COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.306  -1.572  -1.039  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.033  -2.411  -0.221  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.217  -1.956   0.365  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.000  -2.849   1.243  1.00  0.00           C  
HETATM    5  O   UNL     1      -5.616  -3.981   1.457  1.00  0.00           O  
HETATM    6  O   UNL     1      -7.141  -2.407   1.807  1.00  0.00           O  
HETATM    7  C   UNL     1      -5.655  -0.654   0.117  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.918   0.174  -0.704  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.744  -0.281  -1.276  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.944   0.630  -2.172  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.975   1.378  -1.368  1.00  0.00           N  
HETATM   12  C   UNL     1      -2.221   2.570  -0.794  1.00  0.00           C  
HETATM   13  O   UNL     1      -3.266   3.186  -0.858  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.724   0.961  -1.101  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.227  -0.079  -1.484  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.057   1.977  -0.268  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.007   3.002  -0.070  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.676   4.112   0.686  1.00  0.00           C  
HETATM   19  C   UNL     1       0.590   4.216   1.246  1.00  0.00           C  
HETATM   20  C   UNL     1       1.526   3.222   1.056  1.00  0.00           C  
HETATM   21  C   UNL     1       1.210   2.091   0.301  1.00  0.00           C  
HETATM   22  N   UNL     1       2.153   1.086   0.117  1.00  0.00           N  
HETATM   23  C   UNL     1       3.145   0.921   1.014  1.00  0.00           C  
HETATM   24  O   UNL     1       3.159   1.583   2.035  1.00  0.00           O  
HETATM   25  C   UNL     1       4.206  -0.055   0.760  1.00  0.00           C  
HETATM   26  C   UNL     1       5.262  -0.313   1.589  1.00  0.00           C  
HETATM   27  C   UNL     1       6.111  -1.279   1.106  1.00  0.00           C  
HETATM   28  C   UNL     1       5.764  -1.797  -0.081  1.00  0.00           C  
HETATM   29 CL   UNL     1       6.658  -3.030  -0.915  1.00  0.00          Cl  
HETATM   30  S   UNL     1       4.323  -1.089  -0.658  1.00  0.00           S  
HETATM   31  H   UNL     1      -2.391  -1.922  -1.493  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.689  -3.417  -0.033  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.620  -3.027   2.374  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.570  -0.296   0.567  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.257   1.182  -0.896  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.416   0.034  -2.917  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.615   1.327  -2.674  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.402   4.897   0.841  1.00  0.00           H  
HETATM   39  H   UNL     1       0.845   5.085   1.836  1.00  0.00           H  
HETATM   40  H   UNL     1       2.507   3.316   1.497  1.00  0.00           H  
HETATM   41  H   UNL     1       2.096   0.504  -0.657  1.00  0.00           H  
HETATM   42  H   UNL     1       5.414   0.193   2.532  1.00  0.00           H  
HETATM   43  H   UNL     1       6.993  -1.597   1.642  1.00  0.00           H  
CONECT    1    9    2    2   31                                       
CONECT    2    1    1    3   32                                       
CONECT    3    7    7    2    4                                       
CONECT    4    3    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4   33                                                 
CONECT    7    8    3    3   34                                       
CONECT    8    9    9    7   35                                       
CONECT    9   10    8    8    1                                       
CONECT   10   11    9   36   37                                       
CONECT   11   12   10   14                                            
CONECT   12   13   13   17   11                                       
CONECT   13   12   12                                                 
CONECT   14   11   16   15   15                                       
CONECT   15   14   14                                                 
CONECT   16   17   14   21   21                                       
CONECT   17   18   18   12   16                                       
CONECT   18   17   17   19   38                                       
CONECT   19   18   20   20   39                                       
CONECT   20   19   19   21   40                                       
CONECT   21   16   16   20   22                                       
CONECT   22   21   23   41                                            
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   26   30                                       
CONECT   26   25   25   27   42                                       
CONECT   27   26   28   28   43                                       
CONECT   28   30   27   27   29                                       
CONECT   29   28                                                      
CONECT   30   25   28                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   22                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
