COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.597  -0.186   0.455  1.00  0.00           C  
HETATM    2  N   UNL     1      -5.389   1.052   1.288  1.00  0.00           N  
HETATM    3  C   UNL     1       7.794   0.117   2.515  1.00  0.00           C  
HETATM    4  C   UNL     1       8.957  -0.306   1.899  1.00  0.00           C  
HETATM    5  C   UNL     1       5.266  -0.456  -1.618  1.00  0.00           C  
HETATM    6  C   UNL     1       7.772  -0.612  -0.162  1.00  0.00           C  
HETATM    7  C   UNL     1       0.865   0.682  -1.056  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.492   1.098  -0.645  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.540   1.080  -1.567  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.805   1.469  -1.178  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.036   1.877   0.124  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.002   1.898   1.043  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.733   1.505   0.668  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.600  -0.097   0.521  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.121   0.010  -0.763  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.332  -1.123  -1.527  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.028  -2.369  -1.020  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.502  -2.489   0.271  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.284  -1.343   1.040  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.176  -3.818   0.815  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.408  -5.051  -0.019  1.00  0.00           C  
HETATM   22  C   UNL     1       6.614   0.179   1.800  1.00  0.00           C  
HETATM   23  C   UNL     1       8.947  -0.670   0.562  1.00  0.00           C  
HETATM   24  C   UNL     1       5.333  -0.115  -0.319  1.00  0.00           C  
HETATM   25  C   UNL     1       3.150   0.310  -0.548  1.00  0.00           C  
HETATM   26  F   UNL     1      10.087  -1.082  -0.034  1.00  0.00           F  
HETATM   27  N   UNL     1       4.193   0.289   0.222  1.00  0.00           N  
HETATM   28  N   UNL     1       1.875   0.701  -0.163  1.00  0.00           N  
HETATM   29  O   UNL     1       1.071   0.323  -2.198  1.00  0.00           O  
HETATM   30  O   UNL     1      -5.364   2.661  -0.583  1.00  0.00           O  
HETATM   31  O   UNL     1      -4.484   3.317   1.662  1.00  0.00           O  
HETATM   32  O   UNL     1      -4.721  -3.919   1.934  1.00  0.00           O  
HETATM   33  S   UNL     1       3.606  -0.226  -2.163  1.00  0.00           S  
HETATM   34  S   UNL     1      -4.654   2.374   0.613  1.00  0.00           S  
HETATM   35  H   UNL     1      -5.674   1.075   2.215  1.00  0.00           H  
HETATM   36  H   UNL     1       7.807   0.399   3.557  1.00  0.00           H  
HETATM   37  H   UNL     1       9.878  -0.353   2.463  1.00  0.00           H  
HETATM   38  H   UNL     1       6.089  -0.805  -2.225  1.00  0.00           H  
HETATM   39  H   UNL     1       7.764  -0.896  -1.204  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.361   0.762  -2.584  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.616   1.456  -1.890  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.190   2.214   2.059  1.00  0.00           H  
HETATM   43  H   UNL     1       0.073   1.522   1.387  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.362   0.983  -1.166  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.738  -1.032  -2.523  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.194  -3.252  -1.620  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.875  -1.428   2.036  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.512  -5.271  -0.600  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.633  -5.894   0.634  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.246  -4.881  -0.694  1.00  0.00           H  
HETATM   51  H   UNL     1       5.707   0.510   2.282  1.00  0.00           H  
HETATM   52  H   UNL     1       1.711   0.988   0.749  1.00  0.00           H  
CONECT    1   24   22   22    6                                       
CONECT    2   34   14   35                                            
CONECT    3   22    4    4   36                                       
CONECT    4    3    3   23   37                                       
CONECT    5   33   24   24   38                                       
CONECT    6    1   23   23   39                                       
CONECT    7   29   29    8   28                                       
CONECT    8   13    7    9    9                                       
CONECT    9    8    8   10   40                                       
CONECT   10   11   11    9   41                                       
CONECT   11   12   34   10   10                                       
CONECT   12   13   13   11   42                                       
CONECT   13   12   12    8   43                                       
CONECT   14    2   15   15   19                                       
CONECT   15   14   14   16   44                                       
CONECT   16   15   17   17   45                                       
CONECT   17   16   16   18   46                                       
CONECT   18   19   19   17   20                                       
CONECT   19   14   18   18   47                                       
CONECT   20   18   21   32   32                                       
CONECT   21   20   48   49   50                                       
CONECT   22    1    1    3   51                                       
CONECT   23    6    6    4   26                                       
CONECT   24    5    5   27    1                                       
CONECT   25   33   28   27   27                                       
CONECT   26   23                                                      
CONECT   27   25   25   24                                            
CONECT   28    7   25   52                                            
CONECT   29    7    7                                                 
CONECT   30   34   34                                                 
CONECT   31   34   34                                                 
CONECT   32   20   20                                                 
CONECT   33   25    5                                                 
CONECT   34   30   30   31   31                                       
CONECT   34   11    2                                                 
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   19                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   28                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
