COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.075   1.007  -0.491  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.074   0.334  -1.199  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.322   0.903  -1.335  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.587   2.142  -0.771  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.599   2.815  -0.068  1.00  0.00           C  
HETATM    6  C   UNL     1       0.969  -1.130   0.837  1.00  0.00           C  
HETATM    7  C   UNL     1       1.419  -2.194   1.619  1.00  0.00           C  
HETATM    8  C   UNL     1       2.727  -2.224   2.063  1.00  0.00           C  
HETATM    9  C   UNL     1       3.596  -1.203   1.737  1.00  0.00           C  
HETATM   10  C   UNL     1       3.157  -0.132   0.955  1.00  0.00           C  
HETATM   11  C   UNL     1       8.030   0.733  -2.135  1.00  0.00           C  
HETATM   12  O   UNL     1      -4.362  -0.785  -0.844  1.00  0.00           O  
HETATM   13  C   UNL     1      -4.738   0.404  -0.343  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.672   0.974   0.333  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.563   0.007   0.207  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.076  -1.064  -0.542  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.247  -0.012   0.657  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.436  -1.100   0.363  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.949  -2.171  -0.386  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.258  -2.149  -0.832  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.649   2.266   1.027  1.00  0.00           C  
HETATM   22  O   UNL     1      -3.951   2.330   2.204  1.00  0.00           O  
HETATM   23  N   UNL     1      -3.294   3.383   0.360  1.00  0.00           N  
HETATM   24  C   UNL     1      -6.346   2.258   0.071  1.00  0.00           C  
HETATM   25  F   UNL     1      -9.812   2.695  -0.906  1.00  0.00           F  
HETATM   26  C   UNL     1       1.838  -0.094   0.509  1.00  0.00           C  
HETATM   27  C   UNL     1       4.089   0.962   0.606  1.00  0.00           C  
HETATM   28  N   UNL     1       5.363   0.927   1.044  1.00  0.00           N  
HETATM   29  O   UNL     1       3.706   1.893  -0.075  1.00  0.00           O  
HETATM   30  C   UNL     1       6.256   2.060   0.790  1.00  0.00           C  
HETATM   31  C   UNL     1       7.032   2.000  -0.500  1.00  0.00           C  
HETATM   32  C   UNL     1       6.941   2.704   1.998  1.00  0.00           C  
HETATM   33  C   UNL     1       5.806   3.438   1.281  1.00  0.00           C  
HETATM   34  N   UNL     1       7.350   0.825  -1.004  1.00  0.00           N  
HETATM   35  C   UNL     1       8.414   1.895  -2.787  1.00  0.00           C  
HETATM   36  C   UNL     1       8.067   3.112  -2.223  1.00  0.00           C  
HETATM   37  N   UNL     1       7.385   3.125  -1.089  1.00  0.00           N  
HETATM   38  N   UNL     1      -0.134  -3.264  -0.682  1.00  0.00           N  
HETATM   39  S   UNL     1      -0.168  -4.608   0.284  1.00  0.00           S  
HETATM   40  O   UNL     1       1.171  -5.084   0.270  1.00  0.00           O  
HETATM   41  O   UNL     1      -0.773  -4.159   1.488  1.00  0.00           O  
HETATM   42  C   UNL     1      -1.263  -5.763  -0.586  1.00  0.00           C  
HETATM   43  C   UNL     1      -3.272   4.674   1.053  1.00  0.00           C  
HETATM   44  C   UNL     1       0.753  -3.221  -1.848  1.00  0.00           C  
HETATM   45  C   UNL     1       2.065  -2.532  -1.466  1.00  0.00           C  
HETATM   46  H   UNL     1      -6.869  -0.631  -1.640  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.095   0.384  -1.882  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.811   3.780   0.369  1.00  0.00           H  
HETATM   49  H   UNL     1       0.743  -2.996   1.877  1.00  0.00           H  
HETATM   50  H   UNL     1       3.070  -3.050   2.668  1.00  0.00           H  
HETATM   51  H   UNL     1       4.617  -1.232   2.088  1.00  0.00           H  
HETATM   52  H   UNL     1       8.286  -0.234  -2.543  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.858   0.815   1.233  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.645  -2.977  -1.407  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.053   3.332  -0.578  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.578   2.783   0.618  1.00  0.00           H  
HETATM   57  H   UNL     1       1.493   0.731  -0.097  1.00  0.00           H  
HETATM   58  H   UNL     1       5.689   0.151   1.526  1.00  0.00           H  
HETATM   59  H   UNL     1       6.727   2.284   2.981  1.00  0.00           H  
HETATM   60  H   UNL     1       7.953   3.084   1.859  1.00  0.00           H  
HETATM   61  H   UNL     1       6.071   4.301   0.670  1.00  0.00           H  
HETATM   62  H   UNL     1       4.845   3.501   1.792  1.00  0.00           H  
HETATM   63  H   UNL     1       8.970   1.852  -3.711  1.00  0.00           H  
HETATM   64  H   UNL     1       8.350   4.038  -2.703  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.344  -6.688  -0.014  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.250  -5.315  -0.695  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.852  -5.981  -1.572  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.963   5.454   0.358  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.268   4.899   1.433  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.568   4.628   1.884  1.00  0.00           H  
HETATM   71  H   UNL     1       0.961  -4.237  -2.183  1.00  0.00           H  
HETATM   72  H   UNL     1       0.270  -2.665  -2.651  1.00  0.00           H  
HETATM   73  H   UNL     1       2.724  -2.501  -2.333  1.00  0.00           H  
HETATM   74  H   UNL     1       1.857  -1.516  -1.131  1.00  0.00           H  
HETATM   75  H   UNL     1       2.547  -3.089  -0.663  1.00  0.00           H  
CONECT    1   24   13    2    2                                       
CONECT    2    1    1    3   46                                       
CONECT    3    4    4    2   47                                       
CONECT    4    5   25    3    3                                       
CONECT    5   24   24    4   48                                       
CONECT    6   26   18    7    7                                       
CONECT    7    6    6    8   49                                       
CONECT    8    9    9    7   50                                       
CONECT    9   10    8    8   51                                       
CONECT   10   27   26   26    9                                       
CONECT   11   35   34   34   52                                       
CONECT   12   16   13                                                 
CONECT   13   12    1   14   14                                       
CONECT   14   15   13   13   21                                       
CONECT   15   16   16   17   14                                       
CONECT   16   20   12   15   15                                       
CONECT   17   18   18   15   53                                       
CONECT   18   19    6   17   17                                       
CONECT   19   38   20   20   18                                       
CONECT   20   19   19   16   54                                       
CONECT   21   14   22   22   23                                       
CONECT   22   21   21                                                 
CONECT   23   21   43   55                                            
CONECT   24    5    5    1   56                                       
CONECT   25    4                                                      
CONECT   26   10   10    6   57                                       
CONECT   27   28   29   29   10                                       
CONECT   28   30   27   58                                            
CONECT   29   27   27                                                 
CONECT   30   32   31   33   28                                       
CONECT   31   37   37   34   30                                       
CONECT   32   30   33   59   60                                       
CONECT   33   32   30   61   62                                       
CONECT   34   11   11   31                                            
CONECT   35   36   36   11   63                                       
CONECT   36   35   35   37   64                                       
CONECT   37   36   31   31                                            
CONECT   38   39   44   19                                            
CONECT   39   42   41   41   40                                       
CONECT   39   40   38                                                 
CONECT   40   39   39                                                 
CONECT   41   39   39                                                 
CONECT   42   39   65   66   67                                       
CONECT   43   23   68   69   70                                       
CONECT   44   38   45   71   72                                       
CONECT   45   44   73   74   75                                       
CONECT   46    2                                                      
CONECT   47    3                                                      
CONECT   48    5                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   11                                                      
CONECT   53   17                                                      
CONECT   54   20                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   26                                                      
CONECT   58   28                                                      
CONECT   59   32                                                      
CONECT   60   32                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
CONECT   63   35                                                      
CONECT   64   36                                                      
CONECT   65   42                                                      
CONECT   66   42                                                      
CONECT   67   42                                                      
CONECT   68   43                                                      
CONECT   69   43                                                      
CONECT   70   43                                                      
CONECT   71   44                                                      
CONECT   72   44                                                      
CONECT   73   45                                                      
CONECT   74   45                                                      
CONECT   75   45                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
