COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.242   4.544  -0.075  1.00  0.00           O  
HETATM    2  C   UNL     1       1.905   3.233  -0.182  1.00  0.00           C  
HETATM    3  C   UNL     1       2.373   2.320   0.754  1.00  0.00           C  
HETATM    4  C   UNL     1       2.034   0.987   0.651  1.00  0.00           C  
HETATM    5 CL   UNL     1       2.620  -0.153   1.822  1.00  0.00          Cl  
HETATM    6  C   UNL     1       1.216   0.556  -0.401  1.00  0.00           C  
HETATM    7  C   UNL     1       0.850  -0.863  -0.516  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.396  -1.400  -0.542  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.613  -0.562  -0.449  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.296  -0.451   0.764  1.00  0.00           C  
HETATM   11 CL   UNL     1      -1.721  -1.296   2.167  1.00  0.00          Cl  
HETATM   12  C   UNL     1      -3.429   0.333   0.845  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.889   1.010  -0.276  1.00  0.00           C  
HETATM   14  O   UNL     1      -5.008   1.776  -0.193  1.00  0.00           O  
HETATM   15  C   UNL     1      -3.212   0.901  -1.484  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.076   0.125  -1.572  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.468  -2.845  -0.665  1.00  0.00           C  
HETATM   18  C   UNL     1       0.679  -3.504  -0.742  1.00  0.00           C  
HETATM   19  S   UNL     1       1.939  -2.257  -0.662  1.00  0.00           S  
HETATM   20  O   UNL     1       2.391  -2.170  -2.007  1.00  0.00           O  
HETATM   21  C   UNL     1       0.747   1.481  -1.341  1.00  0.00           C  
HETATM   22  C   UNL     1       1.089   2.810  -1.224  1.00  0.00           C  
HETATM   23  H   UNL     1       1.626   5.067   0.456  1.00  0.00           H  
HETATM   24  H   UNL     1       3.004   2.654   1.565  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.959   0.419   1.783  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.827   1.299  -0.384  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.573   1.429  -2.354  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.550   0.042  -2.512  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.416  -3.361  -0.693  1.00  0.00           H  
HETATM   30  H   UNL     1       0.818  -4.571  -0.836  1.00  0.00           H  
HETATM   31  H   UNL     1       0.116   1.154  -2.154  1.00  0.00           H  
HETATM   32  H   UNL     1       0.724   3.525  -1.947  1.00  0.00           H  
CONECT    1    2   23                                                 
CONECT    2    1    3    3   22                                       
CONECT    3    2    2    4   24                                       
CONECT    4    3    5    6    6                                       
CONECT    5    4                                                      
CONECT    6    4    4   21    7                                       
CONECT    7    8    8    6   19                                       
CONECT    8    9   17    7    7                                       
CONECT    9   16   16   10    8                                       
CONECT   10   12   12    9   11                                       
CONECT   11   10                                                      
CONECT   12   13   10   10   25                                       
CONECT   13   14   15   15   12                                       
CONECT   14   13   26                                                 
CONECT   15   13   13   16   27                                       
CONECT   16   15    9    9   28                                       
CONECT   17    8   18   18   29                                       
CONECT   18   17   17   19   30                                       
CONECT   19    7   18   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   22   22    6   31                                       
CONECT   22    2   21   21   32                                       
CONECT   23    1                                                      
CONECT   24    3                                                      
CONECT   25   12                                                      
CONECT   26   14                                                      
CONECT   27   15                                                      
CONECT   28   16                                                      
CONECT   29   17                                                      
CONECT   30   18                                                      
CONECT   31   21                                                      
CONECT   32   22                                                      
MASTER        0    0    0    0    0    0    0    0   32    0   32    0
END
