COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -8.682   0.444  -0.538  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.108  -0.846  -0.269  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.902  -1.118   0.633  1.00  0.00           C  
HETATM    4  N   UNL     1       1.268  -2.295   0.479  1.00  0.00           N  
HETATM    5  C   UNL     1       0.116  -1.934  -0.120  1.00  0.00           C  
HETATM    6  O   UNL     1       2.917  -1.655  -2.105  1.00  0.00           O  
HETATM    7  C   UNL     1      -6.552   1.479  -0.560  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.347   0.254  -0.406  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.141  -0.018   0.496  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.380   1.082   0.359  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.759   1.061   1.653  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.101  -2.266  -1.266  1.00  0.00           O  
HETATM   13  C   UNL     1      -7.899   1.467   0.172  1.00  0.00           C  
HETATM   14  N   UNL     1      -6.709   0.461  -1.611  1.00  0.00           N  
HETATM   15  S   UNL     1      -6.205   0.065   1.651  1.00  0.00           S  
HETATM   16  C   UNL     1      -7.936  -0.070  -1.525  1.00  0.00           C  
HETATM   17  O   UNL     1      -8.336  -0.940  -2.275  1.00  0.00           O  
HETATM   18  C   UNL     1       2.257  -3.089  -0.254  1.00  0.00           C  
HETATM   19  C   UNL     1       3.174  -3.839   0.732  1.00  0.00           C  
HETATM   20  C   UNL     1       4.327  -2.886   0.984  1.00  0.00           C  
HETATM   21  O   UNL     1       4.999  -2.807   1.984  1.00  0.00           O  
HETATM   22  C   UNL     1       4.465  -2.056  -0.274  1.00  0.00           C  
HETATM   23  C   UNL     1       3.172  -2.181  -1.048  1.00  0.00           C  
HETATM   24  C   UNL     1       4.706  -0.614   0.090  1.00  0.00           C  
HETATM   25  C   UNL     1       5.848   0.028  -0.350  1.00  0.00           C  
HETATM   26  C   UNL     1       6.069   1.352  -0.016  1.00  0.00           C  
HETATM   27  C   UNL     1       7.315   2.052  -0.496  1.00  0.00           C  
HETATM   28  S   UNL     1       6.992   2.827  -2.103  1.00  0.00           S  
HETATM   29  C   UNL     1       5.148   2.033   0.757  1.00  0.00           C  
HETATM   30  C   UNL     1       4.005   1.391   1.196  1.00  0.00           C  
HETATM   31  C   UNL     1       3.782   0.069   0.859  1.00  0.00           C  
HETATM   32  C   UNL     1       3.001   2.133   2.039  1.00  0.00           C  
HETATM   33  S   UNL     1       1.775   2.925   0.962  1.00  0.00           S  
HETATM   34  H   UNL     1      -9.591   0.180  -0.324  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.784  -0.297  -1.153  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.554  -1.793  -0.573  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.456  -0.171   0.937  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.226  -1.667   1.517  1.00  0.00           H  
HETATM   39  H   UNL     1       1.442  -2.029   1.396  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.371   2.459  -1.001  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.023   0.803  -1.290  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.793  -0.693  -0.710  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.465  -0.567   1.380  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.695   0.929   0.800  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.917   1.966   0.798  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.659   1.942   2.287  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.606   0.451   1.968  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.387   2.438   0.092  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.033   0.214  -2.261  1.00  0.00           H  
HETATM   50  H   UNL     1       1.757  -3.794  -0.917  1.00  0.00           H  
HETATM   51  H   UNL     1       2.643  -4.048   1.661  1.00  0.00           H  
HETATM   52  H   UNL     1       3.536  -4.765   0.284  1.00  0.00           H  
HETATM   53  H   UNL     1       5.295  -2.430  -0.874  1.00  0.00           H  
HETATM   54  H   UNL     1       6.568  -0.504  -0.954  1.00  0.00           H  
HETATM   55  H   UNL     1       7.602   2.817   0.226  1.00  0.00           H  
HETATM   56  H   UNL     1       8.123   1.327  -0.597  1.00  0.00           H  
HETATM   57  H   UNL     1       8.170   3.404  -2.403  1.00  0.00           H  
HETATM   58  H   UNL     1       5.320   3.067   1.017  1.00  0.00           H  
HETATM   59  H   UNL     1       2.887  -0.432   1.199  1.00  0.00           H  
HETATM   60  H   UNL     1       2.499   1.433   2.708  1.00  0.00           H  
HETATM   61  H   UNL     1       3.512   2.894   2.628  1.00  0.00           H  
HETATM   62  H   UNL     1       0.957   3.539   1.835  1.00  0.00           H  
CONECT    1   13   16   34                                            
CONECT    2    9    3   35   36                                       
CONECT    3    2    5   37   38                                       
CONECT    4    5   18   39                                            
CONECT    5    3    4   12   12                                       
CONECT    6   23   23                                                 
CONECT    7   13   14   10   40                                       
CONECT    8   10    9   41   42                                       
CONECT    9    8    2   43   44                                       
CONECT   10   15    7    8   45                                       
CONECT   11   13   15   46   47                                       
CONECT   12    5    5                                                 
CONECT   13    1   11    7   48                                       
CONECT   14   16    7   49                                            
CONECT   15   11   10                                                 
CONECT   16    1   17   17   14                                       
CONECT   17   16   16                                                 
CONECT   18   19    4   23   50                                       
CONECT   19   18   20   51   52                                       
CONECT   20   19   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23   24   53                                       
CONECT   23   18   22    6    6                                       
CONECT   24   22   25   25   31                                       
CONECT   25   24   24   26   54                                       
CONECT   26   25   27   29   29                                       
CONECT   27   26   28   55   56                                       
CONECT   28   27   57                                                 
CONECT   29   26   26   30   58                                       
CONECT   30   31   31   29   32                                       
CONECT   31   24   30   30   59                                       
CONECT   32   30   33   60   61                                       
CONECT   33   32   62                                                 
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   22                                                      
CONECT   54   25                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   32                                                      
CONECT   62   33                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
