COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.449  -1.461   1.224  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.730  -0.533   0.417  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.566   0.591   0.401  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.427  -0.712  -0.239  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.996  -0.560  -0.242  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.517  -2.000  -0.043  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.468  -2.957  -0.764  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.997  -4.375  -0.568  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.110  -4.939  -1.466  1.00  0.00           C  
HETATM   10  C   UNL     1       0.326  -6.238  -1.283  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.124  -6.973  -0.202  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.010  -6.409   0.697  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.447  -5.110   0.513  1.00  0.00           C  
HETATM   14  C   UNL     1       2.094   2.689  -0.392  1.00  0.00           C  
HETATM   15  C   UNL     1       2.946   3.765   0.231  1.00  0.00           C  
HETATM   16  C   UNL     1       3.924   5.997   0.213  1.00  0.00           C  
HETATM   17  C   UNL     1       3.627   0.869   0.305  1.00  0.00           C  
HETATM   18  C   UNL     1       5.830   0.611   1.205  1.00  0.00           C  
HETATM   19  C   UNL     1       4.004   0.159  -0.820  1.00  0.00           C  
HETATM   20  F   UNL     1       7.680  -1.910   0.504  1.00  0.00           F  
HETATM   21  C   UNL     1       7.614  -0.624  -0.043  1.00  0.00           C  
HETATM   22  F   UNL     1       8.490   0.221   0.647  1.00  0.00           F  
HETATM   23  F   UNL     1       7.978  -0.672  -1.392  1.00  0.00           F  
HETATM   24  C   UNL     1       6.207  -0.098   0.080  1.00  0.00           C  
HETATM   25  C   UNL     1       4.540   1.095   1.317  1.00  0.00           C  
HETATM   26  C   UNL     1       5.294  -0.324  -0.932  1.00  0.00           C  
HETATM   27  C   UNL     1       2.222   1.401   0.424  1.00  0.00           C  
HETATM   28  N   UNL     1       3.096   4.951  -0.392  1.00  0.00           N  
HETATM   29  O   UNL     1       3.496   3.564   1.293  1.00  0.00           O  
HETATM   30  N   UNL     1       1.277   0.405  -0.085  1.00  0.00           N  
HETATM   31  C   UNL     1       0.006   0.390   0.363  1.00  0.00           C  
HETATM   32  O   UNL     1      -0.332   1.142   1.252  1.00  0.00           O  
HETATM   33  N   UNL     1      -2.294  -0.382   0.412  1.00  0.00           N  
HETATM   34  O   UNL     1      -3.372  -1.157  -1.370  1.00  0.00           O  
HETATM   35  O   UNL     1      -6.633   0.258   1.146  1.00  0.00           O  
HETATM   36  N   UNL     1      -6.546  -0.864   1.583  1.00  0.00           N  
HETATM   37  C   UNL     1      -5.025  -2.861   1.584  1.00  0.00           C  
HETATM   38  C   UNL     1      -5.325   1.867  -0.286  1.00  0.00           C  
HETATM   39  S   UNL     1      -3.935   2.339  -1.281  1.00  0.00           S  
HETATM   40  N   UNL     1      -4.468   3.777  -1.599  1.00  0.00           N  
HETATM   41  N   UNL     1      -5.595   3.954  -1.034  1.00  0.00           N  
HETATM   42  C   UNL     1      -6.130   2.992  -0.320  1.00  0.00           C  
HETATM   43  C   UNL     1      -7.460   3.100   0.381  1.00  0.00           C  
HETATM   44  H   UNL     1      -1.094  -0.354  -1.308  1.00  0.00           H  
HETATM   45  H   UNL     1       0.487  -2.109  -0.452  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.503  -2.234   1.021  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.473  -2.848  -0.355  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.482  -2.723  -1.828  1.00  0.00           H  
HETATM   49  H   UNL     1       0.242  -4.365  -2.310  1.00  0.00           H  
HETATM   50  H   UNL     1       1.018  -6.679  -1.985  1.00  0.00           H  
HETATM   51  H   UNL     1       0.216  -7.988  -0.060  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.362  -6.983   1.541  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.137  -4.668   1.217  1.00  0.00           H  
HETATM   54  H   UNL     1       1.052   3.011  -0.402  1.00  0.00           H  
HETATM   55  H   UNL     1       2.428   2.507  -1.413  1.00  0.00           H  
HETATM   56  H   UNL     1       4.944   5.630   0.331  1.00  0.00           H  
HETATM   57  H   UNL     1       3.927   6.876  -0.431  1.00  0.00           H  
HETATM   58  H   UNL     1       3.518   6.262   1.189  1.00  0.00           H  
HETATM   59  H   UNL     1       6.544   0.788   1.997  1.00  0.00           H  
HETATM   60  H   UNL     1       3.290  -0.018  -1.611  1.00  0.00           H  
HETATM   61  H   UNL     1       4.246   1.649   2.196  1.00  0.00           H  
HETATM   62  H   UNL     1       5.588  -0.879  -1.811  1.00  0.00           H  
HETATM   63  H   UNL     1       2.000   1.610   1.471  1.00  0.00           H  
HETATM   64  H   UNL     1       2.656   5.111  -1.242  1.00  0.00           H  
HETATM   65  H   UNL     1       1.566  -0.245  -0.745  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.339  -0.027   1.314  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.393  -3.558   0.831  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.937  -2.912   1.625  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.437  -3.127   2.558  1.00  0.00           H  
HETATM   70  H   UNL     1      -7.309   3.489   1.388  1.00  0.00           H  
HETATM   71  H   UNL     1      -8.110   3.776  -0.175  1.00  0.00           H  
HETATM   72  H   UNL     1      -7.922   2.115   0.437  1.00  0.00           H  
CONECT    1   37   36   36    2                                       
CONECT    2    1    4    3    3                                       
CONECT    3    2    2   35   38                                       
CONECT    4   33    2   34   34                                       
CONECT    5    6   31   33   44                                       
CONECT    6    7    5   45   46                                       
CONECT    7    8    6   47   48                                       
CONECT    8    9    9   13    7                                       
CONECT    9   10    8    8   49                                       
CONECT   10   11   11    9   50                                       
CONECT   11   10   10   12   51                                       
CONECT   12   11   13   13   52                                       
CONECT   13   12   12    8   53                                       
CONECT   14   15   27   54   55                                       
CONECT   15   28   29   29   14                                       
CONECT   16   28   56   57   58                                       
CONECT   17   27   19   19   25                                       
CONECT   18   25   25   24   59                                       
CONECT   19   17   17   26   60                                       
CONECT   20   21                                                      
CONECT   21   23   24   20   22                                       
CONECT   22   21                                                      
CONECT   23   21                                                      
CONECT   24   26   26   18   21                                       
CONECT   25   17   18   18   61                                       
CONECT   26   19   24   24   62                                       
CONECT   27   14   30   17   63                                       
CONECT   28   16   15   64                                            
CONECT   29   15   15                                                 
CONECT   30   27   31   65                                            
CONECT   31   30    5   32   32                                       
CONECT   32   31   31                                                 
CONECT   33    5    4   66                                            
CONECT   34    4    4                                                 
CONECT   35   36    3                                                 
CONECT   36    1    1   35                                            
CONECT   37    1   67   68   69                                       
CONECT   38    3   42   42   39                                       
CONECT   39   38   40                                                 
CONECT   40   39   41   41                                            
CONECT   41   42   40   40                                            
CONECT   42   43   38   38   41                                       
CONECT   43   42   70   71   72                                       
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   12                                                      
CONECT   53   13                                                      
CONECT   54   14                                                      
CONECT   55   14                                                      
CONECT   56   16                                                      
CONECT   57   16                                                      
CONECT   58   16                                                      
CONECT   59   18                                                      
CONECT   60   19                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   30                                                      
CONECT   66   33                                                      
CONECT   67   37                                                      
CONECT   68   37                                                      
CONECT   69   37                                                      
CONECT   70   43                                                      
CONECT   71   43                                                      
CONECT   72   43                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
