COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.451  -2.833   1.268  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.238  -2.772  -0.245  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.440  -4.165  -0.848  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.792  -4.580  -0.632  1.00  0.00           O  
HETATM    5  C   UNL     1      -2.763  -3.696  -1.199  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.584  -2.298  -0.600  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.208  -1.840  -0.840  1.00  0.00           N  
HETATM    8  C   UNL     1      -1.010  -0.477  -0.330  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.672   0.458  -1.493  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.965   1.051  -2.064  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.570   1.922  -1.044  1.00  0.00           N  
HETATM   12  S   UNL     1      -4.160   1.749  -0.615  1.00  0.00           S  
HETATM   13  O   UNL     1      -4.644   3.056  -0.335  1.00  0.00           O  
HETATM   14  O   UNL     1      -4.747   0.894  -1.585  1.00  0.00           O  
HETATM   15  C   UNL     1      -4.195   0.869   0.911  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.641   1.284   2.052  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.798   0.422   3.124  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.479  -0.692   2.854  1.00  0.00           C  
HETATM   19  S   UNL     1      -4.973  -0.688   1.166  1.00  0.00           S  
HETATM   20  C   UNL     1      -1.725   2.949  -0.416  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.442   2.281   0.090  1.00  0.00           C  
HETATM   22  N   UNL     1       0.191   1.546  -1.013  1.00  0.00           N  
HETATM   23  C   UNL     1       1.445   1.059  -0.636  1.00  0.00           C  
HETATM   24  C   UNL     1       1.908   1.258   0.659  1.00  0.00           C  
HETATM   25  C   UNL     1       3.148   0.776   1.029  1.00  0.00           C  
HETATM   26  C   UNL     1       2.230   0.371  -1.552  1.00  0.00           C  
HETATM   27  C   UNL     1       3.469  -0.108  -1.176  1.00  0.00           C  
HETATM   28  C   UNL     1       3.929   0.097   0.112  1.00  0.00           C  
HETATM   29  C   UNL     1       5.282  -0.428   0.519  1.00  0.00           C  
HETATM   30  C   UNL     1       6.346   0.637   0.243  1.00  0.00           C  
HETATM   31  F   UNL     1       6.053   1.791   0.977  1.00  0.00           F  
HETATM   32  F   UNL     1       7.602   0.150   0.621  1.00  0.00           F  
HETATM   33  F   UNL     1       6.356   0.943  -1.122  1.00  0.00           F  
HETATM   34  C   UNL     1       5.271  -0.762   2.012  1.00  0.00           C  
HETATM   35  O   UNL     1       5.582  -1.606  -0.231  1.00  0.00           O  
HETATM   36  H   UNL     1      -1.501  -3.037   1.479  1.00  0.00           H  
HETATM   37  H   UNL     1       0.165  -3.627   1.690  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.170  -1.879   1.714  1.00  0.00           H  
HETATM   39  H   UNL     1       0.774  -2.427  -0.457  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.236  -4.132  -1.918  1.00  0.00           H  
HETATM   41  H   UNL     1       0.238  -4.870  -0.369  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.626  -3.649  -2.279  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.764  -4.063  -0.973  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.284  -1.608  -1.071  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.773  -2.335   0.473  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.923  -0.136   0.158  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.190  -0.474   0.388  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.154  -0.101  -2.271  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.737   1.635  -2.956  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.655   0.247  -2.319  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.110   2.221   2.132  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.398   0.636   4.104  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.698  -1.476   3.565  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.474   3.715  -1.150  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.258   3.399   0.421  1.00  0.00           H  
HETATM   56  H   UNL     1       0.244   3.044   0.459  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.686   1.590   0.896  1.00  0.00           H  
HETATM   58  H   UNL     1       1.298   1.789   1.375  1.00  0.00           H  
HETATM   59  H   UNL     1       3.509   0.930   2.035  1.00  0.00           H  
HETATM   60  H   UNL     1       1.871   0.211  -2.558  1.00  0.00           H  
HETATM   61  H   UNL     1       4.079  -0.643  -1.888  1.00  0.00           H  
HETATM   62  H   UNL     1       4.513  -1.520   2.209  1.00  0.00           H  
HETATM   63  H   UNL     1       6.250  -1.141   2.306  1.00  0.00           H  
HETATM   64  H   UNL     1       5.043   0.137   2.584  1.00  0.00           H  
HETATM   65  H   UNL     1       5.605  -1.468  -1.188  1.00  0.00           H  
CONECT    1    2   36   37   38                                       
CONECT    2    3    1    7   39                                       
CONECT    3    4    2   40   41                                       
CONECT    4    5    3                                                 
CONECT    5    4    6   42   43                                       
CONECT    6    5    7   44   45                                       
CONECT    7    6    2    8                                            
CONECT    8    7    9   46   47                                       
CONECT    9    8   10   22   48                                       
CONECT   10   11    9   49   50                                       
CONECT   11   12   10   20                                            
CONECT   12   14   14   13   13                                       
CONECT   12   15   11                                                 
CONECT   13   12   12                                                 
CONECT   14   12   12                                                 
CONECT   15   16   16   12   19                                       
CONECT   16   15   15   17   51                                       
CONECT   17   16   18   18   52                                       
CONECT   18   17   17   19   53                                       
CONECT   19   15   18                                                 
CONECT   20   11   21   54   55                                       
CONECT   21   20   22   56   57                                       
CONECT   22    9   21   23                                            
CONECT   23   22   26   26   24                                       
CONECT   24   23   25   25   58                                       
CONECT   25   24   24   28   59                                       
CONECT   26   23   23   27   60                                       
CONECT   27   26   28   28   61                                       
CONECT   28   27   27   25   29                                       
CONECT   29   28   35   34   30                                       
CONECT   30   29   33   31   32                                       
CONECT   31   30                                                      
CONECT   32   30                                                      
CONECT   33   30                                                      
CONECT   34   29   62   63   64                                       
CONECT   35   29   65                                                 
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    8                                                      
CONECT   47    8                                                      
CONECT   48    9                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   34                                                      
CONECT   63   34                                                      
CONECT   64   34                                                      
CONECT   65   35                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
