COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.191   0.779  -1.214  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.840   2.688   0.221  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.714   1.999  -1.018  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.365   4.725   0.724  1.00  0.00           C  
HETATM    5  C   UNL     1       2.533  -1.201   0.522  1.00  0.00           C  
HETATM    6  C   UNL     1       3.004   0.758   2.035  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.365  -2.167  -0.485  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.174  -2.894   0.366  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.462  -2.456   0.640  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.119  -0.564  -0.792  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.574  -2.659   1.712  1.00  0.00           C  
HETATM   12  C   UNL     1       5.283  -1.315  -0.259  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.933  -1.288   0.058  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.234   1.351   0.030  1.00  0.00           C  
HETATM   15  C   UNL     1       1.046   0.839   0.502  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.834  -1.000  -1.059  1.00  0.00           C  
HETATM   17  C   UNL     1       1.279  -0.428   0.150  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.950   0.427  -0.697  1.00  0.00           C  
HETATM   19  C   UNL     1       4.800  -0.280   0.723  1.00  0.00           C  
HETATM   20  C   UNL     1       2.019   1.682   1.315  1.00  0.00           C  
HETATM   21  C   UNL     1       6.207  -2.415   0.270  1.00  0.00           C  
HETATM   22  C   UNL     1       6.769  -1.306  -0.622  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.949  -0.208  -1.986  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.439   3.775   0.846  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.375   4.266   0.029  1.00  0.00           N  
HETATM   26  N   UNL     1      -2.067   2.943  -0.319  1.00  0.00           N  
HETATM   27  N   UNL     1       3.500  -0.242   1.078  1.00  0.00           N  
HETATM   28  O   UNL     1      -3.805   2.256  -1.488  1.00  0.00           O  
HETATM   29  O   UNL     1       5.581   0.520   1.194  1.00  0.00           O  
HETATM   30  O   UNL     1      -6.260  -3.170   1.476  1.00  0.00           O  
HETATM   31  F   UNL     1       7.576  -0.336  -0.016  1.00  0.00           F  
HETATM   32  F   UNL     1       7.117  -1.646  -1.934  1.00  0.00           F  
HETATM   33  S   UNL     1      -0.050  -1.078  -0.794  1.00  0.00           S  
HETATM   34  H   UNL     1      -1.296   5.720   1.140  1.00  0.00           H  
HETATM   35  H   UNL     1       2.293  -1.958   1.267  1.00  0.00           H  
HETATM   36  H   UNL     1       2.953  -1.675  -0.366  1.00  0.00           H  
HETATM   37  H   UNL     1       3.839   1.342   2.419  1.00  0.00           H  
HETATM   38  H   UNL     1       2.499   0.255   2.860  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.362  -2.507  -0.698  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.806  -3.803   0.817  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.485   0.345  -1.245  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.116  -2.600   0.769  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.104  -3.322   2.395  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.503  -1.664   2.153  1.00  0.00           H  
HETATM   45  H   UNL     1       4.576  -1.587  -1.043  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.936  -0.947   0.267  1.00  0.00           H  
HETATM   47  H   UNL     1       1.468   2.269   2.049  1.00  0.00           H  
HETATM   48  H   UNL     1       2.567   2.350   0.650  1.00  0.00           H  
HETATM   49  H   UNL     1       6.465  -2.389   1.329  1.00  0.00           H  
HETATM   50  H   UNL     1       6.106  -3.409  -0.165  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.564   0.304  -2.726  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.258  -0.883  -2.492  1.00  0.00           H  
CONECT    1    3   23   18                                            
CONECT    2   26   24   24   14                                       
CONECT    3   28   28   26    1                                       
CONECT    4   25   25   24   34                                       
CONECT    5   17   27   35   36                                       
CONECT    6   20   27   37   38                                       
CONECT    7   16   16    8   39                                       
CONECT    8    9    9    7   40                                       
CONECT    9   13   30    8    8                                       
CONECT   10   13   13   16   41                                       
CONECT   11   30   42   43   44                                       
CONECT   12   19   22   21   45                                       
CONECT   13   10   10    9   46                                       
CONECT   14    2   18   18   15                                       
CONECT   15   14   20   17   17                                       
CONECT   16   10   23    7    7                                       
CONECT   17   15   15   33    5                                       
CONECT   18    1   14   14   33                                       
CONECT   19   27   29   29   12                                       
CONECT   20   15    6   47   48                                       
CONECT   21   12   22   49   50                                       
CONECT   22   31   12   32   21                                       
CONECT   23    1   16   51   52                                       
CONECT   24    4    2    2                                            
CONECT   25    4    4   26                                            
CONECT   26   25    3    2                                            
CONECT   27    6    5   19                                            
CONECT   28    3    3                                                 
CONECT   29   19   19                                                 
CONECT   30   11    9                                                 
CONECT   31   22                                                      
CONECT   32   22                                                      
CONECT   33   18   17                                                 
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
