COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.119   3.018  -0.330  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.414   1.408  -0.912  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.553   1.143  -0.815  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.459   2.712  -0.210  1.00  0.00           C  
HETATM    5  C   UNL     1       1.127   2.700  -1.387  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.336   2.360  -1.262  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.890   1.392  -2.081  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.228   1.075  -1.973  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.024   1.732  -1.030  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.943   0.819  -0.696  1.00  0.00           C  
HETATM   11  C   UNL     1      -9.632   0.194  -0.467  1.00  0.00           C  
HETATM   12  C   UNL     1      -8.849  -0.464  -1.399  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.509  -0.158  -1.519  1.00  0.00           C  
HETATM   14  C   UNL     1     -11.096  -0.143  -0.347  1.00  0.00           C  
HETATM   15  C   UNL     1      -9.077   1.159   0.355  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.739   1.476   0.246  1.00  0.00           C  
HETATM   17  N   UNL     1       1.905   1.843  -0.489  1.00  0.00           N  
HETATM   18  C   UNL     1       3.246   1.970  -0.431  1.00  0.00           C  
HETATM   19  O   UNL     1       3.807   2.793  -1.122  1.00  0.00           O  
HETATM   20  C   UNL     1       4.047   1.088   0.492  1.00  0.00           C  
HETATM   21  N   UNL     1       5.264   1.787   0.941  1.00  0.00           N  
HETATM   22  C   UNL     1       6.362   0.813   1.027  1.00  0.00           C  
HETATM   23  C   UNL     1       5.799  -0.553   0.584  1.00  0.00           C  
HETATM   24  C   UNL     1       4.560  -0.161  -0.267  1.00  0.00           C  
HETATM   25  N   UNL     1       6.778  -1.279  -0.229  1.00  0.00           N  
HETATM   26  C   UNL     1       7.709  -2.050   0.366  1.00  0.00           C  
HETATM   27  O   UNL     1       7.737  -2.142   1.576  1.00  0.00           O  
HETATM   28  C   UNL     1       8.717  -2.796  -0.470  1.00  0.00           C  
HETATM   29  N   UNL     1       9.843  -3.270   0.376  1.00  0.00           N  
HETATM   30  C   UNL     1      10.435  -4.390  -0.399  1.00  0.00           C  
HETATM   31  C   UNL     1       9.221  -5.135  -0.996  1.00  0.00           C  
HETATM   32  C   UNL     1       8.091  -4.086  -1.043  1.00  0.00           C  
HETATM   33  F   UNL     1       8.856  -6.206  -0.174  1.00  0.00           F  
HETATM   34  C   UNL     1       5.356   3.101   1.224  1.00  0.00           C  
HETATM   35  O   UNL     1       4.362   3.796   1.209  1.00  0.00           O  
HETATM   36  C   UNL     1       6.694   3.708   1.561  1.00  0.00           C  
HETATM   37  C   UNL     1       7.300   4.685   0.551  1.00  0.00           C  
HETATM   38  C   UNL     1       6.732   5.205   1.873  1.00  0.00           C  
HETATM   39  N   UNL     1     -11.271  -1.224   0.632  1.00  0.00           N  
HETATM   40  C   UNL     1     -10.670  -2.475   0.147  1.00  0.00           C  
HETATM   41  C   UNL     1     -10.822  -3.557   1.220  1.00  0.00           C  
HETATM   42  O   UNL     1     -12.207  -3.711   1.542  1.00  0.00           O  
HETATM   43  C   UNL     1     -12.824  -2.511   2.018  1.00  0.00           C  
HETATM   44  C   UNL     1     -12.692  -1.419   0.953  1.00  0.00           C  
HETATM   45  H   UNL     1      -0.681   3.776   0.303  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.069   3.228   0.515  1.00  0.00           H  
HETATM   47  H   UNL     1       1.451   2.540  -2.415  1.00  0.00           H  
HETATM   48  H   UNL     1       1.281   3.745  -1.116  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.273   0.883  -2.807  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.659   0.319  -2.613  1.00  0.00           H  
HETATM   51  H   UNL     1      -9.288  -1.217  -2.037  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.899  -0.672  -2.247  1.00  0.00           H  
HETATM   53  H   UNL     1     -11.645   0.739  -0.016  1.00  0.00           H  
HETATM   54  H   UNL     1     -11.476  -0.465  -1.316  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.694   1.669   1.079  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.307   2.229   0.889  1.00  0.00           H  
HETATM   57  H   UNL     1       1.456   1.185   0.063  1.00  0.00           H  
HETATM   58  H   UNL     1       3.443   0.790   1.349  1.00  0.00           H  
HETATM   59  H   UNL     1       7.175   1.111   0.365  1.00  0.00           H  
HETATM   60  H   UNL     1       6.724   0.752   2.053  1.00  0.00           H  
HETATM   61  H   UNL     1       5.499  -1.146   1.448  1.00  0.00           H  
HETATM   62  H   UNL     1       3.816  -0.957  -0.263  1.00  0.00           H  
HETATM   63  H   UNL     1       4.851   0.095  -1.286  1.00  0.00           H  
HETATM   64  H   UNL     1       6.756  -1.205  -1.196  1.00  0.00           H  
HETATM   65  H   UNL     1       9.085  -2.162  -1.276  1.00  0.00           H  
HETATM   66  H   UNL     1      10.518  -2.535   0.523  1.00  0.00           H  
HETATM   67  H   UNL     1      11.074  -4.006  -1.194  1.00  0.00           H  
HETATM   68  H   UNL     1      11.000  -5.051   0.259  1.00  0.00           H  
HETATM   69  H   UNL     1       9.452  -5.490  -2.000  1.00  0.00           H  
HETATM   70  H   UNL     1       7.252  -4.406  -0.425  1.00  0.00           H  
HETATM   71  H   UNL     1       7.766  -3.925  -2.070  1.00  0.00           H  
HETATM   72  H   UNL     1       7.379   3.062   2.109  1.00  0.00           H  
HETATM   73  H   UNL     1       8.384   4.681   0.436  1.00  0.00           H  
HETATM   74  H   UNL     1       6.732   4.889  -0.356  1.00  0.00           H  
HETATM   75  H   UNL     1       5.790   5.752   1.836  1.00  0.00           H  
HETATM   76  H   UNL     1       7.443   5.544   2.628  1.00  0.00           H  
HETATM   77  H   UNL     1     -11.176  -2.793  -0.765  1.00  0.00           H  
HETATM   78  H   UNL     1      -9.612  -2.315  -0.061  1.00  0.00           H  
HETATM   79  H   UNL     1     -10.429  -4.501   0.843  1.00  0.00           H  
HETATM   80  H   UNL     1     -10.271  -3.264   2.113  1.00  0.00           H  
HETATM   81  H   UNL     1     -13.878  -2.699   2.218  1.00  0.00           H  
HETATM   82  H   UNL     1     -12.331  -2.188   2.934  1.00  0.00           H  
HETATM   83  H   UNL     1     -13.110  -0.487   1.334  1.00  0.00           H  
HETATM   84  H   UNL     1     -13.230  -1.720   0.055  1.00  0.00           H  
CONECT    1    6    4    4   45                                       
CONECT    2    9    3    3    3                                       
CONECT    3    2    2    2   10                                       
CONECT    4    1    1    9   46                                       
CONECT    5   17    6   47   48                                       
CONECT    6    5    7    7    1                                       
CONECT    7    6    6    8   49                                       
CONECT    8    7    9    9   50                                       
CONECT    9    8    8    4    2                                       
CONECT   10    3   16   16   13                                       
CONECT   11   15   15   12   14                                       
CONECT   12   13   13   11   51                                       
CONECT   13   10   12   12   52                                       
CONECT   14   11   39   53   54                                       
CONECT   15   16   11   11   55                                       
CONECT   16   10   10   15   56                                       
CONECT   17   18    5   57                                            
CONECT   18   19   19   20   17                                       
CONECT   19   18   18                                                 
CONECT   20   24   21   18   58                                       
CONECT   21   22   20   34                                            
CONECT   22   23   21   59   60                                       
CONECT   23   25   22   24   61                                       
CONECT   24   23   20   62   63                                       
CONECT   25   26   23   64                                            
CONECT   26   28   27   27   25                                       
CONECT   27   26   26                                                 
CONECT   28   29   26   32   65                                       
CONECT   29   28   30   66                                            
CONECT   30   29   31   67   68                                       
CONECT   31   30   32   33   69                                       
CONECT   32   28   31   70   71                                       
CONECT   33   31                                                      
CONECT   34   21   35   35   36                                       
CONECT   35   34   34                                                 
CONECT   36   34   38   37   72                                       
CONECT   37   36   38   73   74                                       
CONECT   38   36   37   75   76                                       
CONECT   39   40   14   44                                            
CONECT   40   41   39   77   78                                       
CONECT   41   40   42   79   80                                       
CONECT   42   41   43                                                 
CONECT   43   42   44   81   82                                       
CONECT   44   39   43   83   84                                       
CONECT   45    1                                                      
CONECT   46    4                                                      
CONECT   47    5                                                      
CONECT   48    5                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51   12                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   16                                                      
CONECT   57   17                                                      
CONECT   58   20                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   24                                                      
CONECT   63   24                                                      
CONECT   64   25                                                      
CONECT   65   28                                                      
CONECT   66   29                                                      
CONECT   67   30                                                      
CONECT   68   30                                                      
CONECT   69   31                                                      
CONECT   70   32                                                      
CONECT   71   32                                                      
CONECT   72   36                                                      
CONECT   73   37                                                      
CONECT   74   37                                                      
CONECT   75   38                                                      
CONECT   76   38                                                      
CONECT   77   40                                                      
CONECT   78   40                                                      
CONECT   79   41                                                      
CONECT   80   41                                                      
CONECT   81   43                                                      
CONECT   82   43                                                      
CONECT   83   44                                                      
CONECT   84   44                                                      
MASTER        0    0    0    0    0    0    0    0   84    0   84    0
END
