COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.488   1.643  -0.084  1.00  0.00           O  
HETATM    2  C   UNL     1       4.702   0.536  -0.022  1.00  0.00           C  
HETATM    3  C   UNL     1       5.280  -0.718   0.100  1.00  0.00           C  
HETATM    4  C   UNL     1       4.480  -1.852   0.164  1.00  0.00           C  
HETATM    5  C   UNL     1       3.099  -1.731   0.106  1.00  0.00           C  
HETATM    6  C   UNL     1       3.323   0.663  -0.076  1.00  0.00           C  
HETATM    7  C   UNL     1       2.517  -0.472  -0.017  1.00  0.00           C  
HETATM    8  C   UNL     1       1.040  -0.338  -0.075  1.00  0.00           C  
HETATM    9  N   UNL     1       0.293  -1.430  -0.018  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.032  -1.344  -0.066  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.139  -2.314  -0.030  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.217  -3.700   0.072  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.472  -4.285   0.076  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.593  -3.479  -0.020  1.00  0.00           C  
HETATM   15  N   UNL     1       0.506   0.873  -0.177  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.810   1.042  -0.227  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.639  -0.086  -0.179  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.977  -0.252  -0.208  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.317  -1.556  -0.124  1.00  0.00           C  
HETATM   20  N   UNL     1      -4.493  -2.169  -0.116  1.00  0.00           N  
HETATM   21  N   UNL     1      -1.354   2.312  -0.338  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.299   3.336  -0.369  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.939   4.715  -0.552  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.882   4.941   0.499  1.00  0.00           O  
HETATM   25  C   UNL     1      -2.924   3.963   0.558  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.304   2.576   0.752  1.00  0.00           C  
HETATM   27  N   UNL     1       5.065  -3.114   0.287  1.00  0.00           N  
HETATM   28  H   UNL     1       5.747   1.891  -0.982  1.00  0.00           H  
HETATM   29  H   UNL     1       6.355  -0.814   0.146  1.00  0.00           H  
HETATM   30  H   UNL     1       2.476  -2.612   0.155  1.00  0.00           H  
HETATM   31  H   UNL     1       2.874   1.640  -0.171  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.323  -4.302   0.145  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.575  -5.357   0.152  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.572  -3.934  -0.017  1.00  0.00           H  
HETATM   35  H   UNL     1       0.257   3.315   0.569  1.00  0.00           H  
HETATM   36  H   UNL     1       0.379   3.135  -1.198  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.165   5.482  -0.518  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.449   4.754  -1.515  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.586   4.186   1.394  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.492   3.980  -0.372  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.090   1.821   0.740  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.780   2.542   1.708  1.00  0.00           H  
HETATM   43  H   UNL     1       6.031  -3.199   0.328  1.00  0.00           H  
HETATM   44  H   UNL     1       4.507  -3.906   0.332  1.00  0.00           H  
CONECT    1    2   28                                                 
CONECT    2    6    1    3    3                                       
CONECT    3    2    2    4   29                                       
CONECT    4    5    5    3   27                                       
CONECT    5    7    4    4   30                                       
CONECT    6    7    7    2   31                                       
CONECT    7    8    6    6    5                                       
CONECT    8   15   15    9    7                                       
CONECT    9   10   10    8                                            
CONECT   10   17   11    9    9                                       
CONECT   11   19   10   12   12                                       
CONECT   12   11   11   13   32                                       
CONECT   13   14   14   12   33                                       
CONECT   14   20   13   13   34                                       
CONECT   15   16    8    8                                            
CONECT   16   21   17   17   15                                       
CONECT   17   18   16   16   10                                       
CONECT   18   19   17                                                 
CONECT   19   18   20   20   11                                       
CONECT   20   19   19   14                                            
CONECT   21   22   26   16                                            
CONECT   22   23   21   35   36                                       
CONECT   23   24   22   37   38                                       
CONECT   24   23   25                                                 
CONECT   25   24   26   39   40                                       
CONECT   26   25   21   41   42                                       
CONECT   27    4   43   44                                            
CONECT   28    1                                                      
CONECT   29    3                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   22                                                      
CONECT   36   22                                                      
CONECT   37   23                                                      
CONECT   38   23                                                      
CONECT   39   25                                                      
CONECT   40   25                                                      
CONECT   41   26                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
CONECT   44   27                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
