COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.241   0.314  -2.319  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.212   1.282  -2.142  1.00  0.00           C  
HETATM    3  C   UNL     1       2.839   0.322   1.432  1.00  0.00           C  
HETATM    4  C   UNL     1       3.506  -1.507   0.034  1.00  0.00           C  
HETATM    5  C   UNL     1       3.893   1.076   0.954  1.00  0.00           C  
HETATM    6  C   UNL     1       4.566  -0.759  -0.443  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.176   0.232  -1.443  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.123   2.171  -1.086  1.00  0.00           C  
HETATM    9  C   UNL     1       7.222   2.944  -0.799  1.00  0.00           C  
HETATM   10  C   UNL     1       6.750   0.916  -1.380  1.00  0.00           C  
HETATM   11  C   UNL     1       2.647  -0.969   0.974  1.00  0.00           C  
HETATM   12  C   UNL     1       4.760   0.537   0.014  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.082   1.122  -0.381  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.061   2.095  -0.205  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.742  -3.631  -0.081  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.549  -0.591   0.955  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.885  -5.723  -0.583  1.00  0.00           C  
HETATM   18  C   UNL     1       1.500  -1.791   1.502  1.00  0.00           C  
HETATM   19  C   UNL     1       0.082  -2.441  -0.500  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.763  -0.372   0.090  1.00  0.00           C  
HETATM   21  N   UNL     1       7.578   1.912  -1.565  1.00  0.00           N  
HETATM   22  N   UNL     1       6.159   2.617  -0.112  1.00  0.00           N  
HETATM   23  N   UNL     1       5.831   1.300  -0.473  1.00  0.00           N  
HETATM   24  N   UNL     1      -1.084  -4.566  -0.990  1.00  0.00           N  
HETATM   25  N   UNL     1       0.319  -1.579   0.661  1.00  0.00           N  
HETATM   26  O   UNL     1      -1.096  -3.748   1.073  1.00  0.00           O  
HETATM   27  O   UNL     1      -0.353   0.123   1.916  1.00  0.00           O  
HETATM   28  S   UNL     1      -2.727   1.020   0.740  1.00  0.00           S  
HETATM   29 CL   UNL     1      -4.949   3.211   1.120  1.00  0.00          Cl  
HETATM   30  H   UNL     1      -5.316  -0.381  -3.143  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.043   1.344  -2.829  1.00  0.00           H  
HETATM   32  H   UNL     1       2.166   0.740   2.166  1.00  0.00           H  
HETATM   33  H   UNL     1       3.354  -2.515  -0.322  1.00  0.00           H  
HETATM   34  H   UNL     1       4.042   2.085   1.311  1.00  0.00           H  
HETATM   35  H   UNL     1       5.237  -1.180  -1.177  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.418  -0.525  -1.583  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.883   2.926  -0.950  1.00  0.00           H  
HETATM   38  H   UNL     1       7.734   3.894  -0.750  1.00  0.00           H  
HETATM   39  H   UNL     1       6.796  -0.046  -1.868  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.062  -6.365  -1.447  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.350  -6.285   0.183  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.840  -5.382  -0.183  1.00  0.00           H  
HETATM   43  H   UNL     1       1.772  -2.846   1.487  1.00  0.00           H  
HETATM   44  H   UNL     1       1.276  -1.488   2.525  1.00  0.00           H  
HETATM   45  H   UNL     1       1.037  -2.782  -0.900  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.453  -1.880  -1.266  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.448  -0.151  -0.930  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.378  -1.272   0.093  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.801  -4.472  -1.913  1.00  0.00           H  
CONECT    1    2    2    7   30                                       
CONECT    2    1    1    8   31                                       
CONECT    3    5   11   11   32                                       
CONECT    4    6    6   11   33                                       
CONECT    5   12   12    3   34                                       
CONECT    6   12    4    4   35                                       
CONECT    7    1   13   13   36                                       
CONECT    8    2   14   14   37                                       
CONECT    9   21   22   22   38                                       
CONECT   10   21   21   23   39                                       
CONECT   11    3    3    4   18                                       
CONECT   12   23    5    5    6                                       
CONECT   13    7    7   14   28                                       
CONECT   14    8    8   13   29                                       
CONECT   15   24   26   26   19                                       
CONECT   16   25   20   27   27                                       
CONECT   17   24   40   41   42                                       
CONECT   18   11   25   43   44                                       
CONECT   19   15   25   45   46                                       
CONECT   20   16   28   47   48                                       
CONECT   21    9   10   10                                            
CONECT   22    9    9   23                                            
CONECT   23   22   10   12                                            
CONECT   24   17   15   49                                            
CONECT   25   19   18   16                                            
CONECT   26   15   15                                                 
CONECT   27   16   16                                                 
CONECT   28   20   13                                                 
CONECT   29   14                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   24                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
