COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.574  -3.323   0.139  1.00  0.00           O  
HETATM    2  C   UNL     1       0.277  -2.289  -0.009  1.00  0.00           C  
HETATM    3  O   UNL     1       1.468  -2.496  -0.133  1.00  0.00           O  
HETATM    4  C   UNL     1      -0.236  -0.908  -0.019  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.613  -0.669   0.001  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.086   0.624  -0.008  1.00  0.00           C  
HETATM    7  N   UNL     1      -3.545   0.874   0.013  1.00  0.00           N1+
HETATM    8  O   UNL     1      -4.323  -0.062   0.038  1.00  0.00           O  
HETATM    9  O   UNL     1      -3.967   2.017   0.005  1.00  0.00           O1-
HETATM   10  C   UNL     1      -1.204   1.693  -0.036  1.00  0.00           C  
HETATM   11  C   UNL     1       0.158   1.474  -0.056  1.00  0.00           C  
HETATM   12  C   UNL     1       0.655   0.176  -0.042  1.00  0.00           C  
HETATM   13  N   UNL     1       2.026  -0.046  -0.062  1.00  0.00           N  
HETATM   14  C   UNL     1       2.953   1.084   0.025  1.00  0.00           C  
HETATM   15  C   UNL     1       4.392   0.568  -0.018  1.00  0.00           C  
HETATM   16  N   UNL     1       5.322   1.702   0.070  1.00  0.00           N  
HETATM   17  H   UNL     1      -0.191  -4.211   0.139  1.00  0.00           H  
HETATM   18  H   UNL     1      -2.305  -1.498   0.023  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.585   2.703  -0.047  1.00  0.00           H  
HETATM   20  H   UNL     1       0.839   2.312  -0.078  1.00  0.00           H  
HETATM   21  H   UNL     1       2.369  -0.951  -0.133  1.00  0.00           H  
HETATM   22  H   UNL     1       2.784   1.758  -0.815  1.00  0.00           H  
HETATM   23  H   UNL     1       2.786   1.620   0.960  1.00  0.00           H  
HETATM   24  H   UNL     1       4.562  -0.106   0.822  1.00  0.00           H  
HETATM   25  H   UNL     1       4.559   0.033  -0.952  1.00  0.00           H  
HETATM   26  H   UNL     1       5.145   2.252   0.897  1.00  0.00           H  
HETATM   27  H   UNL     1       6.280   1.387   0.044  1.00  0.00           H  
CONECT    1    2   17                                                 
CONECT    2    4    3    3    1                                       
CONECT    3    2    2                                                 
CONECT    4   12   12    5    2                                       
CONECT    5    6    6    4   18                                       
CONECT    6   10    7    5    5                                       
CONECT    7    9    6    8    8                                       
CONECT    8    7    7                                                 
CONECT    9    7                                                      
CONECT   10   11   11    6   19                                       
CONECT   11   10   10   12   20                                       
CONECT   12   11   13    4    4                                       
CONECT   13   14   12   21                                            
CONECT   14   13   15   22   23                                       
CONECT   15   14   16   24   25                                       
CONECT   16   15   26   27                                            
CONECT   17    1                                                      
CONECT   18    5                                                      
CONECT   19   10                                                      
CONECT   20   11                                                      
CONECT   21   13                                                      
CONECT   22   14                                                      
CONECT   23   14                                                      
CONECT   24   15                                                      
CONECT   25   15                                                      
CONECT   26   16                                                      
CONECT   27   16                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
