COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.244  -3.330   1.321  1.00  0.00           C  
HETATM    2  C   UNL     1       6.543  -1.440  -0.631  1.00  0.00           C  
HETATM    3  C   UNL     1       6.587  -0.234   0.041  1.00  0.00           C  
HETATM    4  C   UNL     1       8.044  -2.390   0.977  1.00  0.00           C  
HETATM    5  C   UNL     1       8.088  -1.183   1.648  1.00  0.00           C  
HETATM    6  C   UNL     1       3.555   2.050  -0.442  1.00  0.00           C  
HETATM    7  C   UNL     1       2.148   1.963   0.093  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.207   2.823   0.051  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.848   1.537  -0.475  1.00  0.00           C  
HETATM   10  C   UNL     1       0.324   5.012  -0.836  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.872   4.049  -0.610  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.304   1.363   1.159  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.180  -0.793  -0.177  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.501  -0.836   0.218  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.497  -0.552  -0.910  1.00  0.00           O  
HETATM   16  C   UNL     1      -2.993   0.391  -0.324  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.409   0.338   0.097  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.062   0.240   0.885  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.981   1.419   0.770  1.00  0.00           C  
HETATM   20  S   UNL     1      -7.476  -2.262  -0.127  1.00  0.00           S  
HETATM   21  O   UNL     1      -6.864  -2.836  -1.273  1.00  0.00           O  
HETATM   22  O   UNL     1      -8.809  -1.772  -0.176  1.00  0.00           O  
HETATM   23  N   UNL     1      -2.251   1.484  -0.058  1.00  0.00           N  
HETATM   24  C   UNL     1       1.464   4.020  -1.175  1.00  0.00           C  
HETATM   25  N   UNL     1       1.219   2.853  -0.307  1.00  0.00           N  
HETATM   26  O   UNL     1       1.853   1.092   0.884  1.00  0.00           O  
HETATM   27  C   UNL     1       4.402   0.931   0.168  1.00  0.00           C  
HETATM   28  N   UNL     1       4.523   1.142   1.616  1.00  0.00           N  
HETATM   29  C   UNL     1       5.794   0.942  -0.468  1.00  0.00           C  
HETATM   30  C   UNL     1       7.359  -0.105   1.181  1.00  0.00           C  
HETATM   31  C   UNL     1       7.272  -2.520  -0.164  1.00  0.00           C  
HETATM   32 CL   UNL     1       7.216  -4.036  -1.007  1.00  0.00          Cl  
HETATM   33  H   UNL     1      -7.587  -2.809   2.215  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.819  -4.247   1.192  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.188  -3.575   1.426  1.00  0.00           H  
HETATM   36  H   UNL     1       5.937  -1.542  -1.519  1.00  0.00           H  
HETATM   37  H   UNL     1       8.613  -3.232   1.342  1.00  0.00           H  
HETATM   38  H   UNL     1       8.691  -1.082   2.539  1.00  0.00           H  
HETATM   39  H   UNL     1       3.538   1.944  -1.526  1.00  0.00           H  
HETATM   40  H   UNL     1       3.984   3.016  -0.177  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.321   2.878   1.133  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.791   1.521  -1.564  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.316   0.675  -0.072  1.00  0.00           H  
HETATM   44  H   UNL     1       0.130   5.685  -1.671  1.00  0.00           H  
HETATM   45  H   UNL     1       0.550   5.573   0.071  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.330   3.773  -1.560  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.607   4.496   0.058  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.749   2.201   1.676  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.743  -1.633  -0.696  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.097   0.201   1.192  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.390   2.297   0.984  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.646   2.237   0.410  1.00  0.00           H  
HETATM   53  H   UNL     1       1.414   3.729  -2.224  1.00  0.00           H  
HETATM   54  H   UNL     1       2.433   4.464  -0.949  1.00  0.00           H  
HETATM   55  H   UNL     1       3.924  -0.030  -0.021  1.00  0.00           H  
HETATM   56  H   UNL     1       5.024   0.382   2.052  1.00  0.00           H  
HETATM   57  H   UNL     1       4.964   2.027   1.817  1.00  0.00           H  
HETATM   58  H   UNL     1       6.306   1.868  -0.205  1.00  0.00           H  
HETATM   59  H   UNL     1       5.699   0.875  -1.552  1.00  0.00           H  
HETATM   60  H   UNL     1       7.394   0.838   1.706  1.00  0.00           H  
CONECT    1   20   33   34   35                                       
CONECT    2    3    3   31   36                                       
CONECT    3    2    2   29   30                                       
CONECT    4    5   31   31   37                                       
CONECT    5    4   30   30   38                                       
CONECT    6    7   27   39   40                                       
CONECT    7    6   25   26   26                                       
CONECT    8    9   11   25   41                                       
CONECT    9    8   23   42   43                                       
CONECT   10   11   24   44   45                                       
CONECT   11    8   10   46   47                                       
CONECT   12   18   18   19   48                                       
CONECT   13   14   14   17   49                                       
CONECT   14   13   13   18   20                                       
CONECT   15   16   16                                                 
CONECT   16   15   15   17   23                                       
CONECT   17   13   16   19   19                                       
CONECT   18   12   12   14   50                                       
CONECT   19   12   17   17   51                                       
CONECT   20    1   14   21   21                                       
CONECT   20   22   22                                                 
CONECT   21   20   20                                                 
CONECT   22   20   20                                                 
CONECT   23    9   16   52                                            
CONECT   24   10   25   53   54                                       
CONECT   25    7    8   24                                            
CONECT   26    7    7                                                 
CONECT   27    6   28   29   55                                       
CONECT   28   27   56   57                                            
CONECT   29    3   27   58   59                                       
CONECT   30    3    5    5   60                                       
CONECT   31    2    4    4   32                                       
CONECT   32   31                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
CONECT   55   27                                                      
CONECT   56   28                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
