COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.311   3.302   0.639  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.088   2.351  -0.092  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.770   0.941   0.407  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.424   0.580   0.059  1.00  0.00           O  
HETATM    5  C   UNL     1      -1.362  -0.810  -0.283  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.794  -1.378  -0.184  1.00  0.00           C  
HETATM    7  O   UNL     1      -3.056  -2.286  -1.255  1.00  0.00           O  
HETATM    8  C   UNL     1      -3.668  -0.099  -0.309  1.00  0.00           C  
HETATM    9  O   UNL     1      -4.917  -0.260   0.367  1.00  0.00           O  
HETATM   10  O   UNL     1      -0.502  -1.495   0.630  1.00  0.00           O  
HETATM   11  C   UNL     1       0.753  -1.021   0.417  1.00  0.00           C  
HETATM   12  C   UNL     1       1.815  -1.507   1.166  1.00  0.00           C  
HETATM   13  C   UNL     1       3.091  -1.024   0.949  1.00  0.00           C  
HETATM   14  C   UNL     1       3.310  -0.056  -0.015  1.00  0.00           C  
HETATM   15  N   UNL     1       4.677   0.461  -0.245  1.00  0.00           N1+
HETATM   16  O   UNL     1       5.609   0.034   0.413  1.00  0.00           O1-
HETATM   17  O   UNL     1       4.871   1.313  -1.093  1.00  0.00           O  
HETATM   18  C   UNL     1       2.253   0.430  -0.762  1.00  0.00           C  
HETATM   19  C   UNL     1       0.976  -0.054  -0.552  1.00  0.00           C  
HETATM   20  H   UNL     1      -2.542   4.176   0.294  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.148   2.558   0.055  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.848   2.424  -1.153  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.910   0.881   1.487  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.989  -0.924  -1.300  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.954  -1.862   0.780  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.423  -3.012  -1.168  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.822   0.171  -1.354  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.375  -0.994  -0.064  1.00  0.00           H  
HETATM   29  H   UNL     1       1.645  -2.262   1.919  1.00  0.00           H  
HETATM   30  H   UNL     1       3.918  -1.402   1.531  1.00  0.00           H  
HETATM   31  H   UNL     1       2.427   1.186  -1.514  1.00  0.00           H  
HETATM   32  H   UNL     1       0.151   0.326  -1.136  1.00  0.00           H  
CONECT    1    2   20                                                 
CONECT    2    1    3   21   22                                       
CONECT    3    2    4    8   23                                       
CONECT    4    3    5                                                 
CONECT    5    4    6   10   24                                       
CONECT    6    5    7    8   25                                       
CONECT    7    6   26                                                 
CONECT    8    3    6    9   27                                       
CONECT    9    8   28                                                 
CONECT   10    5   11                                                 
CONECT   11   10   12   12   19                                       
CONECT   12   11   11   13   29                                       
CONECT   13   12   14   14   30                                       
CONECT   14   13   13   15   18                                       
CONECT   15   14   16   17   17                                       
CONECT   16   15                                                      
CONECT   17   15   15                                                 
CONECT   18   14   19   19   31                                       
CONECT   19   11   18   18   32                                       
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    5                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29   12                                                      
CONECT   30   13                                                      
CONECT   31   18                                                      
CONECT   32   19                                                      
MASTER        0    0    0    0    0    0    0    0   32    0   32    0
END
