COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.319   0.451  -0.878  1.00  0.00           C  
HETATM    2  C   UNL     1       2.746   0.991  -0.748  1.00  0.00           C  
HETATM    3  O   UNL     1       2.725   2.418  -0.828  1.00  0.00           O  
HETATM    4  C   UNL     1       3.325   0.563   0.604  1.00  0.00           C  
HETATM    5  O   UNL     1       4.681   1.000   0.704  1.00  0.00           O  
HETATM    6  C   UNL     1       3.270  -0.964   0.710  1.00  0.00           C  
HETATM    7  O   UNL     1       4.092  -1.543  -0.306  1.00  0.00           O  
HETATM    8  C   UNL     1       1.823  -1.429   0.524  1.00  0.00           C  
HETATM    9  C   UNL     1       1.769  -2.958   0.568  1.00  0.00           C  
HETATM   10  O   UNL     1       1.336  -0.971  -0.739  1.00  0.00           O  
HETATM   11  O   UNL     1       0.499   1.020   0.145  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.826   0.723   0.109  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.327  -0.104  -0.887  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.674  -0.409  -0.918  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.523   0.109   0.042  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.027   0.933   1.035  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.681   1.241   1.071  1.00  0.00           C  
HETATM   18  N   UNL     1      -4.966  -0.219   0.007  1.00  0.00           N1+
HETATM   19  O   UNL     1      -5.404  -0.945  -0.868  1.00  0.00           O  
HETATM   20  O   UNL     1      -5.715   0.236   0.852  1.00  0.00           O1-
HETATM   21  H   UNL     1       0.918   0.716  -1.856  1.00  0.00           H  
HETATM   22  H   UNL     1       3.362   0.589  -1.552  1.00  0.00           H  
HETATM   23  H   UNL     1       2.365   2.760  -1.658  1.00  0.00           H  
HETATM   24  H   UNL     1       3.630  -1.275   1.691  1.00  0.00           H  
HETATM   25  H   UNL     1       4.104  -2.510  -0.298  1.00  0.00           H  
HETATM   26  H   UNL     1       1.204  -1.020   1.322  1.00  0.00           H  
HETATM   27  H   UNL     1       2.388  -3.367  -0.230  1.00  0.00           H  
HETATM   28  H   UNL     1       2.140  -3.307   1.531  1.00  0.00           H  
HETATM   29  H   UNL     1       0.739  -3.289   0.434  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.664  -0.508  -1.637  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.064  -1.052  -1.693  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.693   1.337   1.784  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.293   1.881   1.849  1.00  0.00           H  
HETATM   34  H   UNL     1       2.738   1.007   1.409  1.00  0.00           H  
HETATM   35  H   UNL     1       4.791   1.959   0.638  1.00  0.00           H  
CONECT    1   11   10    2   21                                       
CONECT    2    1    3    4   22                                       
CONECT    3    2   23                                                 
CONECT    4    6    2    5   34                                       
CONECT    5    4   35                                                 
CONECT    6    8    4    7   24                                       
CONECT    7    6   25                                                 
CONECT    8    9   10    6   26                                       
CONECT    9    8   27   28   29                                       
CONECT   10    8    1                                                 
CONECT   11   12    1                                                 
CONECT   12   13   13   17   11                                       
CONECT   13   14   12   12   30                                       
CONECT   14   15   15   13   31                                       
CONECT   15   18   14   14   16                                       
CONECT   16   15   17   17   32                                       
CONECT   17   16   16   12   33                                       
CONECT   18   20   19   19   15                                       
CONECT   19   18   18                                                 
CONECT   20   18                                                      
CONECT   21    1                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    8                                                      
CONECT   27    9                                                      
CONECT   28    9                                                      
CONECT   29    9                                                      
CONECT   30   13                                                      
CONECT   31   14                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
