COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.250   1.881  -6.464  1.00  0.00           O  
HETATM    2  O   UNL     1       1.151   1.389  -4.470  1.00  0.00           O  
HETATM    3  N   UNL     1      -1.081   0.505  -4.668  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.394   0.550  -5.316  1.00  0.00           C  
HETATM    5  S   UNL     1       0.270   0.972  -5.504  1.00  0.00           S  
HETATM    6  C   UNL     1       0.830  -0.569  -6.278  1.00  0.00           C  
HETATM    7  C   UNL     1       0.365  -0.371  -1.531  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.770  -0.761  -0.816  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.997  -0.715  -1.451  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.062  -0.295  -2.705  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.969   0.073  -3.358  1.00  0.00           C  
HETATM   12  N   UNL     1       0.225   0.039  -2.790  1.00  0.00           N  
HETATM   13  C   UNL     1       3.373  -1.583   0.367  1.00  0.00           C  
HETATM   14  C   UNL     1       2.126  -1.552  -0.221  1.00  0.00           C  
HETATM   15  C   UNL     1       1.704  -0.408  -0.896  1.00  0.00           C  
HETATM   16  C   UNL     1       2.548   0.698  -0.978  1.00  0.00           C  
HETATM   17  C   UNL     1       3.791   0.661  -0.382  1.00  0.00           C  
HETATM   18  C   UNL     1       4.207  -0.478   0.287  1.00  0.00           C  
HETATM   19  F   UNL     1       5.427  -0.512   0.865  1.00  0.00           F  
HETATM   20  O   UNL     1      -0.957   1.811   8.771  1.00  0.00           O  
HETATM   21  O   UNL     1      -0.435  -0.191   7.995  1.00  0.00           O  
HETATM   22  O   UNL     1       0.616  -0.220   5.546  1.00  0.00           O  
HETATM   23  C   UNL     1      -0.778   0.943   7.762  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.006   1.384   6.339  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.736   0.213   5.393  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.967   0.661   3.948  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.697  -0.509   3.002  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.928  -0.061   1.557  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.658  -1.233   0.610  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.248  -1.131  -0.722  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.220   0.048  -0.662  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.906  -2.297  -1.463  1.00  0.00           C  
HETATM   33  O   UNL     1       0.655  -0.943   3.155  1.00  0.00           O  
HETATM   34  H   UNL     1      -3.156   0.209  -4.616  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.614   1.573  -5.622  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.389  -0.097  -6.192  1.00  0.00           H  
HETATM   37  H   UNL     1       1.729  -0.376  -6.863  1.00  0.00           H  
HETATM   38  H   UNL     1       1.051  -1.305  -5.505  1.00  0.00           H  
HETATM   39  H   UNL     1       0.047  -0.952  -6.932  1.00  0.00           H  
HETATM   40  H   UNL     1       3.701  -2.468   0.890  1.00  0.00           H  
HETATM   41  H   UNL     1       1.478  -2.413  -0.158  1.00  0.00           H  
HETATM   42  H   UNL     1       2.225   1.587  -1.501  1.00  0.00           H  
HETATM   43  H   UNL     1       4.444   1.519  -0.442  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.811   1.527   9.684  1.00  0.00           H  
HETATM   45  H   UNL     1       1.179   0.534   5.327  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.331   2.207   6.102  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.038   1.715   6.222  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.410  -0.609   5.631  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.292   1.483   3.711  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.999   0.992   3.831  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.371  -1.332   3.239  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.253   0.760   1.319  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.960   0.269   1.440  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.388  -2.021   0.791  1.00  0.00           H  
HETATM   55  H   UNL     1       0.345  -1.619   0.788  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.992  -1.443   0.290  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.752   0.878  -0.135  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.477   0.359  -1.675  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.126  -0.252  -0.135  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.214  -3.138  -1.506  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.812  -2.598  -0.936  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.163  -1.986  -2.476  1.00  0.00           H  
HETATM   63  H   UNL     1       1.218  -0.188   2.936  1.00  0.00           H  
CONECT    1    5    5                                                 
CONECT    2    5    5                                                 
CONECT    3    4    5   11                                            
CONECT    4    3   34   35   36                                       
CONECT    5    1    1    2    2                                       
CONECT    5    3    6                                                 
CONECT    6    5   37   38   39                                       
CONECT    7    8    8   12   15                                       
CONECT    8    7    7    9   29                                       
CONECT    9    8   10   10   30                                       
CONECT   10    9    9   11                                            
CONECT   11    3   10   12   12                                       
CONECT   12    7   11   11                                            
CONECT   13   14   14   18   40                                       
CONECT   14   13   13   15   41                                       
CONECT   15    7   14   16   16                                       
CONECT   16   15   15   17   42                                       
CONECT   17   16   18   18   43                                       
CONECT   18   13   17   17   19                                       
CONECT   19   18                                                      
CONECT   20   23   44                                                 
CONECT   21   23   23                                                 
CONECT   22   25   45                                                 
CONECT   23   20   21   21   24                                       
CONECT   24   23   25   46   47                                       
CONECT   25   22   24   26   48                                       
CONECT   26   25   27   49   50                                       
CONECT   27   26   28   33   51                                       
CONECT   28   27   29   52   53                                       
CONECT   29    8   28   54   55                                       
CONECT   30    9   31   32   56                                       
CONECT   31   30   57   58   59                                       
CONECT   32   30   60   61   62                                       
CONECT   33   27   63                                                 
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   32                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
