COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.417   2.331   1.311  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.302   1.748   0.294  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.572  -1.070   0.917  1.00  0.00           C  
HETATM    4  O   UNL     1      -3.799  -1.332   1.808  1.00  0.00           O  
HETATM    5  C   UNL     1      -2.333   2.656  -0.937  1.00  0.00           C  
HETATM    6  C   UNL     1       0.750  -1.943  -0.743  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.735   4.071  -0.517  1.00  0.00           C  
HETATM    8  O   UNL     1      -1.036   2.688  -1.538  1.00  0.00           O  
HETATM    9  C   UNL     1       2.043  -1.329  -0.421  1.00  0.00           C  
HETATM   10  C   UNL     1       2.108   0.018  -0.041  1.00  0.00           C  
HETATM   11  C   UNL     1       3.219  -2.087  -0.488  1.00  0.00           C  
HETATM   12  C   UNL     1       3.327   0.586   0.259  1.00  0.00           C  
HETATM   13  C   UNL     1       4.429  -1.502  -0.185  1.00  0.00           C  
HETATM   14  C   UNL     1       4.485  -0.169   0.185  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.788   0.387  -0.099  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.794  -1.728  -0.720  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.414  -1.235  -0.553  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.051  -0.671  -0.440  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.533   0.072  -0.169  1.00  0.00           N  
HETATM   20  N   UNL     1      -2.586  -0.675  -0.421  1.00  0.00           N  
HETATM   21  N   UNL     1       5.789   0.451   0.509  1.00  0.00           N1+
HETATM   22  O   UNL     1      -2.145  -2.845  -1.056  1.00  0.00           O  
HETATM   23  O   UNL     1       6.810  -0.210   0.445  1.00  0.00           O  
HETATM   24  O   UNL     1       5.842   1.622   0.840  1.00  0.00           O1-
HETATM   25  H   UNL     1      -1.429   1.783   2.158  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.477   2.429   0.958  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.309   1.652   0.700  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.057   2.270  -1.655  1.00  0.00           H  
HETATM   29  H   UNL     1       0.712  -2.951  -1.128  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.011   4.456   0.201  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.757   4.718  -1.393  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.724   4.047  -0.058  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.341   3.021  -0.955  1.00  0.00           H  
HETATM   34  H   UNL     1       1.205   0.608   0.017  1.00  0.00           H  
HETATM   35  H   UNL     1       3.177  -3.127  -0.776  1.00  0.00           H  
HETATM   36  H   UNL     1       3.379   1.625   0.553  1.00  0.00           H  
HETATM   37  H   UNL     1       5.337  -2.085  -0.235  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.407  -1.379  -1.189  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.409   0.329  -0.686  1.00  0.00           H  
HETATM   40  O   UNL     1      -5.895  -1.136   1.135  1.00  0.00           O  
HETATM   41  H   UNL     1      -6.181  -1.397   2.021  1.00  0.00           H  
CONECT    1    2   25   26                                            
CONECT    2    1   15    5   27                                       
CONECT    3    4    4   18   40                                       
CONECT    4    3    3                                                 
CONECT    5    2    7    8   28                                       
CONECT    6   17   17    9   29                                       
CONECT    7    5   30   31   32                                       
CONECT    8    5   33                                                 
CONECT    9    6   10   10   11                                       
CONECT   10    9    9   12   34                                       
CONECT   11    9   13   13   35                                       
CONECT   12   10   14   14   36                                       
CONECT   13   11   11   14   37                                       
CONECT   14   12   12   13   21                                       
CONECT   15   20    2   19   19                                       
CONECT   16   20   22   22   17                                       
CONECT   17   16   19    6    6                                       
CONECT   18    3   20   38   39                                       
CONECT   19   15   15   17                                            
CONECT   20   18   16   15                                            
CONECT   21   14   24   23   23                                       
CONECT   22   16   16                                                 
CONECT   23   21   21                                                 
CONECT   24   21                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40    3   41                                                 
CONECT   41   40                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
