COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.783  -3.168  -2.383  1.00  0.00           O  
HETATM    2  S   UNL     1       1.695  -1.986  -1.429  1.00  0.00           S  
HETATM    3  O   UNL     1       3.032  -1.620  -1.119  1.00  0.00           O  
HETATM    4  O   UNL     1       0.753  -1.084  -1.994  1.00  0.00           O  
HETATM    5  C   UNL     1       0.980  -2.577   0.069  1.00  0.00           C  
HETATM    6  C   UNL     1       1.181  -3.882   0.463  1.00  0.00           C  
HETATM    7  C   UNL     1       0.625  -4.348   1.642  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.137  -3.507   2.436  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.348  -2.199   2.058  1.00  0.00           C  
HETATM   10  C   UNL     1       0.211  -1.720   0.867  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.004  -0.323   0.457  1.00  0.00           C  
HETATM   12  C   UNL     1       1.038   0.620   0.592  1.00  0.00           C  
HETATM   13  C   UNL     1       0.833   1.959   0.200  1.00  0.00           C  
HETATM   14  C   UNL     1       1.836   2.866   0.330  1.00  0.00           C  
HETATM   15 CL   UNL     1       1.584   4.514  -0.152  1.00  0.00          Cl  
HETATM   16  C   UNL     1       3.081   2.468   0.856  1.00  0.00           C  
HETATM   17  O   UNL     1       3.985   3.286   0.974  1.00  0.00           O  
HETATM   18  C   UNL     1       3.287   1.131   1.248  1.00  0.00           C  
HETATM   19  C   UNL     1       2.283   0.225   1.123  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.301   0.089  -0.090  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.448   0.057   0.716  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.653   0.442   0.201  1.00  0.00           C  
HETATM   23 CL   UNL     1      -5.075   0.403   1.197  1.00  0.00          Cl  
HETATM   24  C   UNL     1      -1.398   0.523  -1.421  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.607   0.906  -1.925  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.743   0.868  -1.123  1.00  0.00           C  
HETATM   27  O   UNL     1      -4.942   1.250  -1.630  1.00  0.00           O  
HETATM   28  H   UNL     1       1.774  -4.545  -0.151  1.00  0.00           H  
HETATM   29  H   UNL     1       0.786  -5.372   1.944  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.567  -3.878   3.355  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.942  -1.545   2.678  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.121   2.263  -0.204  1.00  0.00           H  
HETATM   33  H   UNL     1       4.241   0.828   1.651  1.00  0.00           H  
HETATM   34  H   UNL     1       2.440  -0.799   1.428  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.379  -0.272   1.743  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.517   0.555  -2.045  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.682   1.241  -2.949  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.133   2.191  -1.520  1.00  0.00           H  
HETATM   39  H   UNL     1       2.165  -2.951  -3.245  1.00  0.00           H  
CONECT    1    2   39                                                 
CONECT    2    5    4    4    3                                       
CONECT    2    3    1                                                 
CONECT    3    2    2                                                 
CONECT    4    2    2                                                 
CONECT    5    6    6   10    2                                       
CONECT    6    7    5    5   28                                       
CONECT    7    8    8    6   29                                       
CONECT    8    7    7    9   30                                       
CONECT    9    8   10   10   31                                       
CONECT   10    9    9    5   11                                       
CONECT   11   10   20   12   12                                       
CONECT   12   11   11   19   13                                       
CONECT   13   12   14   14   32                                       
CONECT   14   13   13   16   15                                       
CONECT   15   14                                                      
CONECT   16   18   14   17   17                                       
CONECT   17   16   16                                                 
CONECT   18   19   19   16   33                                       
CONECT   19   12   18   18   34                                       
CONECT   20   21   11   24   24                                       
CONECT   21   22   22   20   35                                       
CONECT   22   23   21   21   26                                       
CONECT   23   22                                                      
CONECT   24   20   20   25   36                                       
CONECT   25   26   26   24   37                                       
CONECT   26   22   27   25   25                                       
CONECT   27   26   38                                                 
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   13                                                      
CONECT   33   18                                                      
CONECT   34   19                                                      
CONECT   35   21                                                      
CONECT   36   24                                                      
CONECT   37   25                                                      
CONECT   38   27                                                      
CONECT   39    1                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
