COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.116   0.164  -1.961  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.001  -0.315  -0.513  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.208  -1.146  -0.161  1.00  0.00           C  
HETATM    4  N   UNL     1      -4.143  -0.624   0.608  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.217  -1.323   0.939  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.350  -2.621   0.463  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.344  -3.134  -0.344  1.00  0.00           C  
HETATM    8  N   UNL     1      -3.302  -2.372  -0.635  1.00  0.00           N  
HETATM    9  F   UNL     1      -6.432  -3.366   0.779  1.00  0.00           F  
HETATM   10  N   UNL     1      -0.789  -1.124  -0.361  1.00  0.00           N  
HETATM   11  C   UNL     1       0.423  -0.513  -0.116  1.00  0.00           C  
HETATM   12  N   UNL     1       0.492   0.811  -0.017  1.00  0.00           N  
HETATM   13  C   UNL     1       1.660   1.401   0.219  1.00  0.00           C  
HETATM   14  N   UNL     1       2.760   0.665   0.357  1.00  0.00           N  
HETATM   15  C   UNL     1       2.691  -0.658   0.258  1.00  0.00           C  
HETATM   16  N   UNL     1       1.521  -1.248   0.028  1.00  0.00           N  
HETATM   17  N   UNL     1       3.832  -1.421   0.401  1.00  0.00           N  
HETATM   18  C   UNL     1       5.005  -0.572   0.654  1.00  0.00           C  
HETATM   19  C   UNL     1       6.235  -1.459   0.865  1.00  0.00           C  
HETATM   20  O   UNL     1       6.411  -2.300  -0.279  1.00  0.00           O  
HETATM   21  C   UNL     1       5.288  -3.141  -0.554  1.00  0.00           C  
HETATM   22  C   UNL     1       4.049  -2.270  -0.779  1.00  0.00           C  
HETATM   23  N   UNL     1       1.732   2.776   0.320  1.00  0.00           N  
HETATM   24  C   UNL     1       0.570   3.552   0.174  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.675   3.084  -0.067  1.00  0.00           C  
HETATM   26  N   UNL     1      -1.502   4.178  -0.135  1.00  0.00           N  
HETATM   27  C   UNL     1      -0.736   5.271   0.067  1.00  0.00           C  
HETATM   28  N   UNL     1       0.499   4.891   0.255  1.00  0.00           N  
HETATM   29  C   UNL     1      -2.946   4.162  -0.380  1.00  0.00           C  
HETATM   30  H   UNL     1      -1.243   0.765  -2.216  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.170  -0.698  -2.626  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.017   0.767  -2.074  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.947   0.548   0.152  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.840  -2.090  -0.433  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.979  -0.890   1.569  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.413  -4.139  -0.732  1.00  0.00           H  
HETATM   37  H   UNL     1       2.584   3.205   0.493  1.00  0.00           H  
HETATM   38  H   UNL     1       5.171   0.084  -0.200  1.00  0.00           H  
HETATM   39  H   UNL     1       4.833   0.029   1.547  1.00  0.00           H  
HETATM   40  H   UNL     1       3.179  -2.909  -0.933  1.00  0.00           H  
HETATM   41  H   UNL     1       4.200  -1.642  -1.657  1.00  0.00           H  
HETATM   42  H   UNL     1       7.117  -0.833   0.997  1.00  0.00           H  
HETATM   43  H   UNL     1       6.090  -2.077   1.752  1.00  0.00           H  
HETATM   44  H   UNL     1       5.486  -3.730  -1.449  1.00  0.00           H  
HETATM   45  H   UNL     1       5.116  -3.807   0.291  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.964   2.049  -0.184  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.088   6.292   0.074  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.476   4.092   0.570  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.238   5.080  -0.892  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.200   3.304  -1.002  1.00  0.00           H  
CONECT    1    2   30   31   32                                       
CONECT    2    1    3   10   33                                       
CONECT    3    2    4    8    8                                       
CONECT    4    3    5    5                                            
CONECT    5    4    4    6   35                                       
CONECT    6    5    7    7    9                                       
CONECT    7    6    6    8   36                                       
CONECT    8    3    3    7                                            
CONECT    9    6                                                      
CONECT   10    2   11   34                                            
CONECT   11   10   12   16   16                                       
CONECT   12   11   13   13                                            
CONECT   13   12   12   14   23                                       
CONECT   14   13   15   15                                            
CONECT   15   14   14   16   17                                       
CONECT   16   11   11   15                                            
CONECT   17   15   18   22                                            
CONECT   18   17   19   38   39                                       
CONECT   19   18   20   42   43                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   44   45                                       
CONECT   22   17   21   40   41                                       
CONECT   23   13   24   37                                            
CONECT   24   23   25   25   28                                       
CONECT   25   24   24   26   46                                       
CONECT   26   25   27   29                                            
CONECT   27   26   28   28   47                                       
CONECT   28   24   27   27                                            
CONECT   29   26   48   49   50                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34   10                                                      
CONECT   35    5                                                      
CONECT   36    7                                                      
CONECT   37   23                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   25                                                      
CONECT   47   27                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
