COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       7.757  -1.927   0.000  1.00  0.00           O  
HETATM    2  C   UNL     1       7.032  -2.899   0.005  1.00  0.00           C  
HETATM    3  N   UNL     1       5.693  -2.741   0.006  1.00  0.00           N  
HETATM    4  C   UNL     1       5.138  -1.452   0.001  1.00  0.00           C  
HETATM    5  N   UNL     1       3.837  -1.162   0.001  1.00  0.00           N  
HETATM    6  C   UNL     1       3.685   0.147   0.002  1.00  0.00           C  
HETATM    7  N   UNL     1       4.922   0.726  -0.007  1.00  0.00           N  
HETATM    8  C   UNL     1       5.836  -0.283  -0.004  1.00  0.00           C  
HETATM    9  C   UNL     1       5.211   2.162  -0.014  1.00  0.00           C  
HETATM   10  C   UNL     1       2.398   0.864   0.003  1.00  0.00           C  
HETATM   11  O   UNL     1       2.380   2.081   0.004  1.00  0.00           O  
HETATM   12  N   UNL     1       1.241   0.173   0.002  1.00  0.00           N  
HETATM   13  C   UNL     1       0.017   0.856   0.002  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.192   0.293  -0.005  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.110   1.238   0.002  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.483   2.451   0.004  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.143   2.209   0.004  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.129   3.766   0.004  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.568   1.022   0.002  1.00  0.00           C  
HETATM   20  O   UNL     1      -4.323   1.975   0.002  1.00  0.00           O  
HETATM   21  N   UNL     1      -4.063  -0.231   0.000  1.00  0.00           N  
HETATM   22  C   UNL     1      -5.513  -0.446   0.000  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.806  -1.947  -0.002  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.297  -2.168  -0.003  1.00  0.00           C  
HETATM   25  N   UNL     1      -7.951  -2.263  -1.148  1.00  0.00           N1+
HETATM   26  N   UNL     1      -7.951  -2.266   1.143  1.00  0.00           N  
HETATM   27  H   UNL     1       7.458  -3.891   0.008  1.00  0.00           H  
HETATM   28  H   UNL     1       5.113  -3.519   0.009  1.00  0.00           H  
HETATM   29  H   UNL     1       6.911  -0.177  -0.006  1.00  0.00           H  
HETATM   30  H   UNL     1       5.281   2.514  -1.043  1.00  0.00           H  
HETATM   31  H   UNL     1       4.411   2.696   0.499  1.00  0.00           H  
HETATM   32  H   UNL     1       6.156   2.345   0.498  1.00  0.00           H  
HETATM   33  H   UNL     1       1.256  -0.797   0.001  1.00  0.00           H  
HETATM   34  H   UNL     1       0.644   2.949   0.005  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.289   4.092  -1.023  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.088   3.698   0.518  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.491   4.484   0.519  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.461  -0.991  -0.001  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.947   0.009   0.890  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.947   0.011  -0.890  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.371  -2.401  -0.892  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.372  -2.403   0.887  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.471  -2.191  -1.988  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.910  -2.405  -1.149  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.911  -2.408   1.142  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.472  -2.196   1.983  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   27                                       
CONECT    3    2    4   28                                            
CONECT    4    3    5    8    8                                       
CONECT    5    4    6    6                                            
CONECT    6    5    5    7   10                                       
CONECT    7    6    8    9                                            
CONECT    8    4    4    7   29                                       
CONECT    9    7   30   31   32                                       
CONECT   10    6   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   33                                            
CONECT   13   12   14   17   17                                       
CONECT   14   13   15   15                                            
CONECT   15   14   14   16   19                                       
CONECT   16   15   17   18                                            
CONECT   17   13   13   16   34                                       
CONECT   18   16   35   36   37                                       
CONECT   19   15   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   38                                            
CONECT   22   21   23   39   40                                       
CONECT   23   22   24   41   42                                       
CONECT   24   23   25   25   26                                       
CONECT   25   24   24   43   44                                       
CONECT   26   24   45   46                                            
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   12                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
