COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.160   1.023   0.088  1.00  0.00           C  
HETATM    2  C   UNL     1       0.658   1.855   0.865  1.00  0.00           C  
HETATM    3  C   UNL     1       0.394   3.211   0.877  1.00  0.00           C  
HETATM    4  N   UNL     1      -0.616   3.682   0.161  1.00  0.00           N  
HETATM    5  N   UNL     1      -1.159   1.568  -0.608  1.00  0.00           N  
HETATM    6  C   UNL     1       3.388  -0.774   1.225  1.00  0.00           C  
HETATM    7  C   UNL     1       4.760  -0.097   1.201  1.00  0.00           C  
HETATM    8  C   UNL     1       5.544  -0.576  -0.022  1.00  0.00           C  
HETATM    9  O   UNL     1       6.825   0.056  -0.045  1.00  0.00           O  
HETATM   10  C   UNL     1       4.775  -0.217  -1.294  1.00  0.00           C  
HETATM   11  C   UNL     1       3.403  -0.894  -1.270  1.00  0.00           C  
HETATM   12  C   UNL     1       2.619  -0.414  -0.047  1.00  0.00           C  
HETATM   13  N   UNL     1       1.306  -1.063  -0.024  1.00  0.00           N  
HETATM   14  C   UNL     1       1.070  -2.391  -0.051  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.216  -2.608  -0.017  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.870  -1.434   0.034  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.339  -1.249   0.084  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.178  -2.124  -0.605  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.545  -1.947  -0.555  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.085  -0.903   0.178  1.00  0.00           C  
HETATM   21  F   UNL     1      -6.425  -0.734   0.224  1.00  0.00           F  
HETATM   22  C   UNL     1      -4.255  -0.031   0.864  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.887  -0.203   0.826  1.00  0.00           C  
HETATM   24  C   UNL     1       0.084  -0.430   0.036  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.374   2.873  -0.566  1.00  0.00           C  
HETATM   26  N   UNL     1      -2.419   3.408  -1.299  1.00  0.00           N  
HETATM   27  H   UNL     1       1.475   1.445   1.440  1.00  0.00           H  
HETATM   28  H   UNL     1       1.005   3.880   1.465  1.00  0.00           H  
HETATM   29  H   UNL     1       3.518  -1.855   1.278  1.00  0.00           H  
HETATM   30  H   UNL     1       2.830  -0.433   2.097  1.00  0.00           H  
HETATM   31  H   UNL     1       4.630   0.984   1.148  1.00  0.00           H  
HETATM   32  H   UNL     1       5.308  -0.353   2.108  1.00  0.00           H  
HETATM   33  H   UNL     1       5.674  -1.658   0.031  1.00  0.00           H  
HETATM   34  H   UNL     1       7.378  -0.202  -0.795  1.00  0.00           H  
HETATM   35  H   UNL     1       4.645   0.864  -1.347  1.00  0.00           H  
HETATM   36  H   UNL     1       5.334  -0.558  -2.166  1.00  0.00           H  
HETATM   37  H   UNL     1       2.855  -0.638  -2.177  1.00  0.00           H  
HETATM   38  H   UNL     1       3.533  -1.975  -1.217  1.00  0.00           H  
HETATM   39  H   UNL     1       2.489   0.667  -0.100  1.00  0.00           H  
HETATM   40  H   UNL     1       1.830  -3.158  -0.094  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.758  -2.938  -1.178  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.196  -2.625  -1.089  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.681   0.782   1.435  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.242   0.475   1.365  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.982   2.828  -1.835  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.588   4.363  -1.278  1.00  0.00           H  
CONECT    1   24    5    5    2                                       
CONECT    2    1    3    3   27                                       
CONECT    3    2    2    4   28                                       
CONECT    4   25   25    3                                            
CONECT    5    1    1   25                                            
CONECT    6    7   12   29   30                                       
CONECT    7    8    6   31   32                                       
CONECT    8    9    7   10   33                                       
CONECT    9    8   34                                                 
CONECT   10    8   11   35   36                                       
CONECT   11   10   12   37   38                                       
CONECT   12    6   11   13   39                                       
CONECT   13   14   12   24                                            
CONECT   14   15   15   13   40                                       
CONECT   15   14   14   16                                            
CONECT   16   15   24   24   17                                       
CONECT   17   16   23   23   18                                       
CONECT   18   17   19   19   41                                       
CONECT   19   18   18   20   42                                       
CONECT   20   22   22   21   19                                       
CONECT   21   20                                                      
CONECT   22   23   20   20   43                                       
CONECT   23   17   17   22   44                                       
CONECT   24   13   16   16    1                                       
CONECT   25    5   26    4    4                                       
CONECT   26   25   45   46                                            
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   14                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
