COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.605   2.790   0.701  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.766   3.885   0.436  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.852   2.800  -1.395  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.546  -3.424   1.644  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.626   1.692  -1.226  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.533   1.658  -0.152  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.338  -2.068   0.494  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.090  -2.928   0.287  1.00  0.00           C  
HETATM    9  N   UNL     1      -2.767  -1.512  -0.792  1.00  0.00           N  
HETATM   10  N   UNL     1       6.786   2.718   0.422  1.00  0.00           N  
HETATM   11  C   UNL     1      -4.501   2.782   1.781  1.00  0.00           C  
HETATM   12  N   UNL     1       0.013  -2.113  -0.284  1.00  0.00           N  
HETATM   13  C   UNL     1      -5.214   0.578   1.155  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.286   1.690   1.993  1.00  0.00           C  
HETATM   15  O   UNL     1      -5.185  -1.816  -0.402  1.00  0.00           O  
HETATM   16  N   UNL     1      -1.940   3.845  -0.583  1.00  0.00           N  
HETATM   17  C   UNL     1      -4.356   0.551   0.097  1.00  0.00           C  
HETATM   18  O   UNL     1      -4.376  -0.382  -2.283  1.00  0.00           O  
HETATM   19  C   UNL     1       0.989  -3.384   1.499  1.00  0.00           C  
HETATM   20  C   UNL     1       1.244  -2.868   0.066  1.00  0.00           C  
HETATM   21  C   UNL     1       2.444  -1.957   0.041  1.00  0.00           C  
HETATM   22  C   UNL     1       2.336  -0.662   0.515  1.00  0.00           C  
HETATM   23  C   UNL     1       3.432   0.177   0.494  1.00  0.00           C  
HETATM   24  C   UNL     1       4.649  -0.283  -0.006  1.00  0.00           C  
HETATM   25  C   UNL     1       5.831   0.614  -0.031  1.00  0.00           C  
HETATM   26  C   UNL     1       5.738   1.921   0.443  1.00  0.00           C  
HETATM   27  C   UNL     1       7.954   2.319  -0.043  1.00  0.00           C  
HETATM   28  C   UNL     1       8.127   1.037  -0.532  1.00  0.00           C  
HETATM   29  C   UNL     1       7.055   0.161  -0.530  1.00  0.00           C  
HETATM   30  C   UNL     1       4.752  -1.589  -0.482  1.00  0.00           C  
HETATM   31  C   UNL     1       3.651  -2.421  -0.451  1.00  0.00           C  
HETATM   32  S   UNL     1      -4.283  -0.864  -0.950  1.00  0.00           S  
HETATM   33  H   UNL     1      -2.802   4.759   1.070  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.154   2.833  -2.217  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.868  -2.759   2.446  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.881  -4.442   1.839  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.544   0.855  -1.905  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.137  -2.681   0.909  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.108  -1.255   1.182  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.316  -3.774  -0.364  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.163  -1.524  -1.551  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.568   3.636   2.440  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.084  -2.023  -1.284  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.848  -0.275   1.348  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.976   1.684   2.824  1.00  0.00           H  
HETATM   46  H   UNL     1       1.421  -2.700   2.230  1.00  0.00           H  
HETATM   47  H   UNL     1       1.408  -4.382   1.623  1.00  0.00           H  
HETATM   48  H   UNL     1       1.385  -3.703  -0.619  1.00  0.00           H  
HETATM   49  H   UNL     1       1.393  -0.306   0.902  1.00  0.00           H  
HETATM   50  H   UNL     1       3.347   1.188   0.863  1.00  0.00           H  
HETATM   51  H   UNL     1       4.797   2.283   0.831  1.00  0.00           H  
HETATM   52  H   UNL     1       8.789   3.005  -0.043  1.00  0.00           H  
HETATM   53  H   UNL     1       9.089   0.722  -0.910  1.00  0.00           H  
HETATM   54  H   UNL     1       7.162  -0.846  -0.905  1.00  0.00           H  
HETATM   55  H   UNL     1       5.692  -1.950  -0.870  1.00  0.00           H  
HETATM   56  H   UNL     1       3.731  -3.434  -0.815  1.00  0.00           H  
CONECT    1    2    2    6   11                                       
CONECT    2   16    1    1   33                                       
CONECT    3   16   16    5   34                                       
CONECT    4    8   19   35   36                                       
CONECT    5    3    6    6   37                                       
CONECT    6    5    5    1   17                                       
CONECT    7    9    8   38   39                                       
CONECT    8    4    7   12   40                                       
CONECT    9   32    7   41                                            
CONECT   10   26   27   27                                            
CONECT   11    1   14   14   42                                       
CONECT   12    8   20   43                                            
CONECT   13   17   17   14   44                                       
CONECT   14   11   11   13   45                                       
CONECT   15   32   32                                                 
CONECT   16    3    3    2                                            
CONECT   17    6   13   13   32                                       
CONECT   18   32   32                                                 
CONECT   19    4   20   46   47                                       
CONECT   20   12   19   21   48                                       
CONECT   21   20   31   31   22                                       
CONECT   22   21   23   23   49                                       
CONECT   23   22   22   24   50                                       
CONECT   24   30   30   23   25                                       
CONECT   25   24   26   26   29                                       
CONECT   26   25   25   10   51                                       
CONECT   27   10   10   28   52                                       
CONECT   28   29   29   27   53                                       
CONECT   29   25   28   28   54                                       
CONECT   30   31   24   24   55                                       
CONECT   31   21   21   30   56                                       
CONECT   32   18   18   17   15                                       
CONECT   32   15    9                                                 
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
