COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.622   0.736   0.003  1.00  0.00           C  
HETATM    2  C   UNL     1       1.376  -0.112  -0.002  1.00  0.00           C  
HETATM    3  O   UNL     1       1.466  -1.322  -0.006  1.00  0.00           O  
HETATM    4  C   UNL     1       0.100   0.505  -0.002  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.212  -0.172   0.000  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.611  -1.506   0.001  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.954  -1.815   0.002  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.905  -0.805   0.002  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.522   0.519   0.000  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.171   0.851  -0.001  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.498   2.056  -0.003  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.166   1.857   0.003  1.00  0.00           C  
HETATM   13  H   UNL     1       2.635   1.368  -0.885  1.00  0.00           H  
HETATM   14  H   UNL     1       2.633   1.362   0.895  1.00  0.00           H  
HETATM   15  H   UNL     1      -0.873  -2.294   0.002  1.00  0.00           H  
HETATM   16  H   UNL     1      -3.267  -2.849   0.003  1.00  0.00           H  
HETATM   17  H   UNL     1      -4.954  -1.059   0.002  1.00  0.00           H  
HETATM   18  H   UNL     1      -4.271   1.297  -0.001  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.926   2.927  -0.004  1.00  0.00           H  
HETATM   20  H   UNL     1       0.580   2.638   0.007  1.00  0.00           H  
HETATM   21 CL   UNL     1       4.075  -0.332   0.001  1.00  0.00          Cl  
CONECT    1    2   13   14   21                                       
CONECT    2    3    3    1    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   12   12                                       
CONECT    5    6    4   10   10                                       
CONECT    6    7    7    5   15                                       
CONECT    7    6    6    8   16                                       
CONECT    8    7    9    9   17                                       
CONECT    9    8    8   10   18                                       
CONECT   10    5    5    9   11                                       
CONECT   11   10   12   19                                            
CONECT   12    4    4   11   20                                       
CONECT   13    1                                                      
CONECT   14    1                                                      
CONECT   15    6                                                      
CONECT   16    7                                                      
CONECT   17    8                                                      
CONECT   18    9                                                      
CONECT   19   11                                                      
CONECT   20   12                                                      
CONECT   21    1                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
