27   26   28   63   64                                       
CONECT   28   23   27   65   66                                       
CONECT   29    2    5   30   30                                       
CONECT   30   29   29   31   67                                       
CONECT   31   30   32   41   41                                       
CONECT   32   31   33   68   69                                       
CONECT   33   32   34   34   40                                       
CONECT   34   33   33   35   70                                       
CONECT   35   34   36   37   37                                       
CONECT   36   35                                                      
CONECT   37   35   35   38   71                                       
CONECT   38   37   39   40   40                                       
CONECT   39   38                                                      
CONECT   40   33   38   38   72                                       
CONECT   41    1   31   31   73                                       
CONECT   42    1                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   25                                                      
CONECT   63   27                                                      
CONECT   64   27                                                      
CONECT   65   28                                                      
CONECT   66   28                                                      
CONECT   67   30                                                      
CONECT   68   32                                                      
CONECT   69   32                                                      
CONECT   70   34                                                      
CONECT   71   37                                                      
CONECT   72   40                                                      
CONECT   73   41                                                      
CONECT   74    6                                                      
CONECT   75    3                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
