COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.505  -3.110   0.127  1.00  0.00           C  
HETATM    2  C   UNL     1       3.273  -2.492   0.064  1.00  0.00           C  
HETATM    3  C   UNL     1       3.194  -1.099   0.024  1.00  0.00           C  
HETATM    4  C   UNL     1       4.364  -0.338   0.048  1.00  0.00           C  
HETATM    5  C   UNL     1       5.592  -0.969   0.111  1.00  0.00           C  
HETATM    6  C   UNL     1       5.662  -2.352   0.150  1.00  0.00           C  
HETATM    7  F   UNL     1       6.727  -0.235   0.134  1.00  0.00           F  
HETATM    8  C   UNL     1       1.877  -0.431  -0.043  1.00  0.00           C  
HETATM    9  C   UNL     1       1.684   0.916  -0.086  1.00  0.00           C  
HETATM   10  C   UNL     1       0.368   1.308  -0.147  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.534   0.272  -0.154  1.00  0.00           C  
HETATM   12  S   UNL     1       0.327  -1.260  -0.087  1.00  0.00           S  
HETATM   13  C   UNL     1      -1.942   0.415  -0.211  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.440   1.526  -0.259  1.00  0.00           O  
HETATM   15  N   UNL     1      -2.731  -0.678  -0.212  1.00  0.00           N  
HETATM   16  C   UNL     1      -4.187  -0.530  -0.272  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.805  -1.795  -0.873  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.330  -1.657  -0.876  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.819  -1.414   0.554  1.00  0.00           C  
HETATM   20  N   UNL     1      -6.199  -0.192   1.084  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.737  -0.320   1.141  1.00  0.00           C  
HETATM   22  N   UNL     1      -0.021   2.649  -0.196  1.00  0.00           N  
HETATM   23  C   UNL     1       0.898   3.622  -0.040  1.00  0.00           C  
HETATM   24  O   UNL     1       2.076   3.338   0.051  1.00  0.00           O  
HETATM   25  N   UNL     1       0.510   4.912   0.016  1.00  0.00           N  
HETATM   26  H   UNL     1       4.565  -4.187   0.162  1.00  0.00           H  
HETATM   27  H   UNL     1       2.370  -3.085   0.046  1.00  0.00           H  
HETATM   28  H   UNL     1       6.623  -2.841   0.199  1.00  0.00           H  
HETATM   29  H   UNL     1       4.310   0.740   0.017  1.00  0.00           H  
HETATM   30  H   UNL     1       2.502   1.622  -0.073  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.951   2.879  -0.344  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.334  -1.562  -0.174  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.440   0.329  -0.893  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.449  -1.925  -1.895  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.519  -2.660  -0.274  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.471  -1.173   1.765  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.310   0.588   1.566  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.618  -0.815  -1.506  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.778  -2.572  -1.263  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.903  -1.301   0.554  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.543  -2.262   1.181  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.471   0.614   0.543  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.430   5.139  -0.057  1.00  0.00           H  
HETATM   44  H   UNL     1       1.171   5.613   0.128  1.00  0.00           H  
CONECT    1    2    6    6   26                                       
CONECT    2    1    3    3   27                                       
CONECT    3    2    2    4    8                                       
CONECT    4    3    5    5   29                                       
CONECT    5    4    4    6    7                                       
CONECT    6    1    1    5   28                                       
CONECT    7    5                                                      
CONECT    8    3    9    9   12                                       
CONECT    9    8    8   10   30                                       
CONECT   10    9   11   11   22                                       
CONECT   11   10   10   12   13                                       
CONECT   12    8   11                                                 
CONECT   13   11   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   32                                            
CONECT   16   15   17   21   33                                       
CONECT   17   16   18   34   35                                       
CONECT   18   17   19   38   39                                       
CONECT   19   18   20   40   41                                       
CONECT   20   19   21   42                                            
CONECT   21   16   20   36   37                                       
CONECT   22   10   23   31                                            
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   43   44                                            
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    6                                                      
CONECT   29    4                                                      
CONECT   30    9                                                      
CONECT   31   22                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   21                                                      
CONECT   37   21                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
