COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.311   1.382  -1.558  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.599   1.292  -2.049  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.232  -3.009  -0.513  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.521  -0.827  -0.624  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.812  -0.910  -1.126  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.348   0.149  -1.834  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.764   0.324  -0.846  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.905   1.616  -0.115  1.00  0.00           C  
HETATM    9  C   UNL     1       0.282   0.556   0.431  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.488   1.712   0.292  1.00  0.00           C  
HETATM   11  C   UNL     1       1.605   0.653   0.811  1.00  0.00           C  
HETATM   12  C   UNL     1       0.089   2.961   0.539  1.00  0.00           C  
HETATM   13  C   UNL     1       1.414   3.043   0.918  1.00  0.00           C  
HETATM   14  C   UNL     1       2.171   1.893   1.048  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.067  -2.043   1.427  1.00  0.00           C  
HETATM   16  C   UNL     1       3.025  -3.244  -1.497  1.00  0.00           C  
HETATM   17  C   UNL     1       2.667  -1.757  -1.536  1.00  0.00           C  
HETATM   18  C   UNL     1       4.665  -0.612  -0.619  1.00  0.00           C  
HETATM   19  C   UNL     1       5.501  -1.241  -1.533  1.00  0.00           C  
HETATM   20  C   UNL     1       6.797  -0.795  -1.703  1.00  0.00           C  
HETATM   21  C   UNL     1       7.263   0.276  -0.964  1.00  0.00           C  
HETATM   22  C   UNL     1       6.434   0.905  -0.052  1.00  0.00           C  
HETATM   23  C   UNL     1       5.135   0.467   0.118  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.474  -3.682   0.652  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.358  -3.306   1.863  1.00  0.00           C  
HETATM   26  N   UNL     1       3.354  -1.061  -0.445  1.00  0.00           N  
HETATM   27  N   UNL     1      -2.457   0.410  -0.352  1.00  0.00           N  
HETATM   28  N   UNL     1      -3.976  -1.899   0.094  1.00  0.00           N  
HETATM   29  O   UNL     1       3.584  -0.499   1.947  1.00  0.00           O  
HETATM   30  O   UNL     1       1.659  -1.880   1.151  1.00  0.00           O  
HETATM   31  O   UNL     1      -2.573   2.625  -0.235  1.00  0.00           O  
HETATM   32  O   UNL     1      -4.635  -1.273   2.172  1.00  0.00           O  
HETATM   33  S   UNL     1       2.575  -0.806   0.994  1.00  0.00           S  
HETATM   34 CL   UNL     1      -0.859   4.406   0.368  1.00  0.00          Cl  
HETATM   35  H   UNL     1      -3.727   2.274  -1.732  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.023   2.116  -2.603  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.527  -2.631  -1.254  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.921  -3.717  -0.974  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.397  -1.803  -0.963  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.354   0.084  -2.219  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.158  -0.412   0.246  1.00  0.00           H  
HETATM   42  H   UNL     1       1.861   4.008   1.109  1.00  0.00           H  
HETATM   43  H   UNL     1       3.207   1.963   1.345  1.00  0.00           H  
HETATM   44  H   UNL     1       4.103  -3.362  -1.613  1.00  0.00           H  
HETATM   45  H   UNL     1       2.714  -3.668  -0.543  1.00  0.00           H  
HETATM   46  H   UNL     1       2.514  -3.762  -2.309  1.00  0.00           H  
HETATM   47  H   UNL     1       2.979  -1.333  -2.491  1.00  0.00           H  
HETATM   48  H   UNL     1       1.590  -1.640  -1.420  1.00  0.00           H  
HETATM   49  H   UNL     1       5.137  -2.078  -2.111  1.00  0.00           H  
HETATM   50  H   UNL     1       7.447  -1.284  -2.413  1.00  0.00           H  
HETATM   51  H   UNL     1       8.277   0.623  -1.098  1.00  0.00           H  
HETATM   52  H   UNL     1       6.801   1.741   0.524  1.00  0.00           H  
HETATM   53  H   UNL     1       4.488   0.959   0.830  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.434  -4.764   0.518  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.471  -3.267   0.757  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.741  -3.114   2.741  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.079  -4.097   2.069  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.949  -0.398  -0.182  1.00  0.00           H  
CONECT    1    2    2    7   35                                       
CONECT    2    6    1    1   36                                       
CONECT    3   28   24   37   38                                       
CONECT    4    5   28    7    7                                       
CONECT    5    6    6    4   39                                       
CONECT    6    5    5    2   40                                       
CONECT    7    4    4    1   27                                       
CONECT    8   27   31   31   10                                       
CONECT    9   10   10   11   41                                       
CONECT   10    8    9    9   12                                       
CONECT   11    9   33   14   14                                       
CONECT   12   10   34   13   13                                       
CONECT   13   12   12   14   42                                       
CONECT   14   11   11   13   43                                       
CONECT   15   28   25   32   32                                       
CONECT   16   17   44   45   46                                       
CONECT   17   26   16   47   48                                       
CONECT   18   19   19   23   26                                       
CONECT   19   20   18   18   49                                       
CONECT   20   21   21   19   50                                       
CONECT   21   20   20   22   51                                       
CONECT   22   21   23   23   52                                       
CONECT   23   22   22   18   53                                       
CONECT   24    3   25   54   55                                       
CONECT   25   24   15   56   57                                       
CONECT   26   18   33   17                                            
CONECT   27    7    8   58                                            
CONECT   28    3    4   15                                            
CONECT   29   33   33                                                 
CONECT   30   33   33                                                 
CONECT   31    8    8                                                 
CONECT   32   15   15                                                 
CONECT   33   30   30   11   26                                       
CONECT   33   29   29                                                 
CONECT   34   12                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    9                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   27                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
