COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.376  -1.422  -0.032  1.00  0.00           C  
HETATM    2  C   UNL     1       0.661  -0.540  -0.340  1.00  0.00           C  
HETATM    3  C   UNL     1       1.956  -1.006  -0.427  1.00  0.00           C  
HETATM    4  C   UNL     1       3.077  -0.055  -0.758  1.00  0.00           C  
HETATM    5  C   UNL     1       3.646   0.534   0.534  1.00  0.00           C  
HETATM    6  C   UNL     1       4.767   1.485   0.202  1.00  0.00           C  
HETATM    7  O   UNL     1       5.419   2.124   1.186  1.00  0.00           O  
HETATM    8  O   UNL     1       5.078   1.673  -0.950  1.00  0.00           O  
HETATM    9  C   UNL     1       2.229  -2.345  -0.209  1.00  0.00           C  
HETATM   10  C   UNL     1       1.206  -3.225   0.097  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.094  -2.772   0.186  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.765  -0.929   0.069  1.00  0.00           C  
HETATM   13  O   UNL     1      -2.168   0.343  -0.118  1.00  0.00           O  
HETATM   14  C   UNL     1      -3.498   0.420   0.053  1.00  0.00           C  
HETATM   15  N   UNL     1      -4.313   1.650  -0.063  1.00  0.00           N1+
HETATM   16  O   UNL     1      -5.517   1.603   0.119  1.00  0.00           O1-
HETATM   17  O   UNL     1      -3.781   2.710  -0.341  1.00  0.00           O  
HETATM   18  C   UNL     1      -3.966  -0.807   0.353  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.860  -1.681   0.360  1.00  0.00           C  
HETATM   20  H   UNL     1       0.449   0.506  -0.510  1.00  0.00           H  
HETATM   21  H   UNL     1       3.863  -0.590  -1.291  1.00  0.00           H  
HETATM   22  H   UNL     1       2.696   0.750  -1.387  1.00  0.00           H  
HETATM   23  H   UNL     1       2.860   1.070   1.066  1.00  0.00           H  
HETATM   24  H   UNL     1       4.027  -0.271   1.163  1.00  0.00           H  
HETATM   25  H   UNL     1       6.130   2.724   0.924  1.00  0.00           H  
HETATM   26  H   UNL     1       3.245  -2.705  -0.278  1.00  0.00           H  
HETATM   27  H   UNL     1       1.426  -4.269   0.265  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.891  -3.460   0.425  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.995  -1.072   0.549  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.878  -2.741   0.564  1.00  0.00           H  
CONECT    1   12   11   11    2                                       
CONECT    2    1    3    3   20                                       
CONECT    3    2    2    9    4                                       
CONECT    4    3    5   21   22                                       
CONECT    5    4    6   23   24                                       
CONECT    6    8    8    5    7                                       
CONECT    7    6   25                                                 
CONECT    8    6    6                                                 
CONECT    9   10   10    3   26                                       
CONECT   10   11    9    9   27                                       
CONECT   11    1    1   10   28                                       
CONECT   12   13   19   19    1                                       
CONECT   13   14   12                                                 
CONECT   14   15   18   18   13                                       
CONECT   15   16   17   17   14                                       
CONECT   16   15                                                      
CONECT   17   15   15                                                 
CONECT   18   14   14   19   29                                       
CONECT   19   18   12   12   30                                       
CONECT   20    2                                                      
CONECT   21    4                                                      
CONECT   22    4                                                      
CONECT   23    5                                                      
CONECT   24    5                                                      
CONECT   25    7                                                      
CONECT   26    9                                                      
CONECT   27   10                                                      
CONECT   28   11                                                      
CONECT   29   18                                                      
CONECT   30   19                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
