COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.016  -1.056   0.557  1.00  0.00           O  
HETATM    2  S   UNL     1      -5.669   0.195  -0.020  1.00  0.00           S  
HETATM    3  O   UNL     1      -6.095   0.599  -1.315  1.00  0.00           O  
HETATM    4  N   UNL     1      -6.202   1.359   1.031  1.00  0.00           N  
HETATM    5  C   UNL     1      -3.909   0.269  -0.031  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.182  -0.497   0.864  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.804  -0.445   0.860  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.259   1.087  -0.937  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.881   1.148  -0.951  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.142   0.383  -0.048  1.00  0.00           C  
HETATM   11  C   UNL     1       0.335   0.444  -0.057  1.00  0.00           C  
HETATM   12  O   UNL     1       0.899   1.485  -0.331  1.00  0.00           O  
HETATM   13  N   UNL     1       1.057  -0.656   0.238  1.00  0.00           N  
HETATM   14  C   UNL     1       2.520  -0.586   0.367  1.00  0.00           C  
HETATM   15  C   UNL     1       3.139  -1.680  -0.510  1.00  0.00           C  
HETATM   16  N   UNL     1       2.545  -2.978  -0.160  1.00  0.00           N  
HETATM   17  C   UNL     1       1.103  -2.997  -0.440  1.00  0.00           C  
HETATM   18  C   UNL     1       0.401  -1.956   0.446  1.00  0.00           C  
HETATM   19  C   UNL     1       3.012   0.785  -0.099  1.00  0.00           C  
HETATM   20  C   UNL     1       4.515   0.843   0.007  1.00  0.00           C  
HETATM   21  C   UNL     1       5.297   0.570  -1.099  1.00  0.00           C  
HETATM   22  C   UNL     1       6.674   0.622  -1.002  1.00  0.00           C  
HETATM   23  C   UNL     1       7.270   0.947   0.202  1.00  0.00           C  
HETATM   24  C   UNL     1       6.488   1.220   1.309  1.00  0.00           C  
HETATM   25  C   UNL     1       5.110   1.174   1.210  1.00  0.00           C  
HETATM   26  H   UNL     1      -5.563   1.919   1.499  1.00  0.00           H  
HETATM   27  H   UNL     1      -7.153   1.480   1.179  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.696  -1.137   1.566  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.238  -1.043   1.559  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.832   1.679  -1.636  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.375   1.788  -1.659  1.00  0.00           H  
HETATM   32  H   UNL     1       2.804  -0.746   1.407  1.00  0.00           H  
HETATM   33  H   UNL     1       2.940  -1.461  -1.559  1.00  0.00           H  
HETATM   34  H   UNL     1       4.215  -1.715  -0.342  1.00  0.00           H  
HETATM   35  H   UNL     1       3.017  -3.731  -0.637  1.00  0.00           H  
HETATM   36  H   UNL     1       0.933  -2.759  -1.490  1.00  0.00           H  
HETATM   37  H   UNL     1       0.704  -3.988  -0.222  1.00  0.00           H  
HETATM   38  H   UNL     1       0.485  -2.245   1.493  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.650  -1.885   0.166  1.00  0.00           H  
HETATM   40  H   UNL     1       2.715   0.945  -1.135  1.00  0.00           H  
HETATM   41  H   UNL     1       2.574   1.561   0.529  1.00  0.00           H  
HETATM   42  H   UNL     1       4.831   0.316  -2.040  1.00  0.00           H  
HETATM   43  H   UNL     1       7.286   0.409  -1.866  1.00  0.00           H  
HETATM   44  H   UNL     1       8.347   0.988   0.279  1.00  0.00           H  
HETATM   45  H   UNL     1       6.954   1.479   2.249  1.00  0.00           H  
HETATM   46  H   UNL     1       4.499   1.387   2.075  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    5    4    3    3                                       
CONECT    2    1    1                                                 
CONECT    3    2    2                                                 
CONECT    4    2   26   27                                            
CONECT    5    8    8    6    2                                       
CONECT    6    7    7    5   28                                       
CONECT    7   10    6    6   29                                       
CONECT    8    9    5    5   30                                       
CONECT    9   10   10    8   31                                       
CONECT   10   11    9    9    7                                       
CONECT   11   12   12   13   10                                       
CONECT   12   11   11                                                 
CONECT   13   14   11   18                                            
CONECT   14   19   15   13   32                                       
CONECT   15   14   16   33   34                                       
CONECT   16   15   17   35                                            
CONECT   17   16   18   36   37                                       
CONECT   18   13   17   38   39                                       
CONECT   19   20   14   40   41                                       
CONECT   20   25   19   21   21                                       
CONECT   21   20   20   22   42                                       
CONECT   22   23   23   21   43                                       
CONECT   23   24   22   22   44                                       
CONECT   24   25   25   23   45                                       
CONECT   25   24   24   20   46                                       
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
