COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.039  -0.739   0.001  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.071   0.561   0.002  1.00  0.00           C  
HETATM    3  O   UNL     1       0.365   3.036  -0.002  1.00  0.00           O  
HETATM    4  C   UNL     1      -0.030  -0.540   0.001  1.00  0.00           C  
HETATM    5  C   UNL     1       1.987  -1.631   0.000  1.00  0.00           C  
HETATM    6  C   UNL     1       2.659  -0.398   0.000  1.00  0.00           C  
HETATM    7  C   UNL     1       4.131  -0.366   0.000  1.00  0.00           C  
HETATM    8  N   UNL     1      -3.444   0.470   0.002  1.00  0.00           N  
HETATM    9  C   UNL     1      -5.543  -0.838   0.002  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.365  -1.747  -0.005  1.00  0.00           O  
HETATM   11  C   UNL     1       0.652   0.704   0.002  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.157   1.938  -0.003  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.373  -0.548   0.001  1.00  0.00           N  
HETATM   14  N   UNL     1       0.671  -1.676   0.000  1.00  0.00           N  
HETATM   15  N   UNL     1       1.971   0.740   0.002  1.00  0.00           N  
HETATM   16  N   UNL     1      -1.504   1.800  -0.002  1.00  0.00           N  
HETATM   17  H   UNL     1       2.554  -2.550  -0.001  1.00  0.00           H  
HETATM   18  H   UNL     1      -2.069   2.588  -0.005  1.00  0.00           H  
HETATM   19  C   UNL     1       4.913  -1.654   0.000  1.00  0.00           C  
HETATM   20  O   UNL     1       4.714   0.698   0.001  1.00  0.00           O  
HETATM   21  H   UNL     1      -3.983   1.276   0.004  1.00  0.00           H  
HETATM   22  H   UNL     1      -5.939  -0.349  -0.888  1.00  0.00           H  
HETATM   23  H   UNL     1      -5.837  -1.888   0.000  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.939  -0.351   0.892  1.00  0.00           H  
HETATM   25  H   UNL     1       4.663  -2.231  -0.890  1.00  0.00           H  
HETATM   26  H   UNL     1       5.980  -1.431   0.000  1.00  0.00           H  
HETATM   27  H   UNL     1       4.663  -2.231   0.890  1.00  0.00           H  
CONECT    1   10   10    8    9                                       
CONECT    2   13   13   16    8                                       
CONECT    3   12   12                                                 
CONECT    4   14   14   11   13                                       
CONECT    5    6    6   14   17                                       
CONECT    6    7    5    5   15                                       
CONECT    7    6   19   20   20                                       
CONECT    8    2    1   21                                            
CONECT    9    1   22   23   24                                       
CONECT   10    1    1                                                 
CONECT   11   15   15    4   12                                       
CONECT   12   11    3    3   16                                       
CONECT   13    4    2    2                                            
CONECT   14    5    4    4                                            
CONECT   15    6   11   11                                            
CONECT   16   12    2   18                                            
CONECT   17    5                                                      
CONECT   18   16                                                      
CONECT   19    7   25   26   27                                       
CONECT   20    7    7                                                 
CONECT   21    8                                                      
CONECT   22    9                                                      
CONECT   23    9                                                      
CONECT   24    9                                                      
CONECT   25   19                                                      
CONECT   26   19                                                      
CONECT   27   19                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
