COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.429   1.207   0.406  1.00  0.00           C  
HETATM    2  C   UNL     1       6.153   0.672  -0.096  1.00  0.00           C  
HETATM    3  C   UNL     1       5.134   0.236   0.675  1.00  0.00           C  
HETATM    4  C   UNL     1       4.044  -0.218  -0.053  1.00  0.00           C  
HETATM    5  C   UNL     1       2.812  -0.742   0.588  1.00  0.00           C  
HETATM    6  C   UNL     1       2.713  -0.787   1.977  1.00  0.00           C  
HETATM    7  C   UNL     1       1.567  -1.275   2.573  1.00  0.00           C  
HETATM    8  C   UNL     1       0.515  -1.719   1.795  1.00  0.00           C  
HETATM    9  C   UNL     1       0.605  -1.677   0.409  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.730  -1.956   0.047  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.874  -2.543  -0.740  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.873  -1.959  -2.154  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.428  -0.909   0.014  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.664  -0.534   0.519  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.985   0.805   0.633  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.076   1.772   0.244  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.841   1.400  -0.261  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.516   0.060  -0.376  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.713  -4.063  -0.815  1.00  0.00           C  
HETATM   20  C   UNL     1       1.750  -1.184  -0.197  1.00  0.00           C  
HETATM   21  C   UNL     1       4.195  -0.145  -1.391  1.00  0.00           C  
HETATM   22  N   UNL     1       7.642   1.287   1.692  1.00  0.00           N  
HETATM   23  N   UNL     1       8.402   1.617  -0.482  1.00  0.00           N  
HETATM   24  N   UNL     1      -0.462  -2.129  -0.376  1.00  0.00           N  
HETATM   25  O   UNL     1      -4.108  -2.226  -0.094  1.00  0.00           O  
HETATM   26  O   UNL     1      -1.951  -1.328   1.061  1.00  0.00           O  
HETATM   27  S   UNL     1       5.719   0.509  -1.791  1.00  0.00           S  
HETATM   28 CL   UNL     1      -5.482   3.453   0.388  1.00  0.00          Cl  
HETATM   29 CL   UNL     1      -2.701   2.614  -0.749  1.00  0.00          Cl  
HETATM   30  H   UNL     1       5.164   0.241   1.755  1.00  0.00           H  
HETATM   31  H   UNL     1       3.533  -0.441   2.589  1.00  0.00           H  
HETATM   32  H   UNL     1       1.492  -1.309   3.650  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.379  -2.101   2.265  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.882  -2.073  -2.593  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.604  -2.487  -2.766  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.131  -0.901  -2.110  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.375  -1.288   0.822  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.948   1.097   1.027  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.553  -0.230  -0.769  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.798  -4.487   0.185  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.492  -4.479  -1.454  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.735  -4.305  -1.231  1.00  0.00           H  
HETATM   43  H   UNL     1       1.821  -1.146  -1.274  1.00  0.00           H  
HETATM   44  H   UNL     1       3.451  -0.453  -2.110  1.00  0.00           H  
HETATM   45  H   UNL     1       6.960   0.995   2.316  1.00  0.00           H  
HETATM   46  H   UNL     1       8.245   1.553  -1.437  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.289  -2.566  -1.224  1.00  0.00           H  
HETATM   48  H   UNL     1       9.243   1.970  -0.151  1.00  0.00           H  
CONECT    1   23    2   22   22                                       
CONECT    2   27    1    3    3                                       
CONECT    3    2    2    4   30                                       
CONECT    4   21   21    3    5                                       
CONECT    5    4    6    6   20                                       
CONECT    6    5    5    7   31                                       
CONECT    7    6    8    8   32                                       
CONECT    8    7    7    9   33                                       
CONECT    9   20   20    8   24                                       
CONECT   10   24   26   26   11                                       
CONECT   11   10   19   25   12                                       
CONECT   12   11   34   35   36                                       
CONECT   13   25   18   18   14                                       
CONECT   14   13   15   15   37                                       
CONECT   15   14   14   16   38                                       
CONECT   16   17   17   15   28                                       
CONECT   17   18   29   16   16                                       
CONECT   18   13   13   17   39                                       
CONECT   19   11   40   41   42                                       
CONECT   20    5    9    9   43                                       
CONECT   21   27    4    4   44                                       
CONECT   22    1    1   45                                            
CONECT   23    1   46   48                                            
CONECT   24    9   10   47                                            
CONECT   25   11   13                                                 
CONECT   26   10   10                                                 
CONECT   27   21    2                                                 
CONECT   28   16                                                      
CONECT   29   17                                                      
CONECT   30    3                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   23                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
