COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.931   3.574   3.301  1.00  0.00           C  
HETATM    2  N   UNL     1       5.244   2.635   2.412  1.00  0.00           N  
HETATM    3  C   UNL     1       5.821   2.274   1.207  1.00  0.00           C  
HETATM    4  N   UNL     1       5.186   1.423   0.416  1.00  0.00           N  
HETATM    5  N   UNL     1       6.994   2.793   0.872  1.00  0.00           N  
HETATM    6  C   UNL     1       7.579   2.473  -0.272  1.00  0.00           C  
HETATM    7  C   UNL     1       6.954   1.583  -1.127  1.00  0.00           C  
HETATM    8  C   UNL     1       5.715   1.056  -0.749  1.00  0.00           C  
HETATM    9  C   UNL     1       5.002   0.105  -1.633  1.00  0.00           C  
HETATM   10  C   UNL     1       5.556  -0.281  -2.855  1.00  0.00           C  
HETATM   11  C   UNL     1       4.850  -1.174  -3.645  1.00  0.00           C  
HETATM   12  C   UNL     1       3.630  -1.653  -3.205  1.00  0.00           C  
HETATM   13  N   UNL     1       3.127  -1.274  -2.046  1.00  0.00           N  
HETATM   14  C   UNL     1       3.763  -0.429  -1.253  1.00  0.00           C  
HETATM   15  O   UNL     1       3.211  -0.071  -0.068  1.00  0.00           O  
HETATM   16  C   UNL     1       1.963  -0.527   0.217  1.00  0.00           C  
HETATM   17  C   UNL     1       0.877   0.277   0.015  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.410  -0.171   0.300  1.00  0.00           C  
HETATM   19  C   UNL     1       1.785  -1.833   0.718  1.00  0.00           C  
HETATM   20  C   UNL     1       2.881  -2.685   0.932  1.00  0.00           C  
HETATM   21  C   UNL     1       2.673  -3.941   1.417  1.00  0.00           C  
HETATM   22  C   UNL     1       1.388  -4.394   1.705  1.00  0.00           C  
HETATM   23  C   UNL     1       0.303  -3.595   1.509  1.00  0.00           C  
HETATM   24  C   UNL     1       0.478  -2.295   1.011  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.623  -1.439   0.796  1.00  0.00           C  
HETATM   26  N   UNL     1      -1.920  -1.875   1.078  1.00  0.00           N  
HETATM   27  C   UNL     1      -3.004  -1.121   0.679  1.00  0.00           C  
HETATM   28  N   UNL     1      -4.305  -1.383   1.003  1.00  0.00           N  
HETATM   29  C   UNL     1      -5.081  -0.400   0.413  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.442  -0.138   0.384  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.917   0.954  -0.313  1.00  0.00           C  
HETATM   32  C   UNL     1      -8.397   1.237  -0.343  1.00  0.00           C  
HETATM   33  F   UNL     1      -8.735   2.068   0.730  1.00  0.00           F  
HETATM   34  F   UNL     1      -8.725   1.872  -1.546  1.00  0.00           F  
HETATM   35  F   UNL     1      -9.104   0.034  -0.243  1.00  0.00           F  
HETATM   36  C   UNL     1      -6.041   1.794  -0.985  1.00  0.00           C  
HETATM   37  C   UNL     1      -4.686   1.548  -0.968  1.00  0.00           C  
HETATM   38  C   UNL     1      -4.189   0.447  -0.267  1.00  0.00           C  
HETATM   39  N   UNL     1      -2.938  -0.043  -0.062  1.00  0.00           N  
HETATM   40  H   UNL     1       6.077   4.523   2.784  1.00  0.00           H  
HETATM   41  H   UNL     1       5.328   3.736   4.194  1.00  0.00           H  
HETATM   42  H   UNL     1       6.899   3.163   3.586  1.00  0.00           H  
HETATM   43  H   UNL     1       4.384   2.266   2.667  1.00  0.00           H  
HETATM   44  H   UNL     1       8.535   2.902  -0.535  1.00  0.00           H  
HETATM   45  H   UNL     1       7.410   1.306  -2.066  1.00  0.00           H  
HETATM   46  H   UNL     1       6.510   0.107  -3.177  1.00  0.00           H  
HETATM   47  H   UNL     1       5.249  -1.493  -4.596  1.00  0.00           H  
HETATM   48  H   UNL     1       3.080  -2.349  -3.821  1.00  0.00           H  
HETATM   49  H   UNL     1       1.019   1.275  -0.372  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.252   0.484   0.132  1.00  0.00           H  
HETATM   51  H   UNL     1       3.882  -2.347   0.713  1.00  0.00           H  
HETATM   52  H   UNL     1       3.517  -4.594   1.581  1.00  0.00           H  
HETATM   53  H   UNL     1       1.250  -5.395   2.088  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.688  -3.960   1.736  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.058  -2.709   1.555  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.625  -2.122   1.544  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.129  -0.788   0.905  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.425   2.645  -1.527  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.010   2.206  -1.494  1.00  0.00           H  
CONECT    1    2   40   41   42                                       
CONECT    2    1    3   43                                            
CONECT    3    2    4    4    5                                       
CONECT    4    3    3    8                                            
CONECT    5    3    6    6                                            
CONECT    6    5    5    7   44                                       
CONECT    7    6    8    8   45                                       
CONECT    8    4    7    7    9                                       
CONECT    9    8   10   10   14                                       
CONECT   10    9    9   11   46                                       
CONECT   11   10   12   12   47                                       
CONECT   12   11   11   13   48                                       
CONECT   13   12   14   14                                            
CONECT   14    9   13   13   15                                       
CONECT   15   14   16                                                 
CONECT   16   15   17   17   19                                       
CONECT   17   16   16   18   49                                       
CONECT   18   17   25   25   50                                       
CONECT   19   16   20   20   24                                       
CONECT   20   19   19   21   51                                       
CONECT   21   20   22   22   52                                       
CONECT   22   21   21   23   53                                       
CONECT   23   22   24   24   54                                       
CONECT   24   19   23   23   25                                       
CONECT   25   18   18   24   26                                       
CONECT   26   25   27   55                                            
CONECT   27   26   28   39   39                                       
CONECT   28   27   29   56                                            
CONECT   29   28   30   30   38                                       
CONECT   30   29   29   31   57                                       
CONECT   31   30   32   36   36                                       
CONECT   32   31   33   34   35                                       
CONECT   33   32                                                      
CONECT   34   32                                                      
CONECT   35   32                                                      
CONECT   36   31   31   37   58                                       
CONECT   37   36   38   38   59                                       
CONECT   38   29   37   37   39                                       
CONECT   39   27   27   38                                            
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   26                                                      
CONECT   56   28                                                      
CONECT   57   30                                                      
CONECT   58   36                                                      
CONECT   59   37                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
