COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       7.198  -0.875  -0.592  1.00  0.00           N  
HETATM    2  N   UNL     1      -0.602   1.194   0.253  1.00  0.00           N  
HETATM    3  C   UNL     1       9.322  -2.086  -0.407  1.00  0.00           C  
HETATM    4  C   UNL     1      10.641  -2.144   0.368  1.00  0.00           C  
HETATM    5  C   UNL     1       6.272   0.085   0.024  1.00  0.00           C  
HETATM    6  C   UNL     1       4.931  -0.003  -0.658  1.00  0.00           C  
HETATM    7  C   UNL     1      11.556  -3.196  -0.262  1.00  0.00           C  
HETATM    8  C   UNL     1       1.650   1.706  -0.279  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.680   1.179  -0.974  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.708   0.475   0.110  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.695  -0.983   0.516  1.00  0.00           C  
HETATM   12  C   UNL     1     -13.150  -2.601   0.571  1.00  0.00           C  
HETATM   13  C   UNL     1      -8.392   0.928  -0.454  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.037   1.200  -0.440  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.640   0.478   1.330  1.00  0.00           C  
HETATM   16  C   UNL     1       7.489  -0.508  -1.984  1.00  0.00           C  
HETATM   17  C   UNL     1      10.517   0.190   0.905  1.00  0.00           C  
HETATM   18  O   UNL     1      11.254   1.412   0.824  1.00  0.00           O  
HETATM   19  C   UNL     1       9.192   0.342   0.152  1.00  0.00           C  
HETATM   20  N   UNL     1       3.918   0.791  -0.257  1.00  0.00           N  
HETATM   21  O   UNL     1      11.279  -0.866   0.317  1.00  0.00           O  
HETATM   22  C   UNL     1       8.436  -0.989   0.192  1.00  0.00           C  
HETATM   23  O   UNL     1       8.404   1.359   0.774  1.00  0.00           O  
HETATM   24  N   UNL     1      -7.990  -1.207   0.481  1.00  0.00           N  
HETATM   25  O   UNL     1       1.454   1.394   1.130  1.00  0.00           O  
HETATM   26  N   UNL     1     -10.873  -1.716   0.416  1.00  0.00           N  
HETATM   27  O   UNL     1      -0.275   0.825   2.446  1.00  0.00           O  
HETATM   28  N   UNL     1     -12.144  -1.588   0.243  1.00  0.00           N  
HETATM   29  O   UNL     1       4.763  -0.788  -1.567  1.00  0.00           O  
HETATM   30  N   UNL     1     -12.390  -0.430  -0.263  1.00  0.00           N  
HETATM   31  N   UNL     1     -11.278   0.203  -0.423  1.00  0.00           N  
HETATM   32  C   UNL     1       2.615   0.706  -0.920  1.00  0.00           C  
HETATM   33  C   UNL     1       0.242   1.571  -0.891  1.00  0.00           C  
HETATM   34  C   UNL     1      -1.978   0.950   0.203  1.00  0.00           C  
HETATM   35  C   UNL     1      -4.040   0.943  -1.024  1.00  0.00           C  
HETATM   36  C   UNL     1      -6.168   0.226   0.061  1.00  0.00           C  
HETATM   37  C   UNL     1      -8.843  -0.303   0.017  1.00  0.00           C  
HETATM   38  C   UNL     1     -10.296  -0.604   0.006  1.00  0.00           C  
HETATM   39  C   UNL     1      -3.999   0.246   1.288  1.00  0.00           C  
HETATM   40  C   UNL     1       0.163   1.118   1.351  1.00  0.00           C  
HETATM   41  F   UNL     1      -4.723   1.166  -2.168  1.00  0.00           F  
HETATM   42  H   UNL     1       9.524  -1.860  -1.454  1.00  0.00           H  
HETATM   43  H   UNL     1       8.812  -3.046  -0.333  1.00  0.00           H  
HETATM   44  H   UNL     1      10.442  -2.410   1.406  1.00  0.00           H  
HETATM   45  H   UNL     1       6.158  -0.147   1.082  1.00  0.00           H  
HETATM   46  H   UNL     1       6.670   1.094  -0.086  1.00  0.00           H  
HETATM   47  H   UNL     1      11.755  -2.930  -1.300  1.00  0.00           H  
HETATM   48  H   UNL     1      12.495  -3.238   0.289  1.00  0.00           H  
HETATM   49  H   UNL     1      11.069  -4.171  -0.224  1.00  0.00           H  
HETATM   50  H   UNL     1       2.022   2.723  -0.398  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.163   1.545  -1.848  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.032  -1.742   0.905  1.00  0.00           H  
HETATM   53  H   UNL     1     -13.311  -3.246  -0.292  1.00  0.00           H  
HETATM   54  H   UNL     1     -12.802  -3.200   1.412  1.00  0.00           H  
HETATM   55  H   UNL     1     -14.086  -2.110   0.838  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.092   1.658  -0.835  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.658   2.142  -0.808  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.091   0.301   2.243  1.00  0.00           H  
HETATM   59  H   UNL     1       7.943   0.483  -2.011  1.00  0.00           H  
HETATM   60  H   UNL     1       8.177  -1.235  -2.415  1.00  0.00           H  
HETATM   61  H   UNL     1       6.563  -0.498  -2.558  1.00  0.00           H  
HETATM   62  H   UNL     1      10.316  -0.045   1.950  1.00  0.00           H  
HETATM   63  H   UNL     1      12.106   1.388   1.280  1.00  0.00           H  
HETATM   64  H   UNL     1       9.391   0.618  -0.883  1.00  0.00           H  
HETATM   65  H   UNL     1       4.053   1.419   0.469  1.00  0.00           H  
HETATM   66  H   UNL     1       8.193  -1.240   1.225  1.00  0.00           H  
HETATM   67  H   UNL     1       8.825   2.229   0.789  1.00  0.00           H  
HETATM   68  H   UNL     1       2.217  -0.303  -0.811  1.00  0.00           H  
HETATM   69  H   UNL     1       2.729   0.938  -1.979  1.00  0.00           H  
HETATM   70  H   UNL     1       0.228   0.789  -1.651  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.085   2.521  -1.312  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.513  -0.116   2.166  1.00  0.00           H  
CONECT    1   22   16    5                                            
CONECT    2   34   40   33                                            
CONECT    3    4   22   42   43                                       
CONECT    4   21    7    3   44                                       
CONECT    5    1    6   45   46                                       
CONECT    6    5   29   29   20                                       
CONECT    7    4   47   48   49                                       
CONECT    8   33   32   25   50                                       
CONECT    9   35   35   34   51                                       
CONECT   10   36   39   39   35                                       
CONECT   11   24   24   36   52                                       
CONECT   12   28   53   54   55                                       
CONECT   13   37   37   14   56                                       
CONECT   14   13   36   36   57                                       
CONECT   15   39   34   34   58                                       
CONECT   16    1   59   60   61                                       
CONECT   17   18   21   19   62                                       
CONECT   18   17   63                                                 
CONECT   19   17   23   22   64                                       
CONECT   20    6   32   65                                            
CONECT   21   17    4                                                 
CONECT   22   19    3    1   66                                       
CONECT   23   19   67                                                 
CONECT   24   37   11   11                                            
CONECT   25   40    8                                                 
CONECT   26   28   38   38                                            
CONECT   27   40   40                                                 
CONECT   28   12   30   26                                            
CONECT   29    6    6                                                 
CONECT   30   28   31   31                                            
CONECT   31   30   30   38                                            
CONECT   32   20    8   68   69                                       
CONECT   33    2    8   70   71                                       
CONECT   34   15   15    9    2                                       
CONECT   35   10   41    9    9                                       
CONECT   36   14   14   11   10                                       
CONECT   37   38   13   13   24                                       
CONECT   38   26   26   31   37                                       
CONECT   39   10   10   15   72                                       
CONECT   40    2   27   27   25                                       
CONECT   41   35                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   12                                                      
CONECT   55   12                                                      
CONECT   56   13                                                      
CONECT   57   14                                                      
CONECT   58   15                                                      
CONECT   59   16                                                      
CONECT   60   16                                                      
CONECT   61   16                                                      
CONECT   62   17                                                      
CONECT   63   18                                                      
CONECT   64   19                                                      
CONECT   65   20                                                      
CONECT   66   22                                                      
CONECT   67   23                                                      
CONECT   68   32                                                      
CONECT   69   32                                                      
CONECT   70   33                                                      
CONECT   71   33                                                      
CONECT   72   39                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
