COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  B   UNL     1       3.086  -0.411  -0.132  1.00  0.00           B  
HETATM    2  O   UNL     1       4.035   0.638  -0.264  1.00  0.00           O  
HETATM    3  O   UNL     1       3.462  -1.635   0.481  1.00  0.00           O  
HETATM    4  C   UNL     1       1.621  -0.214  -0.660  1.00  0.00           C  
HETATM    5  N   UNL     1       0.817   0.451   0.369  1.00  0.00           N  
HETATM    6  S   UNL     1      -0.806   0.679   0.133  1.00  0.00           S  
HETATM    7  O   UNL     1      -1.238   1.361   1.302  1.00  0.00           O  
HETATM    8  O   UNL     1      -0.891   1.291  -1.146  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.496  -0.998   0.083  1.00  0.00           C  
HETATM   10 CL   UNL     1      -3.279  -0.907  -0.172  1.00  0.00          Cl  
HETATM   11  H   UNL     1       3.711   1.401  -0.761  1.00  0.00           H  
HETATM   12  H   UNL     1       4.382  -1.661   0.776  1.00  0.00           H  
HETATM   13  H   UNL     1       1.638   0.400  -1.560  1.00  0.00           H  
HETATM   14  H   UNL     1       1.184  -1.185  -0.891  1.00  0.00           H  
HETATM   15  H   UNL     1       1.235   0.757   1.189  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.040  -1.555  -0.735  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.289  -1.504   1.026  1.00  0.00           H  
CONECT    1    4    2    3                                            
CONECT    2    1   11                                                 
CONECT    3    1   12                                                 
CONECT    4    5    1   13   14                                       
CONECT    5    6    4   15                                            
CONECT    6    8    8    9    7                                       
CONECT    6    7    5                                                 
CONECT    7    6    6                                                 
CONECT    8    6    6                                                 
CONECT    9   10    6   16   17                                       
CONECT   10    9                                                      
CONECT   11    2                                                      
CONECT   12    3                                                      
CONECT   13    4                                                      
CONECT   14    4                                                      
CONECT   15    5                                                      
CONECT   16    9                                                      
CONECT   17    9                                                      
MASTER        0    0    0    0    0    0    0    0   17    0   17    0
END
