COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.548  -0.001  -0.040  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.818   1.170  -0.142  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.475   1.122  -0.460  1.00  0.00           C  
HETATM    4 CL   UNL     1      -4.238   0.063   0.353  1.00  0.00          Cl  
HETATM    5  C   UNL     1      -1.935  -1.223  -0.255  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.592  -1.276  -0.573  1.00  0.00           C  
HETATM    7  C   UNL     1       0.143  -0.103  -0.677  1.00  0.00           C  
HETATM    8  N   UNL     1       1.502  -0.154  -0.999  1.00  0.00           N  
HETATM    9  S   UNL     1       2.641   0.102   0.175  1.00  0.00           S  
HETATM   10  O   UNL     1       3.882  -0.018  -0.509  1.00  0.00           O  
HETATM   11  O   UNL     1       2.253   1.328   0.779  1.00  0.00           O  
HETATM   12  C   UNL     1       2.417  -1.277   1.332  1.00  0.00           C  
HETATM   13  H   UNL     1      -2.299   2.122   0.027  1.00  0.00           H  
HETATM   14  H   UNL     1       0.095   2.036  -0.540  1.00  0.00           H  
HETATM   15  H   UNL     1      -2.507  -2.135  -0.175  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.114  -2.230  -0.741  1.00  0.00           H  
HETATM   17  H   UNL     1       1.777  -0.339  -1.911  1.00  0.00           H  
HETATM   18  H   UNL     1       2.661  -2.214   0.832  1.00  0.00           H  
HETATM   19  H   UNL     1       3.074  -1.141   2.191  1.00  0.00           H  
HETATM   20  H   UNL     1       1.380  -1.304   1.668  1.00  0.00           H  
CONECT    1    4    2    2    5                                       
CONECT    2    1    1    3   13                                       
CONECT    3    2    7    7   14                                       
CONECT    4    1                                                      
CONECT    5    1    6    6   15                                       
CONECT    6    5    5    7   16                                       
CONECT    7    3    3    6    8                                       
CONECT    8    7    9   17                                            
CONECT    9    8   12   11   11                                       
CONECT    9   10   10                                                 
CONECT   10    9    9                                                 
CONECT   11    9    9                                                 
CONECT   12    9   18   19   20                                       
CONECT   13    2                                                      
CONECT   14    3                                                      
CONECT   15    5                                                      
CONECT   16    6                                                      
CONECT   17    8                                                      
CONECT   18   12                                                      
CONECT   19   12                                                      
CONECT   20   12                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
