COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.823  -1.326   0.028  1.00  0.00           C  
HETATM    2  N   UNL     1       3.738  -2.676  -0.046  1.00  0.00           N  
HETATM    3  C   UNL     1       4.912  -3.196   0.170  1.00  0.00           C  
HETATM    4  N   UNL     1       5.824  -2.208   0.396  1.00  0.00           N  
HETATM    5  C   UNL     1       5.162  -1.010   0.312  1.00  0.00           C  
HETATM    6  N   UNL     1       5.512   0.266   0.436  1.00  0.00           N  
HETATM    7  C   UNL     1       4.619   1.224   0.296  1.00  0.00           C  
HETATM    8  N   UNL     1       3.349   0.975   0.030  1.00  0.00           N  
HETATM    9  C   UNL     1       2.906  -0.270  -0.108  1.00  0.00           C  
HETATM   10  N   UNL     1       1.574  -0.520  -0.388  1.00  0.00           N  
HETATM   11  C   UNL     1       0.635   0.595  -0.536  1.00  0.00           C  
HETATM   12  C   UNL     1       0.750   1.175  -1.947  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.771   0.101  -0.309  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.052  -1.230  -0.408  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.378  -1.650  -0.188  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.736  -3.005  -0.273  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.027  -3.376  -0.054  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.002  -2.427   0.254  1.00  0.00           C  
HETATM   19  F   UNL     1      -6.276  -2.826   0.466  1.00  0.00           F  
HETATM   20  C   UNL     1      -4.690  -1.103   0.345  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.366  -0.683   0.126  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.033   0.608   0.209  1.00  0.00           N  
HETATM   23  C   UNL     1      -1.792   1.009   0.010  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.472   2.453   0.113  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.462   3.400  -0.140  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.148   4.745  -0.039  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.853   5.098   0.311  1.00  0.00           C  
HETATM   28  C   UNL     1       0.080   4.105   0.548  1.00  0.00           C  
HETATM   29  N   UNL     1      -0.246   2.833   0.450  1.00  0.00           N  
HETATM   30  H   UNL     1       5.131  -4.253   0.170  1.00  0.00           H  
HETATM   31  H   UNL     1       4.937   2.250   0.404  1.00  0.00           H  
HETATM   32  H   UNL     1       1.262  -1.433  -0.487  1.00  0.00           H  
HETATM   33  H   UNL     1       0.871   1.368   0.195  1.00  0.00           H  
HETATM   34  H   UNL     1       1.766   1.532  -2.112  1.00  0.00           H  
HETATM   35  H   UNL     1       0.514   0.402  -2.678  1.00  0.00           H  
HETATM   36  H   UNL     1       0.051   2.004  -2.057  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.277  -1.943  -0.649  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.990  -3.749  -0.512  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.300  -4.419  -0.120  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.456  -0.381   0.585  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.460   3.089  -0.411  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.894   5.502  -0.229  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.576   6.138   0.398  1.00  0.00           H  
HETATM   44  H   UNL     1       1.090   4.376   0.821  1.00  0.00           H  
HETATM   45  H   UNL     1       6.768  -2.331   0.582  1.00  0.00           H  
CONECT    1    2    5    5    9                                       
CONECT    2    1    3    3                                            
CONECT    3    2    2    4   30                                       
CONECT    4    3    5   45                                            
CONECT    5    1    1    6    4                                       
CONECT    6    5    7    7                                            
CONECT    7    6    6   31    8                                       
CONECT    8    7    9    9                                            
CONECT    9    8    8    1   10                                       
CONECT   10    9   32   11                                            
CONECT   11   10   33   12   13                                       
CONECT   12   11   34   35   36                                       
CONECT   13   11   14   14   23                                       
CONECT   14   13   13   37   15                                       
CONECT   15   14   16   16   21                                       
CONECT   16   15   15   38   17                                       
CONECT   17   16   39   18   18                                       
CONECT   18   17   17   20   19                                       
CONECT   19   18                                                      
CONECT   20   18   21   21   40                                       
CONECT   21   20   20   15   22                                       
CONECT   22   21   23   23                                            
CONECT   23   22   22   13   24                                       
CONECT   24   23   25   25   29                                       
CONECT   25   24   24   26   41                                       
CONECT   26   25   27   27   42                                       
CONECT   27   26   26   43   28                                       
CONECT   28   27   44   29   29                                       
CONECT   29   24   28   28                                            
CONECT   30    3                                                      
CONECT   31    7                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   20                                                      
CONECT   41   25                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
CONECT   44   28                                                      
CONECT   45    4                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
