COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.783  -0.839   0.645  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.495  -4.259   0.790  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.419  -4.156  -0.247  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.582   1.836   0.502  1.00  0.00           C  
HETATM    5  C   UNL     1       0.687  -0.535   1.699  1.00  0.00           C  
HETATM    6  C   UNL     1       1.666  -0.386   2.675  1.00  0.00           C  
HETATM    7  C   UNL     1       2.997  -0.484   2.338  1.00  0.00           C  
HETATM    8  C   UNL     1       3.364  -0.734   1.010  1.00  0.00           C  
HETATM    9  C   UNL     1       2.374  -0.884   0.032  1.00  0.00           C  
HETATM   10  C   UNL     1       1.046  -0.789   0.380  1.00  0.00           C  
HETATM   11  C   UNL     1       5.135  -1.076  -0.638  1.00  0.00           C  
HETATM   12  C   UNL     1       6.504  -1.177  -0.991  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.114   2.567  -0.592  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.715   3.876  -0.424  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.778   4.467   0.828  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.241   3.747   1.918  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.647   2.439   1.761  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.045   1.925  -1.954  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.694  -2.926  -0.809  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.046  -1.779  -0.341  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.118  -1.882   0.701  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.860  -3.152   1.262  1.00  0.00           C  
HETATM   23  S   UNL     1      -3.189  -0.102  -0.853  1.00  0.00           S  
HETATM   24  C   UNL     1      -2.010   0.434   0.329  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.550  -0.590   1.052  1.00  0.00           C  
HETATM   26  O   UNL     1      -4.051  -5.268  -0.706  1.00  0.00           O  
HETATM   27  O   UNL     1      -0.624  -0.438   2.036  1.00  0.00           O  
HETATM   28  O   UNL     1       7.363  -1.051  -0.138  1.00  0.00           O  
HETATM   29  O   UNL     1       6.855  -1.413  -2.272  1.00  0.00           O  
HETATM   30  F   UNL     1      -0.386   5.750   0.986  1.00  0.00           F  
HETATM   31  F   UNL     1      -2.340   1.750  -2.453  1.00  0.00           F  
HETATM   32  C   UNL     1      -0.251   2.826  -2.902  1.00  0.00           C  
HETATM   33  F   UNL     1      -0.412   0.682  -1.852  1.00  0.00           F  
HETATM   34  H   UNL     1       5.545  -0.723   1.401  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.284  -5.224   1.226  1.00  0.00           H  
HETATM   36  H   UNL     1       1.382  -0.192   3.699  1.00  0.00           H  
HETATM   37  H   UNL     1       3.757  -0.367   3.096  1.00  0.00           H  
HETATM   38  H   UNL     1       2.652  -1.077  -0.994  1.00  0.00           H  
HETATM   39  H   UNL     1       0.281  -0.905  -0.374  1.00  0.00           H  
HETATM   40  H   UNL     1       4.373  -1.188  -1.395  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.353   4.442  -1.270  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.291   4.214   2.890  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.008   1.879   2.611  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.411  -2.849  -1.613  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.146  -3.247   2.067  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.881  -5.466  -0.250  1.00  0.00           H  
HETATM   47  H   UNL     1       7.810  -1.466  -2.415  1.00  0.00           H  
HETATM   48  H   UNL     1       0.758   2.962  -2.513  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.200   2.362  -3.887  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.744   3.794  -2.981  1.00  0.00           H  
CONECT    1   11   11    8   34                                       
CONECT    2   22    3    3   35                                       
CONECT    3    2    2   19   26                                       
CONECT    4   17   24   13   13                                       
CONECT    5    6    6   10   27                                       
CONECT    6    7    5    5   36                                       
CONECT    7    8    8    6   37                                       
CONECT    8    1    7    7    9                                       
CONECT    9    8   10   10   38                                       
CONECT   10    9    9    5   39                                       
CONECT   11   12    1    1   40                                       
CONECT   12   28   28   29   11                                       
CONECT   13    4    4   14   18                                       
CONECT   14   15   15   13   41                                       
CONECT   15   16   30   14   14                                       
CONECT   16   17   17   15   42                                       
CONECT   17   16   16    4   43                                       
CONECT   18   13   31   32   33                                       
CONECT   19   20   20    3   44                                       
CONECT   20   21   23   19   19                                       
CONECT   21   25   22   22   20                                       
CONECT   22   21   21    2   45                                       
CONECT   23   24   20                                                 
CONECT   24   25   25    4   23                                       
CONECT   25   27   21   24   24                                       
CONECT   26    3   46                                                 
CONECT   27    5   25                                                 
CONECT   28   12   12                                                 
CONECT   29   12   47                                                 
CONECT   30   15                                                      
CONECT   31   18                                                      
CONECT   32   18   48   49   50                                       
CONECT   33   18                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   22                                                      
CONECT   46   26                                                      
CONECT   47   29                                                      
CONECT   48   32                                                      
CONECT   49   32                                                      
CONECT   50   32                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
