COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.660  -3.773   7.184  1.00  0.00           O  
HETATM    2  C   UNL     1       3.565  -4.168   7.912  1.00  0.00           C  
HETATM    3  C   UNL     1       4.094  -5.576   7.793  1.00  0.00           C  
HETATM    4  C   UNL     1       5.291  -5.796   6.945  1.00  0.00           C  
HETATM    5  C   UNL     1       3.940  -6.266   6.489  1.00  0.00           C  
HETATM    6  N   UNL     1       4.232  -3.446   8.911  1.00  0.00           N  
HETATM    7  C   UNL     1       4.018  -2.125   9.307  1.00  0.00           C  
HETATM    8  C   UNL     1       3.036  -1.359   8.679  1.00  0.00           C  
HETATM    9  C   UNL     1       4.787  -1.571  10.330  1.00  0.00           C  
HETATM   10  C   UNL     1       4.574  -0.250  10.726  1.00  0.00           C  
HETATM   11  C   UNL     1       3.592   0.516  10.098  1.00  0.00           C  
HETATM   12  C   UNL     1       2.821  -0.037   9.074  1.00  0.00           C  
HETATM   13  N   UNL     1       1.830   0.737   8.441  1.00  0.00           N  
HETATM   14  C   UNL     1       1.300   0.725   7.133  1.00  0.00           C  
HETATM   15  N   UNL     1       0.338   1.630   6.865  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.146   1.591   5.607  1.00  0.00           C  
HETATM   17  C   UNL     1       0.291   0.704   4.644  1.00  0.00           C  
HETATM   18  N   UNL     1       1.809  -0.189   6.285  1.00  0.00           N  
HETATM   19  C   UNL     1       1.283  -0.177   5.039  1.00  0.00           C  
HETATM   20  N   UNL     1       1.757  -1.099   4.085  1.00  0.00           N  
HETATM   21  C   UNL     1       3.008  -1.722   3.898  1.00  0.00           C  
HETATM   22  C   UNL     1       4.062  -1.445   4.769  1.00  0.00           C  
HETATM   23  C   UNL     1       5.300  -2.060   4.583  1.00  0.00           C  
HETATM   24  C   UNL     1       6.428  -1.763   5.513  1.00  0.00           C  
HETATM   25  F   UNL     1       7.579  -2.435   5.210  1.00  0.00           F  
HETATM   26  F   UNL     1       6.783  -0.444   5.538  1.00  0.00           F  
HETATM   27  F   UNL     1       6.143  -2.090   6.807  1.00  0.00           F  
HETATM   28  C   UNL     1       5.484  -2.953   3.527  1.00  0.00           C  
HETATM   29  C   UNL     1       4.430  -3.230   2.657  1.00  0.00           C  
HETATM   30  C   UNL     1       3.192  -2.615   2.843  1.00  0.00           C  
HETATM   31  H   UNL     1       3.984  -6.138   8.696  1.00  0.00           H  
HETATM   32  H   UNL     1       5.999  -6.543   7.284  1.00  0.00           H  
HETATM   33  H   UNL     1       5.738  -4.964   6.414  1.00  0.00           H  
HETATM   34  H   UNL     1       3.483  -5.750   5.654  1.00  0.00           H  
HETATM   35  H   UNL     1       3.741  -7.330   6.521  1.00  0.00           H  
HETATM   36  H   UNL     1       4.968  -3.958   9.411  1.00  0.00           H  
HETATM   37  H   UNL     1       2.436  -1.791   7.881  1.00  0.00           H  
HETATM   38  H   UNL     1       5.556  -2.159  10.827  1.00  0.00           H  
HETATM   39  H   UNL     1       5.173   0.181  11.522  1.00  0.00           H  
HETATM   40  H   UNL     1       3.434   1.543  10.416  1.00  0.00           H  
HETATM   41  H   UNL     1       1.414   1.442   9.041  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.921   2.317   5.385  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.124   0.706   3.644  1.00  0.00           H  
HETATM   44  H   UNL     1       1.061  -1.370   3.397  1.00  0.00           H  
HETATM   45  H   UNL     1       3.922  -0.748   5.592  1.00  0.00           H  
HETATM   46  H   UNL     1       6.445  -3.436   3.376  1.00  0.00           H  
HETATM   47  H   UNL     1       4.573  -3.926   1.835  1.00  0.00           H  
HETATM   48  H   UNL     1       2.377  -2.838   2.159  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    6    3                                       
CONECT    3    2    4    5   31                                       
CONECT    4    3    5   32   33                                       
CONECT    5    3    4   34   35                                       
CONECT    6    2    7   36                                            
CONECT    7    6    8    9    9                                       
CONECT    8    7   12   12   37                                       
CONECT    9    7    7   10   38                                       
CONECT   10    9   11   11   39                                       
CONECT   11   10   10   12   40                                       
CONECT   12    8    8   11   13                                       
CONECT   13   12   14   41                                            
CONECT   14   13   15   15   18                                       
CONECT   15   14   14   16                                            
CONECT   16   15   17   17   42                                       
CONECT   17   16   16   19   43                                       
CONECT   18   14   19   19                                            
CONECT   19   17   18   18   20                                       
CONECT   20   19   21   44                                            
CONECT   21   20   22   22   30                                       
CONECT   22   21   21   23   45                                       
CONECT   23   22   24   28   28                                       
CONECT   24   23   25   26   27                                       
CONECT   25   24                                                      
CONECT   26   24                                                      
CONECT   27   24                                                      
CONECT   28   23   23   29   46                                       
CONECT   29   28   30   30   47                                       
CONECT   30   21   29   29   48                                       
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   28                                                      
CONECT   47   29                                                      
CONECT   48   30                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
