COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.475   0.580  -0.118  1.00  0.00           C  
HETATM    2  C   UNL     1       6.924   1.658   0.835  1.00  0.00           C  
HETATM    3  F   UNL     1       8.099   2.244   0.356  1.00  0.00           F  
HETATM    4  O   UNL     1       5.361  -0.123   0.140  1.00  0.00           O  
HETATM    5  O   UNL     1       7.115   0.353  -1.117  1.00  0.00           O  
HETATM    6  C   UNL     1       4.989  -1.145  -0.822  1.00  0.00           C  
HETATM    7  C   UNL     1       3.703  -1.835  -0.361  1.00  0.00           C  
HETATM    8  N   UNL     1       2.600  -0.871  -0.375  1.00  0.00           N  
HETATM    9  C   UNL     1       1.363  -1.257  -0.004  1.00  0.00           C  
HETATM   10  C   UNL     1       0.229  -0.265  -0.018  1.00  0.00           C  
HETATM   11  O   UNL     1       1.163  -2.402   0.340  1.00  0.00           O  
HETATM   12  H   UNL     1       6.146   2.417   0.917  1.00  0.00           H  
HETATM   13  H   UNL     1       7.109   1.221   1.816  1.00  0.00           H  
HETATM   14  H   UNL     1       4.826  -0.685  -1.796  1.00  0.00           H  
HETATM   15  H   UNL     1       5.789  -1.881  -0.897  1.00  0.00           H  
HETATM   16  H   UNL     1       3.472  -2.660  -1.035  1.00  0.00           H  
HETATM   17  H   UNL     1       3.839  -2.218   0.650  1.00  0.00           H  
HETATM   18  H   UNL     1       2.760   0.046  -0.650  1.00  0.00           H  
HETATM   19  C   UNL     1      -1.057  -0.955   0.442  1.00  0.00           C  
HETATM   20  H   UNL     1       0.460   0.560   0.656  1.00  0.00           H  
HETATM   21  H   UNL     1       0.093   0.118  -1.029  1.00  0.00           H  
HETATM   22  N   UNL     1      -2.160   0.009   0.429  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.397  -0.377   0.800  1.00  0.00           C  
HETATM   24  H   UNL     1      -2.000   0.926   0.154  1.00  0.00           H  
HETATM   25  C   UNL     1      -4.506   0.639   0.895  1.00  0.00           C  
HETATM   26  O   UNL     1      -3.618  -1.541   1.056  1.00  0.00           O  
HETATM   27  O   UNL     1      -3.969   1.950   0.709  1.00  0.00           O  
HETATM   28  C   UNL     1      -5.550   0.357  -0.188  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.605   1.465  -0.179  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.867   0.314  -1.556  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.222  -0.989   0.090  1.00  0.00           C  
HETATM   32  O   UNL     1      -7.580   1.202  -1.191  1.00  0.00           O  
HETATM   33  H   UNL     1      -1.288  -1.780  -0.231  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.922  -1.338   1.454  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.975   0.574   1.877  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.536   2.080  -0.145  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.092   1.496   0.795  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.126   2.424  -0.377  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.115  -0.476  -1.562  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.610   0.113  -2.327  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.388   1.273  -1.753  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.610  -0.998   1.108  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.042  -1.137  -0.613  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.493  -1.791  -0.028  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.281   1.866  -1.243  1.00  0.00           H  
CONECT    1    4    2    5    5                                       
CONECT    2    1   12   13    3                                       
CONECT    3    2                                                      
CONECT    4    1    6                                                 
CONECT    5    1    1                                                 
CONECT    6    4   14   15    7                                       
CONECT    7    6   16   17    8                                       
CONECT    8    7   18    9                                            
CONECT    9    8   10   11   11                                       
CONECT   10    9   19   20   21                                       
CONECT   11    9    9                                                 
CONECT   12    2                                                      
CONECT   13    2                                                      
CONECT   14    6                                                      
CONECT   15    6                                                      
CONECT   16    7                                                      
CONECT   17    7                                                      
CONECT   18    8                                                      
CONECT   19   10   22   33   34                                       
CONECT   20   10                                                      
CONECT   21   10                                                      
CONECT   22   19   23   24                                            
CONECT   23   22   25   26   26                                       
CONECT   24   22                                                      
CONECT   25   23   27   28   35                                       
CONECT   26   23   23                                                 
CONECT   27   25   36                                                 
CONECT   28   25   29   30   31                                       
CONECT   29   28   32   37   38                                       
CONECT   30   28   39   40   41                                       
CONECT   31   28   42   43   44                                       
CONECT   32   29   45                                                 
CONECT   33   19                                                      
CONECT   34   19                                                      
CONECT   35   25                                                      
CONECT   36   27                                                      
CONECT   37   29                                                      
CONECT   38   29                                                      
CONECT   39   30                                                      
CONECT   40   30                                                      
CONECT   41   30                                                      
CONECT   42   31                                                      
CONECT   43   31                                                      
CONECT   44   31                                                      
CONECT   45   32                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
