COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1       1.724   1.051  -2.398  1.00  0.00          Cl  
HETATM    2  C   UNL     1       1.435   0.000  -1.046  1.00  0.00           C  
HETATM    3  C   UNL     1       2.506  -0.451  -0.268  1.00  0.00           C  
HETATM    4  C   UNL     1       3.882  -0.037  -0.593  1.00  0.00           C  
HETATM    5  C   UNL     1       4.908  -0.471   0.156  1.00  0.00           C  
HETATM    6  C   UNL     1       6.285  -0.057  -0.169  1.00  0.00           C  
HETATM    7  C   UNL     1       7.352  -0.507   0.607  1.00  0.00           C  
HETATM    8  C   UNL     1       8.650  -0.109   0.292  1.00  0.00           C  
HETATM    9  C   UNL     1       9.788  -0.582   1.108  1.00  0.00           C  
HETATM   10  O   UNL     1      11.042  -0.197   0.803  1.00  0.00           O  
HETATM   11  O   UNL     1       9.592  -1.317   2.055  1.00  0.00           O  
HETATM   12  C   UNL     1       8.874   0.736  -0.798  1.00  0.00           C  
HETATM   13  C   UNL     1       7.812   1.179  -1.562  1.00  0.00           C  
HETATM   14  C   UNL     1       6.524   0.785  -1.261  1.00  0.00           C  
HETATM   15  C   UNL     1       2.266  -1.296   0.819  1.00  0.00           C  
HETATM   16  C   UNL     1       0.978  -1.680   1.120  1.00  0.00           C  
HETATM   17  C   UNL     1       0.148  -0.386  -0.734  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.083  -1.230   0.344  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.352  -1.612   0.645  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.396  -1.113  -0.194  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.723  -1.639   0.289  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.350  -2.782  -0.077  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.855  -3.806  -1.066  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.703  -5.158  -0.368  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.860  -3.934  -2.213  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.599  -1.056   1.234  1.00  0.00           C  
HETATM   27  N   UNL     1      -5.617  -1.860   1.336  1.00  0.00           N  
HETATM   28  O   UNL     1      -5.497  -2.825   0.615  1.00  0.00           O  
HETATM   29  C   UNL     1      -4.394   0.240   1.975  1.00  0.00           C  
HETATM   30  S   UNL     1      -5.104   1.602   1.018  1.00  0.00           S  
HETATM   31  O   UNL     1      -5.754   2.851   0.140  1.00  0.00           O  
HETATM   32  C   UNL     1      -3.484   1.926   0.278  1.00  0.00           C  
HETATM   33  C   UNL     1      -3.334   1.902  -1.097  1.00  0.00           C  
HETATM   34 CL   UNL     1      -4.699   1.562  -2.113  1.00  0.00          Cl  
HETATM   35  C   UNL     1      -2.095   2.150  -1.661  1.00  0.00           C  
HETATM   36  C   UNL     1      -1.008   2.421  -0.852  1.00  0.00           C  
HETATM   37  C   UNL     1      -1.157   2.445   0.522  1.00  0.00           C  
HETATM   38  C   UNL     1      -2.397   2.202   1.088  1.00  0.00           C  
HETATM   39 CL   UNL     1      -2.584   2.232   2.813  1.00  0.00          Cl  
HETATM   40  H   UNL     1       4.065   0.617  -1.433  1.00  0.00           H  
HETATM   41  H   UNL     1       4.725  -1.124   0.996  1.00  0.00           H  
HETATM   42  H   UNL     1       7.174  -1.160   1.448  1.00  0.00           H  
HETATM   43  H   UNL     1      11.753  -0.531   1.365  1.00  0.00           H  
HETATM   44  H   UNL     1       9.880   1.044  -1.043  1.00  0.00           H  
HETATM   45  H   UNL     1       7.991   1.832  -2.403  1.00  0.00           H  
HETATM   46  H   UNL     1       5.699   1.135  -1.863  1.00  0.00           H  
HETATM   47  H   UNL     1       3.090  -1.647   1.423  1.00  0.00           H  
HETATM   48  H   UNL     1       0.792  -2.334   1.959  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.681  -0.035  -1.332  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.402  -0.023  -0.157  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.227  -1.440  -1.219  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.890  -3.491  -1.463  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.668  -5.473   0.029  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.345  -5.898  -1.084  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.987  -5.067   0.449  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.969  -2.970  -2.710  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.502  -4.674  -2.929  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.825  -4.249  -1.816  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.886   0.184   2.947  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.328   0.412   2.118  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.112   3.325  -0.406  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.978   2.131  -2.735  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.041   2.615  -1.293  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.307   2.656   1.154  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.995   0.702   0.398  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3   17                                       
CONECT    3    2    2    4   15                                       
CONECT    4    3    5    5   40                                       
CONECT    5    4    4    6   41                                       
CONECT    6    5    7    7   14                                       
CONECT    7    6    6    8   42                                       
CONECT    8    7    9   12   12                                       
CONECT    9    8   11   11   10                                       
CONECT   10    9   43                                                 
CONECT   11    9    9                                                 
CONECT   12    8    8   13   44                                       
CONECT   13   12   14   14   45                                       
CONECT   14    6   13   13   46                                       
CONECT   15    3   16   16   47                                       
CONECT   16   15   15   18   48                                       
CONECT   17    2   18   18   49                                       
CONECT   18   16   17   17   19                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   50   51                                       
CONECT   21   20   22   22   26                                       
CONECT   22   21   21   23   28                                       
CONECT   23   22   25   24   52                                       
CONECT   24   23   53   54   55                                       
CONECT   25   23   56   57   58                                       
CONECT   26   21   29   27   27                                       
CONECT   27   26   26   28                                            
CONECT   28   22   27                                                 
CONECT   29   26   30   59   60                                       
CONECT   30   29   32   31   65                                       
CONECT   31   30   61                                                 
CONECT   32   30   33   33   38                                       
CONECT   33   32   32   35   34                                       
CONECT   34   33                                                      
CONECT   35   33   36   36   62                                       
CONECT   36   35   35   37   63                                       
CONECT   37   36   38   38   64                                       
CONECT   38   32   37   37   39                                       
CONECT   39   38                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    7                                                      
CONECT   43   10                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
CONECT   61   31                                                      
CONECT   62   35                                                      
CONECT   63   36                                                      
CONECT   64   37                                                      
CONECT   65   30                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
