COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.230  -2.862   1.547  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.646  -4.271   1.974  1.00  0.00           C  
HETATM    3  C   UNL     1       0.186  -5.302   1.210  1.00  0.00           C  
HETATM    4  O   UNL     1      -0.202  -6.618   1.609  1.00  0.00           O  
HETATM    5  C   UNL     1       0.850  -7.582   1.535  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.048  -5.135  -0.293  1.00  0.00           C  
HETATM    7  C   UNL     1       0.368  -3.726  -0.720  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.465  -2.694   0.044  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.066  -1.345  -0.365  1.00  0.00           N  
HETATM   10  C   UNL     1       1.195  -0.794  -0.249  1.00  0.00           C  
HETATM   11  C   UNL     1       2.408  -1.259   0.241  1.00  0.00           C  
HETATM   12  C   UNL     1       3.517  -0.444   0.219  1.00  0.00           C  
HETATM   13  C   UNL     1       3.431   0.852  -0.296  1.00  0.00           C  
HETATM   14  C   UNL     1       4.634   1.722  -0.315  1.00  0.00           C  
HETATM   15  C   UNL     1       5.790   1.548  -1.020  1.00  0.00           C  
HETATM   16  C   UNL     1       6.116   0.413  -1.957  1.00  0.00           C  
HETATM   17  O   UNL     1       6.578   2.588  -0.713  1.00  0.00           O  
HETATM   18  N   UNL     1       6.044   3.340   0.068  1.00  0.00           N  
HETATM   19  C   UNL     1       4.852   2.937   0.393  1.00  0.00           C  
HETATM   20  C   UNL     1       3.895   3.616   1.339  1.00  0.00           C  
HETATM   21  C   UNL     1       2.226   1.329  -0.790  1.00  0.00           C  
HETATM   22  C   UNL     1       1.097   0.508  -0.770  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.190   0.680  -1.167  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.868  -0.406  -0.935  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.330  -0.595  -1.248  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.534  -0.761  -2.770  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.883  -0.038  -2.989  1.00  0.00           C  
HETATM   28  F   UNL     1      -3.883   0.640  -4.212  1.00  0.00           F  
HETATM   29  C   UNL     1      -3.971   0.940  -1.838  1.00  0.00           C  
HETATM   30  O   UNL     1      -4.728   1.886  -1.787  1.00  0.00           O  
HETATM   31  N   UNL     1      -3.087   0.608  -0.881  1.00  0.00           N  
HETATM   32  C   UNL     1      -2.912   1.318   0.313  1.00  0.00           C  
HETATM   33  C   UNL     1      -3.580   2.519   0.512  1.00  0.00           C  
HETATM   34  C   UNL     1      -3.405   3.219   1.692  1.00  0.00           C  
HETATM   35  F   UNL     1      -4.055   4.387   1.887  1.00  0.00           F  
HETATM   36  C   UNL     1      -2.562   2.721   2.675  1.00  0.00           C  
HETATM   37  F   UNL     1      -2.392   3.406   3.827  1.00  0.00           F  
HETATM   38  C   UNL     1      -1.896   1.525   2.476  1.00  0.00           C  
HETATM   39  C   UNL     1      -2.073   0.820   1.301  1.00  0.00           C  
HETATM   40  H   UNL     1      -0.823  -2.127   2.091  1.00  0.00           H  
HETATM   41  H   UNL     1       0.827  -2.712   1.768  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.479  -4.390   3.045  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.703  -4.420   1.752  1.00  0.00           H  
HETATM   44  H   UNL     1       1.243  -5.152   1.432  1.00  0.00           H  
HETATM   45  H   UNL     1       1.669  -7.278   2.186  1.00  0.00           H  
HETATM   46  H   UNL     1       0.474  -8.555   1.854  1.00  0.00           H  
HETATM   47  H   UNL     1       1.208  -7.651   0.508  1.00  0.00           H  
HETATM   48  H   UNL     1       0.545  -5.870  -0.837  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.105  -5.285  -0.514  1.00  0.00           H  
HETATM   50  H   UNL     1       1.425  -3.576  -0.498  1.00  0.00           H  
HETATM   51  H   UNL     1       0.201  -3.607  -1.790  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.521  -2.844  -0.178  1.00  0.00           H  
HETATM   53  H   UNL     1       2.481  -2.260   0.641  1.00  0.00           H  
HETATM   54  H   UNL     1       4.459  -0.809   0.601  1.00  0.00           H  
HETATM   55  H   UNL     1       5.796   0.672  -2.967  1.00  0.00           H  
HETATM   56  H   UNL     1       7.191   0.234  -1.951  1.00  0.00           H  
HETATM   57  H   UNL     1       5.596  -0.488  -1.631  1.00  0.00           H  
HETATM   58  H   UNL     1       3.270   4.316   0.783  1.00  0.00           H  
HETATM   59  H   UNL     1       3.264   2.867   1.818  1.00  0.00           H  
HETATM   60  H   UNL     1       4.457   4.157   2.099  1.00  0.00           H  
HETATM   61  H   UNL     1       2.161   2.332  -1.187  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.720  -1.464  -0.718  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.734  -0.271  -3.326  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.607  -1.814  -3.041  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.708  -0.750  -2.948  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.236   2.906  -0.254  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.240   1.139   3.243  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.553  -0.114   1.148  1.00  0.00           H  
CONECT    1    2    8   40   41                                       
CONECT    2    3    1   42   43                                       
CONECT    3    4    2    6   44                                       
CONECT    4    5    3                                                 
CONECT    5    4   45   46   47                                       
CONECT    6    3    7   48   49                                       
CONECT    7    6    8   50   51                                       
CONECT    8    1    7    9   52                                       
CONECT    9   10    8   24                                            
CONECT   10   11   11   22    9                                       
CONECT   11   12   10   10   53                                       
CONECT   12   13   13   11   54                                       
CONECT   13   12   12   14   21                                       
CONECT   14   19   13   15   15                                       
CONECT   15   17   14   14   16                                       
CONECT   16   15   55   56   57                                       
CONECT   17   18   15                                                 
CONECT   18   19   19   17                                            
CONECT   19   20   18   18   14                                       
CONECT   20   19   58   59   60                                       
CONECT   21   13   22   22   61                                       
CONECT   22   10   21   21   23                                       
CONECT   23   22   24   24                                            
CONECT   24    9   23   23   25                                       
CONECT   25   24   31   26   62                                       
CONECT   26   25   27   63   64                                       
CONECT   27   29   26   28   65                                       
CONECT   28   27                                                      
CONECT   29   31   30   30   27                                       
CONECT   30   29   29                                                 
CONECT   31   32   25   29                                            
CONECT   32   33   33   39   31                                       
CONECT   33   34   32   32   66                                       
CONECT   34   35   36   36   33                                       
CONECT   35   34                                                      
CONECT   36   37   34   34   38                                       
CONECT   37   36                                                      
CONECT   38   36   39   39   67                                       
CONECT   39   38   38   32   68                                       
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    2                                                      
CONECT   44    3                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47    5                                                      
CONECT   48    6                                                      
CONECT   49    6                                                      
CONECT   50    7                                                      
CONECT   51    7                                                      
CONECT   52    8                                                      
CONECT   53   11                                                      
CONECT   54   12                                                      
CONECT   55   16                                                      
CONECT   56   16                                                      
CONECT   57   16                                                      
CONECT   58   20                                                      
CONECT   59   20                                                      
CONECT   60   20                                                      
CONECT   61   21                                                      
CONECT   62   25                                                      
CONECT   63   26                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   33                                                      
CONECT   67   38                                                      
CONECT   68   39                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
