COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.452  -1.230   0.331  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.925  -0.966   0.308  1.00  0.00           C  
HETATM    3  C   UNL     1       1.316  -0.643   1.167  1.00  0.00           C  
HETATM    4  C   UNL     1       1.067  -2.112  -0.482  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.491  -0.142   1.270  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.724  -1.524  -0.681  1.00  0.00           C  
HETATM    7  N   UNL     1       2.578  -1.072   0.986  1.00  0.00           N  
HETATM    8  O   UNL     1       0.996   0.185   1.997  1.00  0.00           O  
HETATM    9  C   UNL     1       2.534  -2.065  -0.102  1.00  0.00           C  
HETATM   10  O   UNL     1       0.555  -2.799  -1.339  1.00  0.00           O  
HETATM   11  C   UNL     1      -2.848   0.117   1.245  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.080  -1.262  -0.701  1.00  0.00           C  
HETATM   13  C   UNL     1       3.765  -0.638   1.727  1.00  0.00           C  
HETATM   14  C   UNL     1       3.003  -3.431   0.401  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.642  -0.445   0.262  1.00  0.00           C  
HETATM   16  C   UNL     1       4.307   0.626   1.110  1.00  0.00           C  
HETATM   17  S   UNL     1      -5.372  -0.114   0.234  1.00  0.00           S  
HETATM   18  C   UNL     1       5.108   0.580  -0.046  1.00  0.00           C  
HETATM   19  C   UNL     1       4.031   1.848   1.655  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.532   1.367  -0.802  1.00  0.00           C  
HETATM   21  O   UNL     1      -5.935  -1.243  -0.420  1.00  0.00           O  
HETATM   22  O   UNL     1      -5.694   0.185   1.585  1.00  0.00           O  
HETATM   23  C   UNL     1       5.597   1.794  -0.592  1.00  0.00           C  
HETATM   24  C   UNL     1       5.431  -0.638  -0.665  1.00  0.00           C  
HETATM   25  C   UNL     1       4.543   3.003   1.068  1.00  0.00           C  
HETATM   26  F   UNL     1      -5.031   1.098  -2.080  1.00  0.00           F  
HETATM   27  F   UNL     1      -6.881   1.726  -0.896  1.00  0.00           F  
HETATM   28  F   UNL     1      -4.809   2.418  -0.228  1.00  0.00           F  
HETATM   29  N   UNL     1       5.293   2.956  -0.006  1.00  0.00           N  
HETATM   30  C   UNL     1       6.397   1.750  -1.747  1.00  0.00           C  
HETATM   31  C   UNL     1       6.209  -0.640  -1.782  1.00  0.00           C  
HETATM   32  C   UNL     1       6.690   0.552  -2.321  1.00  0.00           C  
HETATM   33  H   UNL     1      -0.872   0.297   2.038  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.285  -2.162  -1.434  1.00  0.00           H  
HETATM   35  H   UNL     1       3.139  -1.738  -0.947  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.289   0.758   1.993  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.702  -1.696  -1.470  1.00  0.00           H  
HETATM   38  H   UNL     1       3.495  -0.448   2.766  1.00  0.00           H  
HETATM   39  H   UNL     1       4.525  -1.418   1.685  1.00  0.00           H  
HETATM   40  H   UNL     1       2.963  -4.152  -0.415  1.00  0.00           H  
HETATM   41  H   UNL     1       4.028  -3.352   0.766  1.00  0.00           H  
HETATM   42  H   UNL     1       2.354  -3.763   1.212  1.00  0.00           H  
HETATM   43  H   UNL     1       3.416   1.918   2.540  1.00  0.00           H  
HETATM   44  H   UNL     1       5.064  -1.569  -0.257  1.00  0.00           H  
HETATM   45  H   UNL     1       4.316   3.962   1.510  1.00  0.00           H  
HETATM   46  H   UNL     1       6.778   2.664  -2.177  1.00  0.00           H  
HETATM   47  H   UNL     1       6.456  -1.578  -2.257  1.00  0.00           H  
HETATM   48  H   UNL     1       7.305   0.524  -3.208  1.00  0.00           H  
CONECT    1    2    3    4                                            
CONECT    2    1    5    5    6                                       
CONECT    3    1    7    8    8                                       
CONECT    4    1    9   10   10                                       
CONECT    5    2    2   11   33                                       
CONECT    6    2   12   12   34                                       
CONECT    7    3    9   13                                            
CONECT    8    3    3                                                 
CONECT    9    4    7   14   35                                       
CONECT   10    4    4                                                 
CONECT   11    5   15   15   36                                       
CONECT   12    6    6   15   37                                       
CONECT   13    7   16   38   39                                       
CONECT   14    9   40   41   42                                       
CONECT   15   11   11   12   17                                       
CONECT   16   13   18   18   19                                       
CONECT   17   15   20   21   21                                       
CONECT   17   22   22                                                 
CONECT   18   16   16   23   24                                       
CONECT   19   16   25   25   43                                       
CONECT   20   17   26   27   28                                       
CONECT   21   17   17                                                 
CONECT   22   17   17                                                 
CONECT   23   18   29   29   30                                       
CONECT   24   18   31   31   44                                       
CONECT   25   19   19   29   45                                       
CONECT   26   20                                                      
CONECT   27   20                                                      
CONECT   28   20                                                      
CONECT   29   23   23   25                                            
CONECT   30   23   32   32   46                                       
CONECT   31   24   24   32   47                                       
CONECT   32   30   30   31   48                                       
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   19                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   30                                                      
CONECT   47   31                                                      
CONECT   48   32                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
