COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.741   1.615   0.770  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.113   0.349   0.675  1.00  0.00           C  
HETATM    3  N   UNL     1      -0.548   0.153  -0.714  1.00  0.00           N  
HETATM    4  C   UNL     1       0.600  -0.031  -1.610  1.00  0.00           C  
HETATM    5  C   UNL     1       1.477   1.223  -1.584  1.00  0.00           C  
HETATM    6  C   UNL     1       1.959   1.471  -0.150  1.00  0.00           C  
HETATM    7  C   UNL     1       0.101  -0.275  -3.036  1.00  0.00           C  
HETATM    8  N   UNL     1       2.760   0.319   0.292  1.00  0.00           N  
HETATM    9  C   UNL     1       2.786   2.756  -0.106  1.00  0.00           C  
HETATM   10  C   UNL     1       2.338  -1.007   0.407  1.00  0.00           C  
HETATM   11  C   UNL     1       1.785  -1.460   1.599  1.00  0.00           C  
HETATM   12  C   UNL     1       1.367  -2.771   1.711  1.00  0.00           C  
HETATM   13  C   UNL     1       1.498  -3.635   0.640  1.00  0.00           C  
HETATM   14  C   UNL     1       2.049  -3.188  -0.550  1.00  0.00           C  
HETATM   15  C   UNL     1       2.464  -1.873  -0.670  1.00  0.00           C  
HETATM   16  F   UNL     1       2.175  -4.034  -1.595  1.00  0.00           F  
HETATM   17  C   UNL     1      -1.484  -0.974  -0.819  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.744  -0.653  -0.056  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.794  -0.022  -0.693  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.954   0.273   0.009  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.056  -0.068   1.350  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.002  -0.700   1.982  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.850  -0.997   1.279  1.00  0.00           C  
HETATM   24  O   UNL     1      -5.989   0.894  -0.616  1.00  0.00           O  
HETATM   25  C   UNL     1      -7.179   1.099   0.148  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.987   2.245  -0.463  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.019  -0.180   0.137  1.00  0.00           C  
HETATM   28  S   UNL     1       4.279   0.925   0.626  1.00  0.00           S  
HETATM   29  N   UNL     1       4.221   2.420  -0.121  1.00  0.00           N  
HETATM   30  O   UNL     1       5.216   0.131  -0.089  1.00  0.00           O  
HETATM   31  C   UNL     1       5.331   3.208  -0.661  1.00  0.00           C  
HETATM   32  O   UNL     1       4.342   1.156   2.026  1.00  0.00           O  
HETATM   33  H   UNL     1       0.150   2.477   0.460  1.00  0.00           H  
HETATM   34  H   UNL     1       1.076   1.753   1.798  1.00  0.00           H  
HETATM   35  H   UNL     1       0.475  -0.511   0.995  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.987   0.451   1.318  1.00  0.00           H  
HETATM   37  H   UNL     1       1.185  -0.889  -1.279  1.00  0.00           H  
HETATM   38  H   UNL     1       2.337   1.080  -2.239  1.00  0.00           H  
HETATM   39  H   UNL     1       0.896   2.080  -1.927  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.457   0.597  -3.379  1.00  0.00           H  
HETATM   41  H   UNL     1       0.952  -0.445  -3.695  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.549  -1.150  -3.048  1.00  0.00           H  
HETATM   43  H   UNL     1       2.548   3.371  -0.974  1.00  0.00           H  
HETATM   44  H   UNL     1       2.551   3.307   0.804  1.00  0.00           H  
HETATM   45  H   UNL     1       1.683  -0.786   2.437  1.00  0.00           H  
HETATM   46  H   UNL     1       0.938  -3.123   2.638  1.00  0.00           H  
HETATM   47  H   UNL     1       1.171  -4.660   0.731  1.00  0.00           H  
HETATM   48  H   UNL     1       2.889  -1.523  -1.599  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.728  -1.148  -1.867  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.024  -1.869  -0.400  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.713   0.243  -1.737  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.957   0.160   1.899  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.081  -0.965   3.026  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.029  -1.494   1.774  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.913   1.349   1.175  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.894   2.401   0.119  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.388   3.156  -0.455  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.253   1.995  -1.490  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.443  -0.997   0.573  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.927  -0.024   0.719  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.285  -0.431  -0.890  1.00  0.00           H  
HETATM   62  H   UNL     1       5.724   3.864   0.116  1.00  0.00           H  
HETATM   63  H   UNL     1       6.120   2.538  -1.004  1.00  0.00           H  
HETATM   64  H   UNL     1       4.976   3.809  -1.499  1.00  0.00           H  
CONECT    1    2    6   33   34                                       
CONECT    2    3    1   35   36                                       
CONECT    3   17    2    4                                            
CONECT    4    3    7    5   37                                       
CONECT    5    4    6   38   39                                       
CONECT    6    1    5    9    8                                       
CONECT    7    4   40   41   42                                       
CONECT    8    6   10   28                                            
CONECT    9    6   29   43   44                                       
CONECT   10   11    8   15   15                                       
CONECT   11   12   12   10   45                                       
CONECT   12   11   11   13   46                                       
CONECT   13   12   14   14   47                                       
CONECT   14   13   13   15   16                                       
CONECT   15   10   10   14   48                                       
CONECT   16   14                                                      
CONECT   17   18    3   49   50                                       
CONECT   18   17   19   19   23                                       
CONECT   19   18   18   20   51                                       
CONECT   20   19   24   21   21                                       
CONECT   21   20   20   22   52                                       
CONECT   22   23   23   21   53                                       
CONECT   23   18   22   22   54                                       
CONECT   24   25   20                                                 
CONECT   25   26   27   24   55                                       
CONECT   26   25   56   57   58                                       
CONECT   27   25   59   60   61                                       
CONECT   28    8   29   32   32                                       
CONECT   28   30   30                                                 
CONECT   29    9   28   31                                            
CONECT   30   28   28                                                 
CONECT   31   29   62   63   64                                       
CONECT   32   28   28                                                 
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   15                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   19                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   26                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
CONECT   61   27                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   31                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
