COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.594   0.903   0.115  1.00  0.00           O1-
HETATM    2  N   UNL     1       2.046  -0.179   0.006  1.00  0.00           N1+
HETATM    3  O   UNL     1       2.714  -1.192  -0.104  1.00  0.00           O  
HETATM    4  C   UNL     1       0.568  -0.265   0.008  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.207   0.887   0.015  1.00  0.00           C  
HETATM    6  N   UNL     1       0.397   2.128   0.021  1.00  0.00           N  
HETATM    7  C   UNL     1      -0.419   3.340  -0.091  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.541   0.788   0.021  1.00  0.00           N  
HETATM    9  C   UNL     1      -2.138  -0.385   0.009  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.506  -0.441   0.010  1.00  0.00           N  
HETATM   11  N   UNL     1      -1.423  -1.543   0.002  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.074  -1.507   0.001  1.00  0.00           C  
HETATM   13  O   UNL     1       0.575  -2.541  -0.005  1.00  0.00           O  
HETATM   14  H   UNL     1       1.361   2.198   0.099  1.00  0.00           H  
HETATM   15  H   UNL     1      -0.971   3.320  -1.031  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.120   3.384   0.742  1.00  0.00           H  
HETATM   17  H   UNL     1       0.228   4.217  -0.068  1.00  0.00           H  
HETATM   18  H   UNL     1      -3.956  -1.301   0.006  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.025   0.378   0.015  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.884  -2.396  -0.003  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5    5   12                                       
CONECT    5    4    4    6    8                                       
CONECT    6    5    7   14                                            
CONECT    7    6   15   16   17                                       
CONECT    8    5    9    9                                            
CONECT    9    8    8   10   11                                       
CONECT   10    9   18   19                                            
CONECT   11    9   12   20                                            
CONECT   12    4   11   13   13                                       
CONECT   13   12   12                                                 
CONECT   14    6                                                      
CONECT   15    7                                                      
CONECT   16    7                                                      
CONECT   17    7                                                      
CONECT   18   10                                                      
CONECT   19   10                                                      
CONECT   20   11                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
