COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.146   0.810  -0.111  1.00  0.00           C  
HETATM    2  C   UNL     1       2.466   1.557   0.096  1.00  0.00           C  
HETATM    3  C   UNL     1       3.615  -0.656   0.172  1.00  0.00           C  
HETATM    4  C   UNL     1       2.250  -1.317  -0.038  1.00  0.00           C  
HETATM    5  C   UNL     1       2.226  -2.673   0.671  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.181   1.079   0.299  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.263   1.751   0.848  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.543   1.267   0.660  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.746   0.113  -0.075  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.668  -0.559  -0.622  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.387  -0.075  -0.443  1.00  0.00           C  
HETATM   12  N   UNL     1      -5.118  -0.404  -0.275  1.00  0.00           N1+
HETATM   13  O   UNL     1       0.080   1.554   0.483  1.00  0.00           O  
HETATM   14  O   UNL     1       4.856   1.380  -0.236  1.00  0.00           O  
HETATM   15  O   UNL     1       4.634  -1.465  -0.419  1.00  0.00           O  
HETATM   16  C   UNL     1       3.611   0.725  -0.490  1.00  0.00           C  
HETATM   17  O   UNL     1       1.228  -0.478   0.502  1.00  0.00           O  
HETATM   18  O   UNL     1       0.997  -3.341   0.379  1.00  0.00           O  
HETATM   19  O   UNL     1      -5.298  -1.421  -0.921  1.00  0.00           O1-
HETATM   20  N   UNL     1       2.406   2.858  -0.584  1.00  0.00           N  
HETATM   21  O   UNL     1      -6.068   0.187   0.208  1.00  0.00           O  
HETATM   22  H   UNL     1      -2.105   2.652   1.422  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.386   1.790   1.087  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.829  -1.460  -1.195  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.546  -0.600  -0.871  1.00  0.00           H  
HETATM   26  H   UNL     1       0.957   0.694  -1.178  1.00  0.00           H  
HETATM   27  H   UNL     1       2.635   1.711   1.162  1.00  0.00           H  
HETATM   28  H   UNL     1       2.077  -1.462  -1.105  1.00  0.00           H  
HETATM   29  H   UNL     1       3.061  -3.280   0.323  1.00  0.00           H  
HETATM   30  H   UNL     1       2.310  -2.521   1.747  1.00  0.00           H  
HETATM   31  H   UNL     1       3.808  -0.548   1.239  1.00  0.00           H  
HETATM   32  H   UNL     1       0.912  -4.209   0.797  1.00  0.00           H  
HETATM   33  H   UNL     1       4.693  -2.356  -0.047  1.00  0.00           H  
HETATM   34  H   UNL     1       3.468   0.615  -1.565  1.00  0.00           H  
HETATM   35  H   UNL     1       5.627   0.905  -0.575  1.00  0.00           H  
HETATM   36  H   UNL     1       1.654   3.423  -0.218  1.00  0.00           H  
HETATM   37  H   UNL     1       3.289   3.342  -0.516  1.00  0.00           H  
CONECT    1   13   17    2   26                                       
CONECT    2    1   16   20   27                                       
CONECT    3    4   15   16   31                                       
CONECT    4   17    5    3   28                                       
CONECT    5    4   18   29   30                                       
CONECT    6    7    7   11   13                                       
CONECT    7    8    6    6   22                                       
CONECT    8    7    9    9   23                                       
CONECT    9    8    8   12   10                                       
CONECT   10    9   11   11   24                                       
CONECT   11   10   10    6   25                                       
CONECT   12    9   21   21   19                                       
CONECT   13    6    1                                                 
CONECT   14   16   35                                                 
CONECT   15    3   33                                                 
CONECT   16    3   14    2   34                                       
CONECT   17    1    4                                                 
CONECT   18    5   32                                                 
CONECT   19   12                                                      
CONECT   20    2   36   37                                            
CONECT   21   12   12                                                 
CONECT   22    7                                                      
CONECT   23    8                                                      
CONECT   24   10                                                      
CONECT   25   11                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    3                                                      
CONECT   32   18                                                      
CONECT   33   15                                                      
CONECT   34   16                                                      
CONECT   35   14                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
