COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.995  -1.742   2.184  1.00  0.00           O  
HETATM    2  S   UNL     1      -2.904  -0.730   1.190  1.00  0.00           S  
HETATM    3  C   UNL     1      -1.206  -0.601   0.566  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.227  -0.165   1.700  1.00  0.00           C  
HETATM    5  C   UNL     1       1.109   0.093   0.997  1.00  0.00           C  
HETATM    6  C   UNL     1       1.738   1.401   0.740  1.00  0.00           C  
HETATM    7  C   UNL     1       1.913   1.849  -0.572  1.00  0.00           C  
HETATM    8  C   UNL     1       2.501   3.072  -0.808  1.00  0.00           C  
HETATM    9  C   UNL     1       2.921   3.860   0.257  1.00  0.00           C  
HETATM   10  O   UNL     1       3.500   5.065   0.020  1.00  0.00           O  
HETATM   11  C   UNL     1       2.750   3.419   1.563  1.00  0.00           C  
HETATM   12  C   UNL     1       2.157   2.199   1.808  1.00  0.00           C  
HETATM   13  C   UNL     1       1.595  -1.127   0.661  1.00  0.00           C  
HETATM   14  C   UNL     1       2.860  -1.417  -0.038  1.00  0.00           C  
HETATM   15  C   UNL     1       4.082  -1.112   0.569  1.00  0.00           C  
HETATM   16  C   UNL     1       5.262  -1.385  -0.089  1.00  0.00           C  
HETATM   17  C   UNL     1       5.239  -1.961  -1.352  1.00  0.00           C  
HETATM   18  O   UNL     1       6.405  -2.229  -1.996  1.00  0.00           O  
HETATM   19  C   UNL     1       4.027  -2.265  -1.959  1.00  0.00           C  
HETATM   20  C   UNL     1       2.842  -2.001  -1.308  1.00  0.00           C  
HETATM   21  C   UNL     1       0.562  -2.143   1.154  1.00  0.00           C  
HETATM   22  O   UNL     1       0.050  -1.454   2.345  1.00  0.00           O  
HETATM   23  C   UNL     1      -0.649  -1.998   0.181  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.699  -1.285   0.017  1.00  0.00           O  
HETATM   25  C   UNL     1      -3.941  -0.377  -0.965  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.999  -0.163  -1.961  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.248   0.761  -2.958  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.435   1.470  -2.964  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.375   1.258  -1.972  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.134   0.332  -0.977  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.162   0.096   0.099  1.00  0.00           C  
HETATM   32  O   UNL     1      -3.455   0.562   1.407  1.00  0.00           O  
HETATM   33  H   UNL     1      -1.154   0.086  -0.278  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.582   0.637   2.347  1.00  0.00           H  
HETATM   35  H   UNL     1       1.587   1.237  -1.400  1.00  0.00           H  
HETATM   36  H   UNL     1       2.637   3.419  -1.821  1.00  0.00           H  
HETATM   37  H   UNL     1       2.875   5.801  -0.022  1.00  0.00           H  
HETATM   38  H   UNL     1       3.078   4.034   2.387  1.00  0.00           H  
HETATM   39  H   UNL     1       2.020   1.859   2.824  1.00  0.00           H  
HETATM   40  H   UNL     1       4.101  -0.664   1.551  1.00  0.00           H  
HETATM   41  H   UNL     1       6.207  -1.150   0.380  1.00  0.00           H  
HETATM   42  H   UNL     1       6.760  -3.110  -1.816  1.00  0.00           H  
HETATM   43  H   UNL     1       4.014  -2.713  -2.942  1.00  0.00           H  
HETATM   44  H   UNL     1       1.900  -2.242  -1.779  1.00  0.00           H  
HETATM   45  H   UNL     1       0.930  -3.159   1.300  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.390  -2.776   0.362  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.318  -2.012  -0.858  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.072  -0.716  -1.956  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.515   0.929  -3.733  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.627   2.192  -3.744  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.301   1.814  -1.979  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.937   0.725   0.961  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.152   0.345  -0.283  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.140  -0.952   0.399  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   24                                       
CONECT    2   32   32                                                 
CONECT    3    2    4   23   33                                       
CONECT    4    3    5   22   34                                       
CONECT    5    4    6   13   13                                       
CONECT    6    5    7    7   12                                       
CONECT    7    6    6    8   35                                       
CONECT    8    7    9    9   36                                       
CONECT    9    8    8   10   11                                       
CONECT   10    9   37                                                 
CONECT   11    9   12   12   38                                       
CONECT   12    6   11   11   39                                       
CONECT   13    5    5   14   21                                       
CONECT   14   13   15   15   20                                       
CONECT   15   14   14   16   40                                       
CONECT   16   15   17   17   41                                       
CONECT   17   16   16   18   19                                       
CONECT   18   17   42                                                 
CONECT   19   17   20   20   43                                       
CONECT   20   14   19   19   44                                       
CONECT   21   13   23   45   22                                       
CONECT   22    4   21                                                 
CONECT   23    3   21   46   47                                       
CONECT   24    2   25                                                 
CONECT   25   24   26   26   30                                       
CONECT   26   25   25   27   48                                       
CONECT   27   26   28   28   49                                       
CONECT   28   27   27   29   50                                       
CONECT   29   28   30   30   51                                       
CONECT   30   25   29   29   31                                       
CONECT   31   30   52   53   54                                       
CONECT   32    2    2                                                 
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   31                                                      
CONECT   53   31                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
