COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.054   1.602   0.829  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.808   2.505  -0.566  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.600   0.221   0.719  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.109   0.394   0.531  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.157   3.266  -1.846  1.00  0.00           C  
HETATM    6  C   UNL     1       2.249   0.501   0.317  1.00  0.00           C  
HETATM    7  C   UNL     1       6.002   0.329   0.733  1.00  0.00           C  
HETATM    8  C   UNL     1       5.725  -1.837  -0.981  1.00  0.00           C  
HETATM    9  C   UNL     1       6.979  -1.471  -0.515  1.00  0.00           C  
HETATM   10  C   UNL     1       7.116  -0.389   0.341  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.303  -0.250   0.199  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.375   0.763   0.354  1.00  0.00           C  
HETATM   13  C   UNL     1       3.542   0.734   0.686  1.00  0.00           C  
HETATM   14  C   UNL     1       4.741  -0.035   0.267  1.00  0.00           C  
HETATM   15  C   UNL     1       4.607  -1.123  -0.592  1.00  0.00           C  
HETATM   16 CL   UNL     1      -8.055  -2.834  -0.098  1.00  0.00          Cl  
HETATM   17  C   UNL     1      -6.885  -1.566   0.089  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.538  -1.869   0.128  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.602  -0.852   0.278  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.027   0.466   0.399  1.00  0.00           C  
HETATM   21  S   UNL     1      -2.883  -1.234   0.329  1.00  0.00           S  
HETATM   22  O   UNL     1      -2.356   1.186  -0.632  1.00  0.00           O  
HETATM   23  O   UNL     1      -3.573   3.448  -1.922  1.00  0.00           O  
HETATM   24  C   UNL     1      -0.287   2.418  -0.422  1.00  0.00           C  
HETATM   25  O   UNL     1       0.266   1.778  -1.574  1.00  0.00           O  
HETATM   26  O   UNL     1      -0.347  -0.522   1.913  1.00  0.00           O  
HETATM   27  N   UNL     1       1.508   1.450   0.933  1.00  0.00           N  
HETATM   28  N   UNL     1       3.512   1.801   1.505  1.00  0.00           N  
HETATM   29  N   UNL     1       2.294   2.195   1.627  1.00  0.00           N  
HETATM   30  F   UNL     1       8.339  -0.035   0.793  1.00  0.00           F  
HETATM   31  F   UNL     1       8.070  -2.171  -0.896  1.00  0.00           F  
HETATM   32  F   UNL     1       5.597  -2.891  -1.815  1.00  0.00           F  
HETATM   33  H   UNL     1      -0.323   2.115   1.714  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.225   3.029   0.294  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.184  -0.311  -0.137  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.530   0.890   1.406  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.666   4.240  -1.835  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.817   2.697  -2.711  1.00  0.00           H  
HETATM   39  H   UNL     1       1.890  -0.279  -0.338  1.00  0.00           H  
HETATM   40  H   UNL     1       6.108   1.169   1.404  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.357  -0.015   0.167  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.704   1.788   0.439  1.00  0.00           H  
HETATM   43  H   UNL     1       3.631  -1.408  -0.956  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.212  -2.895   0.043  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.303   1.258   0.520  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.866   3.925  -2.710  1.00  0.00           H  
HETATM   47  H   UNL     1       0.128   3.421  -0.328  1.00  0.00           H  
HETATM   48  H   UNL     1       0.088   2.240  -2.405  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.733  -1.409   1.913  1.00  0.00           H  
CONECT    1    3   27   24   33                                       
CONECT    2   22   24    5   34                                       
CONECT    3   26    4    1   35                                       
CONECT    4   21    3   22   36                                       
CONECT    5    2   23   37   38                                       
CONECT    6   27   13   13   39                                       
CONECT    7   14   14   10   40                                       
CONECT    8   15   15    9   32                                       
CONECT    9   10   10    8   31                                       
CONECT   10    7   30    9    9                                       
CONECT   11   12   12   17   41                                       
CONECT   12   11   11   20   42                                       
CONECT   13   28    6    6   14                                       
CONECT   14   13    7    7   15                                       
CONECT   15   14    8    8   43                                       
CONECT   16   17                                                      
CONECT   17   11   16   18   18                                       
CONECT   18   17   17   19   44                                       
CONECT   19   20   20   18   21                                       
CONECT   20   12   19   19   45                                       
CONECT   21   19    4                                                 
CONECT   22    4    2                                                 
CONECT   23    5   46                                                 
CONECT   24    1    2   25   47                                       
CONECT   25   24   48                                                 
CONECT   26    3   49                                                 
CONECT   27   29    1    6                                            
CONECT   28   29   29   13                                            
CONECT   29   28   28   27                                            
CONECT   30   10                                                      
CONECT   31    9                                                      
CONECT   32    8                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   15                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
