COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.160   1.507  -0.328  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.897   1.081   0.911  1.00  0.00           C  
HETATM    3  C   UNL     1       0.181   1.530  -0.405  1.00  0.00           C  
HETATM    4  N   UNL     1       0.966   1.172   0.664  1.00  0.00           N  
HETATM    5  C   UNL     1       0.839   1.958  -1.692  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.513  -0.276   0.687  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.884  -0.434   0.782  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.455  -1.674   0.577  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.645  -2.770   0.273  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.262  -2.603   0.179  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.705  -1.357   0.381  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.910   1.894  -1.462  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.342   2.324  -2.449  1.00  0.00           O  
HETATM   14  O   UNL     1      -3.255   1.787  -1.449  1.00  0.00           O  
HETATM   15  C   UNL     1      -3.949   2.197  -2.630  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.454   2.004  -2.429  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.230  -4.059   0.060  1.00  0.00           C  
HETATM   18  N   UNL     1      -4.694  -5.082  -0.109  1.00  0.00           N  
HETATM   19  N   UNL     1      -0.966   1.013   2.042  1.00  0.00           N1+
HETATM   20  C   UNL     1       0.345   1.053   1.904  1.00  0.00           C  
HETATM   21  N   UNL     1       0.914   0.962   3.127  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.113   0.869   4.040  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.265   0.903   3.342  1.00  0.00           C  
HETATM   24  C   UNL     1       2.336   0.936   0.512  1.00  0.00           C  
HETATM   25  C   UNL     1       3.259   1.804   1.082  1.00  0.00           C  
HETATM   26  C   UNL     1       4.612   1.568   0.930  1.00  0.00           C  
HETATM   27  C   UNL     1       5.047   0.470   0.211  1.00  0.00           C  
HETATM   28  C   UNL     1       4.131  -0.396  -0.357  1.00  0.00           C  
HETATM   29  C   UNL     1       2.777  -0.169  -0.204  1.00  0.00           C  
HETATM   30  C   UNL     1       4.610  -1.591  -1.140  1.00  0.00           C  
HETATM   31  F   UNL     1       6.009  -1.611  -1.151  1.00  0.00           F  
HETATM   32  F   UNL     1       4.131  -2.762  -0.543  1.00  0.00           F  
HETATM   33  F   UNL     1       4.135  -1.510  -2.453  1.00  0.00           F  
HETATM   34  H   UNL     1      -2.683   1.803   1.133  1.00  0.00           H  
HETATM   35  H   UNL     1       0.567   2.990  -1.914  1.00  0.00           H  
HETATM   36  H   UNL     1       1.921   1.881  -1.590  1.00  0.00           H  
HETATM   37  H   UNL     1       0.504   1.311  -2.503  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.510   0.414   1.017  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.525  -1.796   0.652  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.629  -3.447  -0.055  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.636  -1.226   0.305  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.741   3.248  -2.827  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.615   1.595  -3.475  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.662   0.952  -2.232  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.788   2.605  -1.584  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.983   2.316  -3.329  1.00  0.00           H  
HETATM   47  H   UNL     1       1.863   0.962   3.325  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.014   0.785   5.112  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.259   0.851   3.760  1.00  0.00           H  
HETATM   50  H   UNL     1       2.920   2.662   1.643  1.00  0.00           H  
HETATM   51  H   UNL     1       5.330   2.242   1.373  1.00  0.00           H  
HETATM   52  H   UNL     1       6.105   0.288   0.093  1.00  0.00           H  
HETATM   53  H   UNL     1       2.062  -0.848  -0.645  1.00  0.00           H  
CONECT    1    2    3    3   12                                       
CONECT    2    1    6   19   34                                       
CONECT    3    1    1    4    5                                       
CONECT    4    3   20   24                                            
CONECT    5    3   35   36   37                                       
CONECT    6    2    7    7   11                                       
CONECT    7    6    6    8   38                                       
CONECT    8    7    9    9   39                                       
CONECT    9    8    8   10   17                                       
CONECT   10    9   11   11   40                                       
CONECT   11    6   10   10   41                                       
CONECT   12    1   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15                                                 
CONECT   15   14   16   42   43                                       
CONECT   16   15   44   45   46                                       
CONECT   17    9   18   18   18                                       
CONECT   18   17   17   17                                            
CONECT   19    2   20   20   23                                       
CONECT   20    4   19   19   21                                       
CONECT   21   20   22   47                                            
CONECT   22   21   23   23   48                                       
CONECT   23   19   22   22   49                                       
CONECT   24    4   25   25   29                                       
CONECT   25   24   24   26   50                                       
CONECT   26   25   27   27   51                                       
CONECT   27   26   26   28   52                                       
CONECT   28   27   29   29   30                                       
CONECT   29   24   28   28   53                                       
CONECT   30   28   31   32   33                                       
CONECT   31   30                                                      
CONECT   32   30                                                      
CONECT   33   30                                                      
CONECT   34    2                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
