COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.173  -1.491   0.221  1.00  0.00           C  
HETATM    2 CL   UNL     1       0.068   2.355   0.126  1.00  0.00          Cl  
HETATM    3  N   UNL     1      -0.102  -4.725  -0.003  1.00  0.00           N  
HETATM    4  C   UNL     1      -0.074  -3.589   0.018  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.040  -2.158   0.043  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.219  -1.427  -0.109  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.183  -0.041  -0.084  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.364   0.691  -0.236  1.00  0.00           N  
HETATM    9  C   UNL     1      -3.548   0.135   0.087  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.582  -0.962   0.604  1.00  0.00           O  
HETATM   11  C   UNL     1      -4.818   0.869  -0.192  1.00  0.00           C  
HETATM   12  O   UNL     1      -6.001   0.314   0.131  1.00  0.00           O  
HETATM   13  O   UNL     1      -4.784   1.966  -0.709  1.00  0.00           O  
HETATM   14  C   UNL     1       0.026   0.620   0.094  1.00  0.00           C  
HETATM   15  C   UNL     1       1.203  -0.105   0.246  1.00  0.00           C  
HETATM   16  N   UNL     1       2.417   0.564   0.424  1.00  0.00           N  
HETATM   17  C   UNL     1       3.550   0.056  -0.100  1.00  0.00           C  
HETATM   18  O   UNL     1       3.531  -1.025  -0.652  1.00  0.00           O  
HETATM   19  C   UNL     1       4.828   0.823  -0.002  1.00  0.00           C  
HETATM   20  O   UNL     1       4.846   1.903   0.549  1.00  0.00           O  
HETATM   21  O   UNL     1       5.959   0.315  -0.526  1.00  0.00           O  
HETATM   22  H   UNL     1       2.086  -2.053   0.344  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.159  -1.941  -0.248  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.331   1.600  -0.575  1.00  0.00           H  
HETATM   25  H   UNL     1      -6.796   0.828  -0.069  1.00  0.00           H  
HETATM   26  H   UNL     1       2.445   1.395   0.925  1.00  0.00           H  
HETATM   27  H   UNL     1       6.761   0.848  -0.438  1.00  0.00           H  
CONECT    1    5    5   15   22                                       
CONECT    2   14                                                      
CONECT    3    4    4    4                                            
CONECT    4    3    3    3    5                                       
CONECT    5    4    1    1    6                                       
CONECT    6    5    7    7   23                                       
CONECT    7    6    6   14    8                                       
CONECT    8    7    9   24                                            
CONECT    9    8   11   10   10                                       
CONECT   10    9    9                                                 
CONECT   11   13   13   12    9                                       
CONECT   12   11   25                                                 
CONECT   13   11   11                                                 
CONECT   14   15   15    7    2                                       
CONECT   15    1   16   14   14                                       
CONECT   16   15   17   26                                            
CONECT   17   16   19   18   18                                       
CONECT   18   17   17                                                 
CONECT   19   20   20   17   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   27                                                 
CONECT   22    1                                                      
CONECT   23    6                                                      
CONECT   24    8                                                      
CONECT   25   12                                                      
CONECT   26   16                                                      
CONECT   27   21                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
