COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       6.097   0.238   0.079  1.00  0.00           C  
HETATM    2  C   UNL     1       5.497  -0.050   1.291  1.00  0.00           C  
HETATM    3  C   UNL     1       4.320  -0.775   1.324  1.00  0.00           C  
HETATM    4  C   UNL     1       2.462  -2.003   0.181  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.894   0.725  -0.024  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.178   1.144  -0.068  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.500  -0.213   0.019  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.455  -1.154   0.078  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.046  -2.427   0.160  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.978  -1.081  -0.641  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.520   0.664  -0.078  1.00  0.00           C  
HETATM   12  F   UNL     1      -9.768   1.179  -0.122  1.00  0.00           F  
HETATM   13  C   UNL     1      -8.253  -0.552  -0.684  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.510   1.351   0.574  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.234   0.826   0.620  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.964  -0.393   0.012  1.00  0.00           C  
HETATM   17  N   UNL     1      -4.670  -0.928   0.058  1.00  0.00           N  
HETATM   18  O   UNL     1      -4.174   2.060  -0.137  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.787   3.433  -0.225  1.00  0.00           C  
HETATM   20  N   UNL     1      -1.921   1.549  -0.086  1.00  0.00           N  
HETATM   21  N   UNL     1      -4.344  -2.287   0.154  1.00  0.00           N  
HETATM   22  C   UNL     1      -1.082  -0.652   0.060  1.00  0.00           C  
HETATM   23  C   UNL     1       0.064  -1.573   0.130  1.00  0.00           C  
HETATM   24  O   UNL     1      -0.123  -2.772   0.202  1.00  0.00           O  
HETATM   25  N   UNL     1       1.321  -1.086   0.112  1.00  0.00           N  
HETATM   26  C   UNL     1       3.744  -1.212   0.145  1.00  0.00           C  
HETATM   27  C   UNL     1       4.344  -0.923  -1.066  1.00  0.00           C  
HETATM   28  C   UNL     1       5.518  -0.193  -1.099  1.00  0.00           C  
HETATM   29  S   UNL     1       7.597   1.162   0.038  1.00  0.00           S  
HETATM   30  O   UNL     1       7.666   1.757  -1.251  1.00  0.00           O  
HETATM   31  O   UNL     1       7.640   1.912   1.244  1.00  0.00           O  
HETATM   32  N   UNL     1       8.844   0.075   0.118  1.00  0.00           N  
HETATM   33  C   UNL     1       9.055  -0.880  -0.973  1.00  0.00           C  
HETATM   34  H   UNL     1       5.946   0.291   2.211  1.00  0.00           H  
HETATM   35  H   UNL     1       3.851  -1.000   2.270  1.00  0.00           H  
HETATM   36  H   UNL     1       2.413  -2.574   1.108  1.00  0.00           H  
HETATM   37  H   UNL     1       2.432  -2.685  -0.669  1.00  0.00           H  
HETATM   38  H   UNL     1       0.110   1.124  -0.043  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.514  -3.365   0.225  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.771  -2.032  -1.110  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.042  -1.087  -1.192  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.721   2.299   1.047  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.447   1.362   1.129  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.201   3.702   0.654  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.188   3.585  -1.122  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.678   4.059  -0.273  1.00  0.00           H  
HETATM   47  H   UNL     1       1.470  -0.130   0.054  1.00  0.00           H  
HETATM   48  H   UNL     1       3.894  -1.264  -1.987  1.00  0.00           H  
HETATM   49  H   UNL     1       5.987   0.032  -2.046  1.00  0.00           H  
HETATM   50  H   UNL     1       9.435   0.071   0.887  1.00  0.00           H  
HETATM   51  H   UNL     1       8.169  -1.504  -1.085  1.00  0.00           H  
HETATM   52  H   UNL     1       9.238  -0.338  -1.900  1.00  0.00           H  
HETATM   53  H   UNL     1       9.916  -1.509  -0.744  1.00  0.00           H  
CONECT    1   28   28    2   29                                       
CONECT    2    3    3    1   34                                       
CONECT    3   26    2    2   35                                       
CONECT    4   25   26   36   37                                       
CONECT    5   22   20   20   38                                       
CONECT    6    7    7   20   18                                       
CONECT    7    8   17    6    6                                       
CONECT    8    9   22   22    7                                       
CONECT    9   21   21    8   39                                       
CONECT   10   16   16   13   40                                       
CONECT   11   13   13   14   12                                       
CONECT   12   11                                                      
CONECT   13   10   11   11   41                                       
CONECT   14   15   15   11   42                                       
CONECT   15   16   14   14   43                                       
CONECT   16   17   10   10   15                                       
CONECT   17   21    7   16                                            
CONECT   18    6   19                                                 
CONECT   19   18   44   45   46                                       
CONECT   20    5    5    6                                            
CONECT   21    9    9   17                                            
CONECT   22   23    8    8    5                                       
CONECT   23   24   24   25   22                                       
CONECT   24   23   23                                                 
CONECT   25    4   23   47                                            
CONECT   26    4   27   27    3                                       
CONECT   27   26   26   28   48                                       
CONECT   28   27    1    1   49                                       
CONECT   29    1   31   31   32                                       
CONECT   29   30   30                                                 
CONECT   30   29   29                                                 
CONECT   31   29   29                                                 
CONECT   32   29   33   50                                            
CONECT   33   32   51   52   53                                       
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   25                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   32                                                      
CONECT   51   33                                                      
CONECT   52   33                                                      
CONECT   53   33                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
