COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.285   1.415  -1.025  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.344   2.276   0.006  1.00  0.00           C  
HETATM    3  C   UNL     1       4.380   2.063   0.045  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.604   1.449  -0.022  1.00  0.00           C  
HETATM    5  C   UNL     1       4.771   0.592   0.197  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.941   2.992  -1.284  1.00  0.00           C  
HETATM    7  C   UNL     1       5.802   0.226  -0.873  1.00  0.00           C  
HETATM    8  C   UNL     1       3.548  -0.273   0.032  1.00  0.00           C  
HETATM    9  C   UNL     1       3.044  -0.971   1.114  1.00  0.00           C  
HETATM   10  C   UNL     1       1.922  -1.764   0.963  1.00  0.00           C  
HETATM   11  C   UNL     1       1.303  -1.859  -0.269  1.00  0.00           C  
HETATM   12  C   UNL     1       1.806  -1.160  -1.351  1.00  0.00           C  
HETATM   13  C   UNL     1       2.925  -0.363  -1.199  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.493   3.794  -0.105  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.108  -1.166  -1.223  1.00  0.00           C  
HETATM   16  F   UNL     1       3.816   2.268  -1.218  1.00  0.00           F  
HETATM   17  F   UNL     1       3.448   2.402   1.033  1.00  0.00           F  
HETATM   18  F   UNL     1       5.518   2.865   0.184  1.00  0.00           F  
HETATM   19  O   UNL     1       5.334   0.380   1.493  1.00  0.00           O  
HETATM   20  S   UNL     1      -0.127  -2.869  -0.461  1.00  0.00           S  
HETATM   21  O   UNL     1      -0.197  -3.208  -1.839  1.00  0.00           O  
HETATM   22  O   UNL     1      -0.075  -3.839   0.576  1.00  0.00           O  
HETATM   23  N   UNL     1      -1.446  -1.918  -0.147  1.00  0.00           N  
HETATM   24  C   UNL     1      -1.985  -1.802   1.217  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.356  -2.477   1.286  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.125  -0.315   1.560  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.243   0.296  -0.784  1.00  0.00           C  
HETATM   28  N   UNL     1      -2.919   0.352   0.520  1.00  0.00           N  
HETATM   29  C   UNL     1      -3.222   1.739   0.897  1.00  0.00           C  
HETATM   30  N   UNL     1      -5.974   0.748   1.068  1.00  0.00           N  
HETATM   31  H   UNL     1      -2.875   3.080  -1.499  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.586   2.865  -2.153  1.00  0.00           H  
HETATM   33  H   UNL     1       6.687   0.851  -0.754  1.00  0.00           H  
HETATM   34  H   UNL     1       6.081  -0.823  -0.765  1.00  0.00           H  
HETATM   35  H   UNL     1       5.373   0.388  -1.862  1.00  0.00           H  
HETATM   36  H   UNL     1       3.528  -0.897   2.077  1.00  0.00           H  
HETATM   37  H   UNL     1       1.530  -2.310   1.808  1.00  0.00           H  
HETATM   38  H   UNL     1       1.323  -1.234  -2.314  1.00  0.00           H  
HETATM   39  H   UNL     1       3.316   0.186  -2.043  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.502   4.196  -0.198  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.792   4.411   0.457  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.507  -1.221  -2.131  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.096  -1.585  -1.408  1.00  0.00           H  
HETATM   44  H   UNL     1       4.734   0.592   2.221  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.305  -2.281   1.921  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.256  -3.531   1.024  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.754  -2.390   2.297  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.036  -1.992   0.585  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.626  -0.210   2.523  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.137   0.141   1.612  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.253   0.744  -0.699  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.829   0.845  -1.521  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.331   2.353   0.769  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.539   1.771   1.939  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.819   0.272   1.075  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.396   0.720   1.847  1.00  0.00           H  
CONECT    1    4    4                                                 
CONECT    2    4    6   14   29                                       
CONECT    3    5   16   17   18                                       
CONECT    4    1    1    2   30                                       
CONECT    5    3    7    8   19                                       
CONECT    6    2   14   31   32                                       
CONECT    7    5   33   34   35                                       
CONECT    8    5    9    9   13                                       
CONECT    9    8    8   10   36                                       
CONECT   10    9   11   11   37                                       
CONECT   11   10   10   12   20                                       
CONECT   12   11   13   13   38                                       
CONECT   13    8   12   12   39                                       
CONECT   14    2    6   40   41                                       
CONECT   15   23   27   42   43                                       
CONECT   16    3                                                      
CONECT   17    3                                                      
CONECT   18    3                                                      
CONECT   19    5   44                                                 
CONECT   20   11   21   21   22                                       
CONECT   20   22   23                                                 
CONECT   21   20   20                                                 
CONECT   22   20   20                                                 
CONECT   23   15   20   24                                            
CONECT   24   23   25   26   45                                       
CONECT   25   24   46   47   48                                       
CONECT   26   24   28   49   50                                       
CONECT   27   15   28   51   52                                       
CONECT   28   26   27   29                                            
CONECT   29    2   28   53   54                                       
CONECT   30    4   55   56                                            
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   19                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
