COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.479   0.807  -0.691  1.00  0.00           C  
HETATM    2  C   UNL     1       0.523   0.111   0.348  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.704  -0.686   0.128  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.624  -2.069  -0.014  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.959  -0.052   0.068  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.105  -0.814  -0.139  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.007  -2.185  -0.284  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.773  -2.809  -0.219  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.059   1.415   0.224  1.00  0.00           C  
HETATM   10  N   UNL     1       4.706   0.309  -0.889  1.00  0.00           N  
HETATM   11  N   UNL     1       1.723  -0.501   0.406  1.00  0.00           N  
HETATM   12  C   UNL     1       2.938   0.288   0.623  1.00  0.00           C  
HETATM   13  N   UNL     1      -4.430  -0.157  -0.204  1.00  0.00           N1+
HETATM   14  C   UNL     1       5.142  -0.497   0.086  1.00  0.00           C  
HETATM   15  C   UNL     1       4.077  -0.605   1.156  1.00  0.00           C  
HETATM   16  O   UNL     1       6.219  -1.053   0.109  1.00  0.00           O  
HETATM   17  O   UNL     1       2.896   1.558  -1.443  1.00  0.00           O  
HETATM   18  O   UNL     1       0.449   1.317   0.478  1.00  0.00           O  
HETATM   19  O   UNL     1      -1.990   2.135  -0.751  1.00  0.00           O  
HETATM   20  O   UNL     1      -2.226   1.952   1.448  1.00  0.00           O  
HETATM   21  O   UNL     1      -4.517   1.051  -0.076  1.00  0.00           O1-
HETATM   22  O   UNL     1      -5.433  -0.824  -0.385  1.00  0.00           O  
HETATM   23  H   UNL     1       0.335  -2.563   0.035  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.898  -2.774  -0.444  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.708  -3.882  -0.330  1.00  0.00           H  
HETATM   26  H   UNL     1       5.235   0.516  -1.675  1.00  0.00           H  
HETATM   27  H   UNL     1       1.782  -1.464   0.303  1.00  0.00           H  
HETATM   28  H   UNL     1       2.741   1.112   1.309  1.00  0.00           H  
HETATM   29  H   UNL     1       4.449  -0.225   2.108  1.00  0.00           H  
HETATM   30  H   UNL     1       3.740  -1.636   1.259  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.286   2.916   1.500  1.00  0.00           H  
CONECT    1   10   17   17   12                                       
CONECT    2   18   18   11    3                                       
CONECT    3    2    5    5    4                                       
CONECT    4    3    8    8   23                                       
CONECT    5    9    3    3    6                                       
CONECT    6    5    7    7   13                                       
CONECT    7    6    6    8   24                                       
CONECT    8    4    4    7   25                                       
CONECT    9   19   19   20    5                                       
CONECT   10   14    1   26                                            
CONECT   11   12    2   27                                            
CONECT   12    1   15   11   28                                       
CONECT   13    6   21   22   22                                       
CONECT   14   16   16   10   15                                       
CONECT   15   14   12   29   30                                       
CONECT   16   14   14                                                 
CONECT   17    1    1                                                 
CONECT   18    2    2                                                 
CONECT   19    9    9                                                 
CONECT   20    9   31                                                 
CONECT   21   13                                                      
CONECT   22   13   13                                                 
CONECT   23    4                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26   10                                                      
CONECT   27   11                                                      
CONECT   28   12                                                      
CONECT   29   15                                                      
CONECT   30   15                                                      
CONECT   31   20                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
