COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.710  -2.499   0.698  1.00  0.00           C  
HETATM    2  C   UNL     1       6.595  -2.702   1.930  1.00  0.00           C  
HETATM    3  N   UNL     1       7.832  -3.388   1.533  1.00  0.00           N  
HETATM    4  C   UNL     1       8.677  -3.669   2.701  1.00  0.00           C  
HETATM    5  C   UNL     1       8.566  -2.605   0.528  1.00  0.00           C  
HETATM    6  C   UNL     1       7.681  -2.402  -0.703  1.00  0.00           C  
HETATM    7  N   UNL     1       6.443  -1.716  -0.306  1.00  0.00           N  
HETATM    8  C   UNL     1       5.599  -1.434  -1.474  1.00  0.00           C  
HETATM    9  C   UNL     1       4.469  -0.523  -1.070  1.00  0.00           C  
HETATM   10  C   UNL     1       4.690   0.838  -0.951  1.00  0.00           C  
HETATM   11  C   UNL     1       6.060   1.403  -1.226  1.00  0.00           C  
HETATM   12  F   UNL     1       6.427   1.114  -2.544  1.00  0.00           F  
HETATM   13  F   UNL     1       6.037   2.790  -1.041  1.00  0.00           F  
HETATM   14  F   UNL     1       6.986   0.831  -0.347  1.00  0.00           F  
HETATM   15  C   UNL     1       3.660   1.677  -0.581  1.00  0.00           C  
HETATM   16  C   UNL     1       3.213  -1.050  -0.824  1.00  0.00           C  
HETATM   17  C   UNL     1       2.174  -0.221  -0.454  1.00  0.00           C  
HETATM   18  C   UNL     1       2.392   1.151  -0.327  1.00  0.00           C  
HETATM   19  C   UNL     1       1.284   2.045   0.070  1.00  0.00           C  
HETATM   20  O   UNL     1       1.475   3.241   0.175  1.00  0.00           O  
HETATM   21  N   UNL     1       0.061   1.535   0.315  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.959   2.362   0.795  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.276   2.132   0.420  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.657   3.411   1.654  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.665   4.229   2.129  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.975   4.005   1.752  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.071   4.898   2.272  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.283   2.954   0.898  1.00  0.00           C  
HETATM   29  O   UNL     1      -4.573   2.732   0.532  1.00  0.00           O  
HETATM   30  C   UNL     1      -4.823   1.608  -0.315  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.125   1.831  -1.087  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.372   0.641  -2.019  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.944   0.344   0.538  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.177  -0.864  -0.375  1.00  0.00           C  
HETATM   35  N   UNL     1      -6.345  -0.595  -1.225  1.00  0.00           N  
HETATM   36  C   UNL     1      -7.373  -1.466  -1.275  1.00  0.00           C  
HETATM   37  O   UNL     1      -8.300  -1.269  -2.036  1.00  0.00           O  
HETATM   38  C   UNL     1      -7.372  -2.660  -0.404  1.00  0.00           C  
HETATM   39  C   UNL     1      -6.196  -3.390  -0.197  1.00  0.00           C  
HETATM   40  C   UNL     1      -6.249  -4.500   0.627  1.00  0.00           C  
HETATM   41  C   UNL     1      -7.451  -4.850   1.215  1.00  0.00           C  
HETATM   42  N   UNL     1      -8.545  -4.143   1.002  1.00  0.00           N  
HETATM   43  C   UNL     1      -8.544  -3.076   0.230  1.00  0.00           C  
HETATM   44  H   UNL     1       5.442  -3.468   0.279  1.00  0.00           H  
HETATM   45  H   UNL     1       4.804  -1.964   0.986  1.00  0.00           H  
HETATM   46  H   UNL     1       6.840  -1.733   2.365  1.00  0.00           H  
HETATM   47  H   UNL     1       6.064  -3.307   2.664  1.00  0.00           H  
HETATM   48  H   UNL     1       8.133  -4.306   3.398  1.00  0.00           H  
HETATM   49  H   UNL     1       9.586  -4.177   2.378  1.00  0.00           H  
HETATM   50  H   UNL     1       8.940  -2.733   3.193  1.00  0.00           H  
HETATM   51  H   UNL     1       8.834  -1.635   0.948  1.00  0.00           H  
HETATM   52  H   UNL     1       9.472  -3.139   0.241  1.00  0.00           H  
HETATM   53  H   UNL     1       8.212  -1.797  -1.438  1.00  0.00           H  
HETATM   54  H   UNL     1       7.436  -3.371  -1.139  1.00  0.00           H  
HETATM   55  H   UNL     1       6.196  -0.951  -2.247  1.00  0.00           H  
HETATM   56  H   UNL     1       5.191  -2.368  -1.861  1.00  0.00           H  
HETATM   57  H   UNL     1       3.834   2.739  -0.488  1.00  0.00           H  
HETATM   58  H   UNL     1       3.046  -2.112  -0.924  1.00  0.00           H  
HETATM   59  H   UNL     1       1.195  -0.634  -0.263  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.112   0.593   0.158  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.514   1.315  -0.245  1.00  0.00           H  
HETATM   62  H   UNL     1       0.366   3.588   1.951  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.428   5.044   2.796  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.210   5.738   1.591  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.999   4.331   2.343  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.797   5.272   3.259  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.999   1.494  -1.019  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.954   1.921  -0.384  1.00  0.00           H  
HETATM   69  H   UNL     1      -6.047   2.745  -1.676  1.00  0.00           H  
HETATM   70  H   UNL     1      -7.345   0.747  -2.497  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.593   0.606  -2.780  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.025   0.198   1.106  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.784   0.448   1.226  1.00  0.00           H  
HETATM   74  H   UNL     1      -4.299  -1.023  -1.001  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.360  -1.751   0.231  1.00  0.00           H  
HETATM   76  H   UNL     1      -5.270  -3.094  -0.669  1.00  0.00           H  
HETATM   77  H   UNL     1      -5.361  -5.087   0.810  1.00  0.00           H  
HETATM   78  H   UNL     1      -7.495  -5.716   1.859  1.00  0.00           H  
HETATM   79  H   UNL     1      -9.459  -2.523   0.080  1.00  0.00           H  
CONECT    1    7    2   44   45                                       
CONECT    2    1    3   46   47                                       
CONECT    3    5    2    4                                            
CONECT    4    3   48   49   50                                       
CONECT    5    6    3   51   52                                       
CONECT    6    7    5   53   54                                       
CONECT    7    8    6    1                                            
CONECT    8    9    7   55   56                                       
CONECT    9   10    8   16   16                                       
CONECT   10   11   15   15    9                                       
CONECT   11   12   14   13   10                                       
CONECT   12   11                                                      
CONECT   13   11                                                      
CONECT   14   11                                                      
CONECT   15   10   10   18   57                                       
CONECT   16    9    9   17   58                                       
CONECT   17   18   18   16   59                                       
CONECT   18   15   19   17   17                                       
CONECT   19   20   20   18   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   60                                            
CONECT   22   23   21   24   24                                       
CONECT   23   28   28   22   61                                       
CONECT   24   22   22   25   62                                       
CONECT   25   26   26   24   63                                       
CONECT   26   28   27   25   25                                       
CONECT   27   26   64   65   66                                       
CONECT   28   29   23   23   26                                       
CONECT   29   30   28                                                 
CONECT   30   31   33   29   67                                       
CONECT   31   32   30   68   69                                       
CONECT   32   35   31   70   71                                       
CONECT   33   34   30   72   73                                       
CONECT   34   35   33   74   75                                       
CONECT   35   36   32   34                                            
CONECT   36   37   37   38   35                                       
CONECT   37   36   36                                                 
CONECT   38   43   36   39   39                                       
CONECT   39   38   38   40   76                                       
CONECT   40   41   41   39   77                                       
CONECT   41   42   40   40   78                                       
CONECT   42   43   43   41                                            
CONECT   43   42   42   38   79                                       
CONECT   44    1                                                      
CONECT   45    1                                                      
CONECT   46    2                                                      
CONECT   47    2                                                      
CONECT   48    4                                                      
CONECT   49    4                                                      
CONECT   50    4                                                      
CONECT   51    5                                                      
CONECT   52    5                                                      
CONECT   53    6                                                      
CONECT   54    6                                                      
CONECT   55    8                                                      
CONECT   56    8                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   17                                                      
CONECT   60   21                                                      
CONECT   61   23                                                      
CONECT   62   24                                                      
CONECT   63   25                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   27                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
CONECT   70   32                                                      
CONECT   71   32                                                      
CONECT   72   33                                                      
CONECT   73   33                                                      
CONECT   74   34                                                      
CONECT   75   34                                                      
CONECT   76   39                                                      
CONECT   77   40                                                      
CONECT   78   41                                                      
CONECT   79   43                                                      
MASTER        0    0    0    0    0    0    0    0   79    0   79    0
END
