COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -0.024  -2.646   1.848  1.00  0.00           F  
HETATM    2  C   UNL     1      -0.794  -1.579   1.540  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.134  -1.573   1.881  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.234  -0.482   0.883  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.029   0.616   0.567  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.378   0.613   0.909  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.231   1.781   0.575  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.486   1.741  -0.083  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.183   0.523  -0.561  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.569   0.533  -0.709  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.206  -0.611  -1.156  1.00  0.00           C  
HETATM   12  N   UNL     1      -4.482  -0.566  -0.850  1.00  0.00           N  
HETATM   13  C   UNL     1      -5.064  -1.668  -1.277  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.223  -2.878  -1.592  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.435  -1.730  -1.441  1.00  0.00           C  
HETATM   16  N   UNL     1      -4.922   2.977  -0.192  1.00  0.00           N  
HETATM   17  N   UNL     1      -3.975   3.833   0.382  1.00  0.00           N  
HETATM   18  C   UNL     1      -2.953   3.086   0.849  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.926  -0.486   1.569  1.00  0.00           C  
HETATM   20  C   UNL     1       1.205  -0.486   0.522  1.00  0.00           C  
HETATM   21  C   UNL     1       1.603  -0.160  -0.773  1.00  0.00           C  
HETATM   22  C   UNL     1       2.943  -0.165  -1.103  1.00  0.00           C  
HETATM   23  C   UNL     1       3.891  -0.492  -0.150  1.00  0.00           C  
HETATM   24  C   UNL     1       3.502  -0.816   1.137  1.00  0.00           C  
HETATM   25  C   UNL     1       2.165  -0.809   1.480  1.00  0.00           C  
HETATM   26  S   UNL     1       5.600  -0.497  -0.578  1.00  0.00           S  
HETATM   27  O   UNL     1       6.187  -1.416   0.333  1.00  0.00           O  
HETATM   28  O   UNL     1       5.610  -0.745  -1.977  1.00  0.00           O  
HETATM   29  C   UNL     1       6.159   1.193  -0.227  1.00  0.00           C  
HETATM   30  C   UNL     1       7.647   1.317  -0.562  1.00  0.00           C  
HETATM   31  O   UNL     1       8.087   2.648  -0.286  1.00  0.00           O  
HETATM   32  H   UNL     1      -2.563  -2.422   2.393  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.600   1.467   0.059  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.138   1.422  -0.477  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.279  -0.633  -1.280  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.122  -3.493  -0.697  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.703  -3.459  -2.379  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.236  -2.558  -1.926  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.902  -2.638  -1.792  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.972  -0.486   1.837  1.00  0.00           H  
HETATM   41  H   UNL     1       0.863   0.095  -1.518  1.00  0.00           H  
HETATM   42  H   UNL     1       3.252   0.086  -2.106  1.00  0.00           H  
HETATM   43  H   UNL     1       4.247  -1.071   1.877  1.00  0.00           H  
HETATM   44  H   UNL     1       1.863  -1.058   2.486  1.00  0.00           H  
HETATM   45  H   UNL     1       5.590   1.897  -0.833  1.00  0.00           H  
HETATM   46  H   UNL     1       6.005   1.414   0.829  1.00  0.00           H  
HETATM   47  H   UNL     1       8.216   0.613   0.044  1.00  0.00           H  
HETATM   48  H   UNL     1       7.801   1.096  -1.618  1.00  0.00           H  
HETATM   49  H   UNL     1       9.023   2.800  -0.475  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.043   4.799   0.438  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.069   3.457   1.347  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    3    1    4    4                                       
CONECT    3   19   19    2   32                                       
CONECT    4    2    2    5   20                                       
CONECT    5    6    6    4   33                                       
CONECT    6   19    7    5    5                                       
CONECT    7   18   18    6    8                                       
CONECT    8    7   16   16    9                                       
CONECT    9    8   12   12   10                                       
CONECT   10    9   11   11   34                                       
CONECT   11   10   10   15   35                                       
CONECT   12    9    9   13                                            
CONECT   13   12   14   15   15                                       
CONECT   14   13   36   37   38                                       
CONECT   15   13   13   11   39                                       
CONECT   16   17    8    8                                            
CONECT   17   18   16   50                                            
CONECT   18   17    7    7   51                                       
CONECT   19    3    3    6   40                                       
CONECT   20   21    4   25   25                                       
CONECT   21   22   22   20   41                                       
CONECT   22   21   21   23   42                                       
CONECT   23   22   26   24   24                                       
CONECT   24   23   23   25   43                                       
CONECT   25   20   20   24   44                                       
CONECT   26   27   27   23   29                                       
CONECT   26   28   28                                                 
CONECT   27   26   26                                                 
CONECT   28   26   26                                                 
CONECT   29   30   26   45   46                                       
CONECT   30   31   29   47   48                                       
CONECT   31   30   49                                                 
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   19                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   24                                                      
CONECT   44   25                                                      
CONECT   45   29                                                      
CONECT   46   29                                                      
CONECT   47   30                                                      
CONECT   48   30                                                      
CONECT   49   31                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
