COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.724   1.778   1.995  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.729   1.006   1.364  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.750   0.871  -0.029  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.740   1.489  -0.790  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.738   2.260  -0.186  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.704   2.386   1.207  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.004   2.122   3.348  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.127   2.917   3.354  1.00  0.00           C  
HETATM    9  N   UNL     1      -6.542   3.070   2.058  1.00  0.00           N  
HETATM   10  F   UNL     1      -2.767   0.404   2.077  1.00  0.00           F  
HETATM   11  C   UNL     1      -4.235   1.707   4.539  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.110   2.657   4.924  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.886   2.456   4.396  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.175   3.427   4.924  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.925   4.211   5.756  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.196   3.708   5.757  1.00  0.00           C  
HETATM   17  O   UNL     1      -4.173   4.247   6.471  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.463   5.361   6.499  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.607   6.640   5.722  1.00  0.00           C  
HETATM   20  O   UNL     1      -2.056   6.755   4.591  1.00  0.00           O  
HETATM   21  C   UNL     1       0.259   3.683   4.681  1.00  0.00           C  
HETATM   22  C   UNL     1       0.717   3.274   3.241  1.00  0.00           C  
HETATM   23  O   UNL     1      -0.098   3.974   2.295  1.00  0.00           O  
HETATM   24  C   UNL     1       2.173   3.588   2.904  1.00  0.00           C  
HETATM   25  N   UNL     1       1.118   3.024   5.695  1.00  0.00           N  
HETATM   26  O   UNL     1      -1.156   7.685   6.463  1.00  0.00           O  
HETATM   27  H   UNL     1      -2.984   0.278  -0.521  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.737   1.371  -1.871  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.508   2.741  -0.780  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.668   3.388   4.163  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.347   3.608   1.768  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.897   1.580   5.419  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.802   0.695   4.404  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.571   5.030   6.027  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.410   5.197   6.750  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.048   5.420   7.423  1.00  0.00           H  
HETATM   37  H   UNL     1       0.476   4.771   4.773  1.00  0.00           H  
HETATM   38  H   UNL     1       0.545   2.203   3.079  1.00  0.00           H  
HETATM   39  H   UNL     1       0.498   4.263   1.588  1.00  0.00           H  
HETATM   40  H   UNL     1       2.868   2.983   3.493  1.00  0.00           H  
HETATM   41  H   UNL     1       2.395   4.647   3.074  1.00  0.00           H  
HETATM   42  H   UNL     1       2.368   3.394   1.843  1.00  0.00           H  
HETATM   43  H   UNL     1       2.047   3.347   5.770  1.00  0.00           H  
HETATM   44  H   UNL     1       0.783   2.182   6.084  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.236   8.536   5.981  1.00  0.00           H  
CONECT    1    2    2    6    7                                       
CONECT    2    1    1    3   10                                       
CONECT    3    2    4    4   27                                       
CONECT    4    3    3    5   28                                       
CONECT    5    4    6    6   29                                       
CONECT    6    1    5    5    9                                       
CONECT    7    1    8    8   11                                       
CONECT    8    7    7    9   30                                       
CONECT    9    6    8   31                                            
CONECT   10    2                                                      
CONECT   11    7   12   32   33                                       
CONECT   12   11   13   16   16                                       
CONECT   13   12   14   14                                            
CONECT   14   13   13   15   21                                       
CONECT   15   14   16   18                                            
CONECT   16   12   12   15   17                                       
CONECT   17   16   34                                                 
CONECT   18   15   19   35   36                                       
CONECT   19   18   20   20   26                                       
CONECT   20   19   19                                                 
CONECT   21   14   22   25   37                                       
CONECT   22   21   23   24   38                                       
CONECT   23   22   39                                                 
CONECT   24   22   40   41   42                                       
CONECT   25   21   43   44                                            
CONECT   26   19   45                                                 
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   18                                                      
CONECT   37   21                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   24                                                      
CONECT   41   24                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
