COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.700   0.437  -2.051  1.00  0.00           C  
HETATM    2  C   UNL     1       3.909   0.743   2.288  1.00  0.00           C  
HETATM    3  C   UNL     1       5.059   1.472   2.532  1.00  0.00           C  
HETATM    4  C   UNL     1       1.201  -2.321   0.238  1.00  0.00           C  
HETATM    5  C   UNL     1       3.835   1.130  -1.521  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.060  -1.710   0.239  1.00  0.00           C  
HETATM    7  C   UNL     1       4.149   1.175  -0.094  1.00  0.00           C  
HETATM    8  C   UNL     1       3.447   0.585   0.991  1.00  0.00           C  
HETATM    9  C   UNL     1       2.219  -0.202   0.735  1.00  0.00           C  
HETATM   10  C   UNL     1       2.315  -1.579   0.482  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.172  -0.320   0.487  1.00  0.00           C  
HETATM   12  C   UNL     1       5.749   2.050   1.488  1.00  0.00           C  
HETATM   13  C   UNL     1       0.984   0.432   0.730  1.00  0.00           C  
HETATM   14  C   UNL     1       5.300   1.910   0.169  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.246  -2.444  -0.004  1.00  0.00           C  
HETATM   16  C   UNL     1       4.725   1.809  -2.302  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.462  -0.491   0.249  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.003   2.357   2.710  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.598  -2.733   0.535  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.479  -2.458  -0.979  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.991   1.320   1.557  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.774   1.766  -0.909  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.911  -4.545   0.796  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.720  -4.110  -1.594  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.058   3.693   1.929  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.850   4.122  -0.438  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.418  -4.264   0.674  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.236  -3.847  -1.613  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.623   3.140  -1.614  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.144   2.019   0.475  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.699   1.518   0.512  1.00  0.00           C  
HETATM   32  C   UNL     1       3.667  -2.244   0.480  1.00  0.00           C  
HETATM   33  N   UNL     1       1.799  -0.113  -2.471  1.00  0.00           N  
HETATM   34  N   UNL     1      -1.392   0.242   0.481  1.00  0.00           N  
HETATM   35  N   UNL     1      -2.402  -1.796   0.012  1.00  0.00           N  
HETATM   36  N   UNL     1      -1.199  -3.800  -0.252  1.00  0.00           N  
HETATM   37  N   UNL     1       4.642   1.911  -3.674  1.00  0.00           N  
HETATM   38  N   UNL     1      -3.854  -4.799  -0.645  1.00  0.00           N  
HETATM   39  N   UNL     1      -5.218   3.473   0.732  1.00  0.00           N  
HETATM   40  O   UNL     1      -3.674   0.113   0.253  1.00  0.00           O  
HETATM   41  F   UNL     1       6.871   2.760   1.741  1.00  0.00           F  
HETATM   42  F   UNL     1       0.897   1.758   0.975  1.00  0.00           F  
HETATM   43  F   UNL     1      -6.600   3.306  -2.601  1.00  0.00           F  
HETATM   44  F   UNL     1       4.267  -2.082   1.733  1.00  0.00           F  
HETATM   45  F   UNL     1       3.516  -3.608   0.207  1.00  0.00           F  
HETATM   46  F   UNL     1       4.473  -1.658  -0.502  1.00  0.00           F  
HETATM   47  S   UNL     1       5.985   2.536  -1.326  1.00  0.00           S  
HETATM   48  H   UNL     1       3.372   0.292   3.109  1.00  0.00           H  
HETATM   49  H   UNL     1       5.417   1.588   3.545  1.00  0.00           H  
HETATM   50  H   UNL     1       1.288  -3.381   0.049  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.887   2.235   3.336  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.093   2.289   3.306  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.814  -2.207   1.080  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.580  -2.432   0.900  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.403  -2.023  -1.360  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.637  -1.794  -1.179  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.518   0.392   1.877  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.003   1.132   1.196  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.826   1.497  -0.810  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.228   0.993  -1.449  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.558  -4.224   1.776  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.728  -5.613   0.674  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.532  -5.158  -1.826  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.228  -3.477  -2.332  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.083   3.919   1.636  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.651   4.503   2.535  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.370   5.078  -0.646  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.916   4.264  -0.264  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.985  -4.675   1.509  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.656  -3.926  -2.616  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.623   3.256  -2.033  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.115   2.038  -0.248  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.271   1.714   1.495  1.00  0.00           H  
HETATM   74  H   UNL     1       5.313   2.412  -4.164  1.00  0.00           H  
HETATM   75  H   UNL     1       3.914   1.481  -4.149  1.00  0.00           H  
HETATM   76  H   UNL     1      -4.860  -4.792  -0.723  1.00  0.00           H  
CONECT    1    5   33   33   33                                       
CONECT    2    8    8    3   48                                       
CONECT    3   12   12    2   49                                       
CONECT    4   10   10    6   50                                       
CONECT    5   16   16    1    7                                       
CONECT    6    4   15   15   11                                       
CONECT    7    5   14   14    8                                       
CONECT    8    7    9    2    2                                       
CONECT    9   10    8   13   13                                       
CONECT   10   32    4    4    9                                       
CONECT   11    6   13   34   34                                       
CONECT   12   14   41    3    3                                       
CONECT   13    9    9   11   42                                       
CONECT   14   47    7    7   12                                       
CONECT   15   36    6    6   35                                       
CONECT   16   37   47    5    5                                       
CONECT   17   35   35   34   40                                       
CONECT   18   25   21   51   52                                       
CONECT   19   27   20   53   54                                       
CONECT   20   28   19   55   56                                       
CONECT   21   18   30   57   58                                       
CONECT   22   30   29   59   60                                       
CONECT   23   36   27   61   62                                       
CONECT   24   36   28   63   64                                       
CONECT   25   39   18   65   66                                       
CONECT   26   39   29   67   68                                       
CONECT   27   38   23   19   69                                       
CONECT   28   24   38   20   70                                       
CONECT   29   26   22   43   71                                       
CONECT   30   31   39   21   22                                       
CONECT   31   40   30   72   73                                       
CONECT   32   46   44   45   10                                       
CONECT   33    1    1    1                                            
CONECT   34   11   11   17                                            
CONECT   35   15   17   17                                            
CONECT   36   24   23   15                                            
CONECT   37   16   74   75                                            
CONECT   38   28   27   76                                            
CONECT   39   25   30   26                                            
CONECT   40   17   31                                                 
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   29                                                      
CONECT   44   32                                                      
CONECT   45   32                                                      
CONECT   46   32                                                      
CONECT   47   16   14                                                 
CONECT   48    2                                                      
CONECT   49    3                                                      
CONECT   50    4                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   25                                                      
CONECT   67   26                                                      
CONECT   68   26                                                      
CONECT   69   27                                                      
CONECT   70   28                                                      
CONECT   71   29                                                      
CONECT   72   31                                                      
CONECT   73   31                                                      
CONECT   74   37                                                      
CONECT   75   37                                                      
CONECT   76   38                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
