COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.722   1.232  -0.700  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.677   2.029  -0.094  1.00  0.00           C  
HETATM    3 CL   UNL     1      -2.314   3.683   0.287  1.00  0.00          Cl  
HETATM    4  C   UNL     1      -3.922   1.507   0.207  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.211   0.189  -0.098  1.00  0.00           C  
HETATM    6 CL   UNL     1      -5.774  -0.467   0.279  1.00  0.00          Cl  
HETATM    7  C   UNL     1      -3.255  -0.607  -0.703  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.011  -0.085  -1.003  1.00  0.00           C  
HETATM    9  S   UNL     1      -0.795  -1.097  -1.780  1.00  0.00           S  
HETATM   10  O   UNL     1       0.136  -0.149  -2.283  1.00  0.00           O  
HETATM   11  N   UNL     1       0.009  -1.765  -0.495  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.383  -1.443   0.873  1.00  0.00           C  
HETATM   13  C   UNL     1       0.535  -0.352   1.381  1.00  0.00           C  
HETATM   14  O   UNL     1       0.072   0.742   1.651  1.00  0.00           O  
HETATM   15  C   UNL     1      -0.228  -2.650   1.791  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.108  -3.977   1.090  1.00  0.00           C  
HETATM   17  C   UNL     1       0.795  -4.043  -0.127  1.00  0.00           C  
HETATM   18  C   UNL     1       1.115  -2.685  -0.719  1.00  0.00           C  
HETATM   19  C   UNL     1       2.457  -2.125  -0.288  1.00  0.00           C  
HETATM   20  C   UNL     1       2.772  -0.885  -1.086  1.00  0.00           C  
HETATM   21  C   UNL     1       3.848  -0.841  -1.832  1.00  0.00           C  
HETATM   22  C   UNL     1       2.513  -1.824   1.203  1.00  0.00           C  
HETATM   23  N   UNL     1       1.845  -0.572   1.544  1.00  0.00           N  
HETATM   24  C   UNL     1       2.652   0.518   2.125  1.00  0.00           C  
HETATM   25  C   UNL     1       3.194   1.387   1.019  1.00  0.00           C  
HETATM   26  N   UNL     1       4.315   1.046   0.413  1.00  0.00           N  
HETATM   27  C   UNL     1       4.826   1.775  -0.560  1.00  0.00           C  
HETATM   28  C   UNL     1       4.198   2.932  -0.981  1.00  0.00           C  
HETATM   29  C   UNL     1       3.018   3.322  -0.367  1.00  0.00           C  
HETATM   30  C   UNL     1       2.508   2.527   0.649  1.00  0.00           C  
HETATM   31  H   UNL     1      -0.751   1.641  -0.939  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.669   2.128   0.679  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.480  -1.636  -0.940  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.419  -1.085   0.891  1.00  0.00           H  
HETATM   35  H   UNL     1       0.607  -2.497   2.476  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.128  -2.690   2.438  1.00  0.00           H  
HETATM   37  H   UNL     1       0.244  -4.727   1.816  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.115  -4.304   0.784  1.00  0.00           H  
HETATM   39  H   UNL     1       1.732  -4.537   0.152  1.00  0.00           H  
HETATM   40  H   UNL     1       0.312  -4.658  -0.894  1.00  0.00           H  
HETATM   41  H   UNL     1       1.174  -2.830  -1.813  1.00  0.00           H  
HETATM   42  H   UNL     1       3.233  -2.874  -0.517  1.00  0.00           H  
HETATM   43  H   UNL     1       2.111  -0.032  -1.041  1.00  0.00           H  
HETATM   44  H   UNL     1       4.073   0.047  -2.404  1.00  0.00           H  
HETATM   45  H   UNL     1       4.509  -1.694  -1.877  1.00  0.00           H  
HETATM   46  H   UNL     1       2.103  -2.658   1.768  1.00  0.00           H  
HETATM   47  H   UNL     1       3.573  -1.736   1.497  1.00  0.00           H  
HETATM   48  H   UNL     1       2.029   1.119   2.787  1.00  0.00           H  
HETATM   49  H   UNL     1       3.481   0.094   2.693  1.00  0.00           H  
HETATM   50  H   UNL     1       5.746   1.464  -1.033  1.00  0.00           H  
HETATM   51  H   UNL     1       4.624   3.527  -1.776  1.00  0.00           H  
HETATM   52  H   UNL     1       2.506   4.222  -0.675  1.00  0.00           H  
HETATM   53  H   UNL     1       1.591   2.801   1.149  1.00  0.00           H  
CONECT    1    2    8    8   31                                       
CONECT    2    3    4    4    1                                       
CONECT    3    2                                                      
CONECT    4    2    2    5   32                                       
CONECT    5    4    6    7    7                                       
CONECT    6    5                                                      
CONECT    7    5    5    8   33                                       
CONECT    8    1    1    7    9                                       
CONECT    9    8   11   10   10                                       
CONECT   10    9    9                                                 
CONECT   11    9   18   12                                            
CONECT   12   13   11   15   34                                       
CONECT   13   23   14   14   12                                       
CONECT   14   13   13                                                 
CONECT   15   12   16   35   36                                       
CONECT   16   17   15   37   38                                       
CONECT   17   18   16   39   40                                       
CONECT   18   19   11   17   41                                       
CONECT   19   22   20   18   42                                       
CONECT   20   21   21   19   43                                       
CONECT   21   20   20   44   45                                       
CONECT   22   23   19   46   47                                       
CONECT   23   24   22   13                                            
CONECT   24   25   23   48   49                                       
CONECT   25   30   30   26   24                                       
CONECT   26   27   27   25                                            
CONECT   27   28   26   26   50                                       
CONECT   28   29   29   27   51                                       
CONECT   29   28   28   30   52                                       
CONECT   30   29   25   25   53                                       
CONECT   31    1                                                      
CONECT   32    4                                                      
CONECT   33    7                                                      
CONECT   34   12                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
