COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.652  -0.822  -1.001  1.00  0.00           C  
HETATM    2  C   UNL     1       4.920   1.323  -0.265  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.669  -0.567   0.224  1.00  0.00           C  
HETATM    4  C   UNL     1       8.007   0.263  -0.158  1.00  0.00           C  
HETATM    5  C   UNL     1       7.712  -0.573   0.902  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.462   0.564   0.185  1.00  0.00           C  
HETATM    7  C   UNL     1      -8.840   1.185   1.362  1.00  0.00           C  
HETATM    8  C   UNL     1       8.144  -1.887   0.888  1.00  0.00           C  
HETATM    9  C   UNL     1       8.734  -0.214  -1.233  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.257  -1.081   1.440  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.635  -0.461   2.616  1.00  0.00           C  
HETATM   12  C   UNL     1       9.166  -1.527  -1.248  1.00  0.00           C  
HETATM   13  C   UNL     1       2.579   0.652  -0.204  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.284  -0.438  -0.577  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.424   0.673   2.578  1.00  0.00           C  
HETATM   16  C   UNL     1       8.872  -2.364  -0.188  1.00  0.00           C  
HETATM   17  C   UNL     1       1.321   0.829  -1.057  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.111   0.284  -1.243  1.00  0.00           C  
HETATM   19  C   UNL     1       0.147   0.107  -0.391  1.00  0.00           C  
HETATM   20  N   UNL     1      -3.488  -0.269  -1.394  1.00  0.00           N  
HETATM   21  N   UNL     1       3.702   1.343  -0.841  1.00  0.00           N  
HETATM   22  N   UNL     1       5.954   1.959  -0.852  1.00  0.00           N  
HETATM   23  N   UNL     1      -5.759  -0.671  -1.755  1.00  0.00           N  
HETATM   24  O   UNL     1       7.254   2.280   1.221  1.00  0.00           O  
HETATM   25  O   UNL     1       8.316   2.653  -1.011  1.00  0.00           O  
HETATM   26  O   UNL     1      -6.893  -2.707  -0.940  1.00  0.00           O  
HETATM   27  O   UNL     1      -4.703  -1.462   0.032  1.00  0.00           O  
HETATM   28  O   UNL     1       5.087   0.732   0.784  1.00  0.00           O  
HETATM   29  O   UNL     1      -8.156  -0.993  -2.250  1.00  0.00           O  
HETATM   30  S   UNL     1      -7.188  -1.357  -1.275  1.00  0.00           S  
HETATM   31  S   UNL     1       7.450   1.934  -0.144  1.00  0.00           S  
HETATM   32 CL   UNL     1      -9.836   2.606   1.314  1.00  0.00          Cl  
HETATM   33 CL   UNL     1       7.774  -2.938   2.220  1.00  0.00          Cl  
HETATM   34  H   UNL     1       7.144  -0.200   1.742  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.787   0.964  -0.764  1.00  0.00           H  
HETATM   36  H   UNL     1       8.964   0.439  -2.062  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.641  -1.967   1.470  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.313  -0.863   3.566  1.00  0.00           H  
HETATM   39  H   UNL     1       9.734  -1.899  -2.088  1.00  0.00           H  
HETATM   40  H   UNL     1       2.408   1.073   0.787  1.00  0.00           H  
HETATM   41  H   UNL     1       2.809  -0.410  -0.112  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.053  -1.499  -0.486  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.454  -0.017   0.413  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.718   1.158   3.498  1.00  0.00           H  
HETATM   45  H   UNL     1       9.210  -3.390  -0.199  1.00  0.00           H  
HETATM   46  H   UNL     1       1.090   1.890  -1.148  1.00  0.00           H  
HETATM   47  H   UNL     1       1.491   0.407  -2.047  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.940  -0.138  -2.234  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.342   1.345  -1.335  1.00  0.00           H  
HETATM   50  H   UNL     1       0.378  -0.954  -0.299  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.023   0.528   0.600  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.448   0.242  -2.218  1.00  0.00           H  
HETATM   53  H   UNL     1       3.569   1.815  -1.679  1.00  0.00           H  
HETATM   54  H   UNL     1       5.821   2.431  -1.689  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.719  -0.161  -2.579  1.00  0.00           H  
CONECT    1   23   27   27   20                                       
CONECT    2   21   28   28   22                                       
CONECT    3   10   30    6    6                                       
CONECT    4   31    9    9    5                                       
CONECT    5    4    8    8   34                                       
CONECT    6    3    3    7   35                                       
CONECT    7   15   15    6   32                                       
CONECT    8    5    5   16   33                                       
CONECT    9    4    4   12   36                                       
CONECT   10   11   11    3   37                                       
CONECT   11   10   10   15   38                                       
CONECT   12    9   16   16   39                                       
CONECT   13   17   21   40   41                                       
CONECT   14   20   18   42   43                                       
CONECT   15   11    7    7   44                                       
CONECT   16   12   12    8   45                                       
CONECT   17   13   19   46   47                                       
CONECT   18   14   19   48   49                                       
CONECT   19   17   18   50   51                                       
CONECT   20    1   14   52                                            
CONECT   21   13    2   53                                            
CONECT   22    2   31   54                                            
CONECT   23   30    1   55                                            
CONECT   24   31   31                                                 
CONECT   25   31   31                                                 
CONECT   26   30   30                                                 
CONECT   27    1    1                                                 
CONECT   28    2    2                                                 
CONECT   29   30   30                                                 
CONECT   30   26   26    3   29                                       
CONECT   30   29   23                                                 
CONECT   31   22    4   24   24                                       
CONECT   31   25   25                                                 
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
