COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.139   0.529   0.219  1.00  0.00           C  
HETATM    2  O   UNL     1      -2.919   1.140  -1.077  1.00  0.00           O  
HETATM    3  C   UNL     1      -2.211   0.908  -0.104  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.386   1.520   0.942  1.00  0.00           O1-
HETATM    5  C   UNL     1      -1.191  -0.068  -0.190  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.996  -0.747  -1.347  1.00  0.00           C  
HETATM    7  C   UNL     1       0.064  -1.751  -1.424  1.00  0.00           C  
HETATM    8  C   UNL     1       1.059  -1.735  -0.535  1.00  0.00           C  
HETATM    9  C   UNL     1       1.099  -0.687   0.545  1.00  0.00           C  
HETATM   10  O   UNL     1       1.722   0.494   0.036  1.00  0.00           O  
HETATM   11  C   UNL     1       3.696   1.831  -0.360  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.315  -0.350   1.003  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.864  -1.487   1.753  1.00  0.00           N1+
HETATM   14  H   UNL     1       1.673  -1.062   1.392  1.00  0.00           H  
HETATM   15  H   UNL     1      -0.288   0.528   1.648  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.620  -0.547  -2.206  1.00  0.00           H  
HETATM   17  H   UNL     1       0.042  -2.504  -2.198  1.00  0.00           H  
HETATM   18  H   UNL     1       1.841  -2.479  -0.590  1.00  0.00           H  
HETATM   19  H   UNL     1       3.369   0.477   1.283  1.00  0.00           H  
HETATM   20  H   UNL     1       3.592  -0.320  -0.293  1.00  0.00           H  
HETATM   21  H   UNL     1       3.465   1.883  -1.424  1.00  0.00           H  
HETATM   22  H   UNL     1       3.243   2.680   0.152  1.00  0.00           H  
HETATM   23  H   UNL     1       4.777   1.858  -0.221  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.894  -2.301   1.157  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.279  -1.677   2.552  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.798  -1.265   2.065  1.00  0.00           H  
CONECT    1   10   11   19   20                                       
CONECT    2    3    3                                                 
CONECT    3    2    2    4    5                                       
CONECT    4    3                                                      
CONECT    5    3    6    6   12                                       
CONECT    6    5    5    7   16                                       
CONECT    7    6    8    8   17                                       
CONECT    8    7    7    9   18                                       
CONECT    9    8   10   12   14                                       
CONECT   10    1    9                                                 
CONECT   11    1   21   22   23                                       
CONECT   12    5    9   13   15                                       
CONECT   13   12   24   25   26                                       
CONECT   14    9                                                      
CONECT   15   12                                                      
CONECT   16    6                                                      
CONECT   17    7                                                      
CONECT   18    8                                                      
CONECT   19    1                                                      
CONECT   20    1                                                      
CONECT   21   11                                                      
CONECT   22   11                                                      
CONECT   23   11                                                      
CONECT   24   13                                                      
CONECT   25   13                                                      
CONECT   26   13                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
