COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.940  -1.510   3.283  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.522  -1.894   2.858  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.507  -2.219   1.363  1.00  0.00           C  
HETATM    4  N   UNL     1      -5.325  -3.414   1.114  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.615  -3.564  -0.319  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.091  -2.478   0.919  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.631  -3.599   0.981  1.00  0.00           O  
HETATM    8  N   UNL     1      -2.334  -1.464   0.453  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.957  -1.716   0.022  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.957  -2.191  -1.433  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.781  -3.475  -1.551  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.781  -3.949  -3.005  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.395  -2.866  -3.895  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.572  -1.582  -3.777  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.571  -1.108  -2.323  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.155  -0.446   0.135  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.656   0.617  -0.163  1.00  0.00           O  
HETATM   18  N   UNL     1       1.120  -0.491   0.570  1.00  0.00           N  
HETATM   19  C   UNL     1       1.699  -1.768   1.033  1.00  0.00           C  
HETATM   20  C   UNL     1       3.029  -1.935   0.301  1.00  0.00           C  
HETATM   21  C   UNL     1       3.896  -3.072   0.878  1.00  0.00           C  
HETATM   22  C   UNL     1       5.287  -2.506   0.709  1.00  0.00           C  
HETATM   23  C   UNL     1       6.510  -3.139   0.720  1.00  0.00           C  
HETATM   24  C   UNL     1       7.638  -2.349   0.530  1.00  0.00           C  
HETATM   25  C   UNL     1       7.536  -0.987   0.338  1.00  0.00           C  
HETATM   26  C   UNL     1       6.313  -0.336   0.333  1.00  0.00           C  
HETATM   27  C   UNL     1       5.171  -1.112   0.531  1.00  0.00           C  
HETATM   28  N   UNL     1       3.848  -0.737   0.630  1.00  0.00           N  
HETATM   29  C   UNL     1       3.352   0.459  -0.023  1.00  0.00           C  
HETATM   30  C   UNL     1       1.938   0.729   0.577  1.00  0.00           C  
HETATM   31  C   UNL     1       1.262   1.825  -0.206  1.00  0.00           C  
HETATM   32  O   UNL     1       0.668   1.561  -1.230  1.00  0.00           O  
HETATM   33  N   UNL     1       1.317   3.098   0.232  1.00  0.00           N  
HETATM   34  C   UNL     1       0.659   4.163  -0.530  1.00  0.00           C  
HETATM   35  C   UNL     1       1.347   5.499  -0.235  1.00  0.00           C  
HETATM   36  C   UNL     1       0.472   6.626  -0.798  1.00  0.00           C  
HETATM   37  O   UNL     1      -0.764   6.637  -0.082  1.00  0.00           O  
HETATM   38  C   UNL     1      -1.422   5.458   0.066  1.00  0.00           C  
HETATM   39  C   UNL     1      -2.766   5.489   0.426  1.00  0.00           C  
HETATM   40  C   UNL     1      -3.467   4.312   0.591  1.00  0.00           C  
HETATM   41  C   UNL     1      -2.835   3.098   0.397  1.00  0.00           C  
HETATM   42  C   UNL     1      -1.502   3.064   0.036  1.00  0.00           C  
HETATM   43  C   UNL     1      -0.793   4.241  -0.132  1.00  0.00           C  
HETATM   44  H   UNL     1      -6.264  -0.636   2.718  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.617  -2.342   3.085  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.951  -1.278   4.348  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.845  -1.063   3.056  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.198  -2.768   3.423  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.915  -1.377   0.804  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.878  -4.241   1.480  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.088  -2.655  -0.690  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.686  -3.738  -0.861  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.286  -4.410  -0.467  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.702  -0.568   0.404  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.513  -2.485   0.654  1.00  0.00           H  
HETATM   56  H   UNL     1       0.067  -2.385  -1.752  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.343  -4.246  -0.917  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.805  -3.280  -1.232  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.757  -4.143  -3.324  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.367  -4.864  -3.089  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.395  -3.204  -4.931  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.419  -2.672  -3.576  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.548  -1.776  -4.096  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.009  -0.811  -4.411  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.595  -0.913  -2.004  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.985  -0.193  -2.239  1.00  0.00           H  
HETATM   67  H   UNL     1       1.867  -1.733   2.109  1.00  0.00           H  
HETATM   68  H   UNL     1       1.030  -2.592   0.786  1.00  0.00           H  
HETATM   69  H   UNL     1       2.884  -2.044  -0.774  1.00  0.00           H  
HETATM   70  H   UNL     1       3.668  -3.243   1.930  1.00  0.00           H  
HETATM   71  H   UNL     1       3.774  -3.989   0.300  1.00  0.00           H  
HETATM   72  H   UNL     1       6.589  -4.206   0.871  1.00  0.00           H  
HETATM   73  H   UNL     1       8.614  -2.811   0.533  1.00  0.00           H  
HETATM   74  H   UNL     1       8.437  -0.410   0.187  1.00  0.00           H  
HETATM   75  H   UNL     1       6.246   0.731   0.183  1.00  0.00           H  
HETATM   76  H   UNL     1       4.028   1.292   0.166  1.00  0.00           H  
HETATM   77  H   UNL     1       3.266   0.286  -1.096  1.00  0.00           H  
HETATM   78  H   UNL     1       2.039   1.036   1.618  1.00  0.00           H  
HETATM   79  H   UNL     1       1.792   3.310   1.051  1.00  0.00           H  
HETATM   80  H   UNL     1       0.732   3.946  -1.595  1.00  0.00           H  
HETATM   81  H   UNL     1       1.460   5.625   0.842  1.00  0.00           H  
HETATM   82  H   UNL     1       2.327   5.521  -0.712  1.00  0.00           H  
HETATM   83  H   UNL     1       0.978   7.583  -0.671  1.00  0.00           H  
HETATM   84  H   UNL     1       0.281   6.449  -1.857  1.00  0.00           H  
HETATM   85  H   UNL     1      -3.261   6.436   0.578  1.00  0.00           H  
HETATM   86  H   UNL     1      -4.510   4.339   0.872  1.00  0.00           H  
HETATM   87  H   UNL     1      -3.383   2.176   0.528  1.00  0.00           H  
HETATM   88  H   UNL     1      -1.010   2.114  -0.115  1.00  0.00           H  
CONECT    1    2   44   45   46                                       
CONECT    2    1    3   47   48                                       
CONECT    3    6    2    4   49                                       
CONECT    4    3    5   50                                            
CONECT    5    4   51   52   53                                       
CONECT    6    7    7    8    3                                       
CONECT    7    6    6                                                 
CONECT    8    9    6   54                                            
CONECT    9   16   10    8   55                                       
CONECT   10    9   11   15   56                                       
CONECT   11   10   12   57   58                                       
CONECT   12   11   13   59   60                                       
CONECT   13   14   12   61   62                                       
CONECT   14   15   13   63   64                                       
CONECT   15   14   10   65   66                                       
CONECT   16   18    9   17   17                                       
CONECT   17   16   16                                                 
CONECT   18   19   30   16                                            
CONECT   19   20   18   67   68                                       
CONECT   20   21   28   19   69                                       
CONECT   21   22   20   70   71                                       
CONECT   22   23   23   27   21                                       
CONECT   23   24   22   22   72                                       
CONECT   24   25   25   23   73                                       
CONECT   25   24   24   26   74                                       
CONECT   26   25   27   27   75                                       
CONECT   27   26   26   22   28                                       
CONECT   28   27   20   29                                            
CONECT   29   28   30   76   77                                       
CONECT   30   29   31   18   78                                       
CONECT   31   30   33   32   32                                       
CONECT   32   31   31                                                 
CONECT   33   31   34   79                                            
CONECT   34   35   33   43   80                                       
CONECT   35   36   34   81   82                                       
CONECT   36   35   37   83   84                                       
CONECT   37   36   38                                                 
CONECT   38   37   43   43   39                                       
CONECT   39   38   40   40   85                                       
CONECT   40   39   39   41   86                                       
CONECT   41   42   42   40   87                                       
CONECT   42   43   41   41   88                                       
CONECT   43   34   38   38   42                                       
CONECT   44    1                                                      
CONECT   45    1                                                      
CONECT   46    1                                                      
CONECT   47    2                                                      
CONECT   48    2                                                      
CONECT   49    3                                                      
CONECT   50    4                                                      
CONECT   51    5                                                      
CONECT   52    5                                                      
CONECT   53    5                                                      
CONECT   54    8                                                      
CONECT   55    9                                                      
CONECT   56   10                                                      
CONECT   57   11                                                      
CONECT   58   11                                                      
CONECT   59   12                                                      
CONECT   60   12                                                      
CONECT   61   13                                                      
CONECT   62   13                                                      
CONECT   63   14                                                      
CONECT   64   14                                                      
CONECT   65   15                                                      
CONECT   66   15                                                      
CONECT   67   19                                                      
CONECT   68   19                                                      
CONECT   69   20                                                      
CONECT   70   21                                                      
CONECT   71   21                                                      
CONECT   72   23                                                      
CONECT   73   24                                                      
CONECT   74   25                                                      
CONECT   75   26                                                      
CONECT   76   29                                                      
CONECT   77   29                                                      
CONECT   78   30                                                      
CONECT   79   33                                                      
CONECT   80   34                                                      
CONECT   81   35                                                      
CONECT   82   35                                                      
CONECT   83   36                                                      
CONECT   84   36                                                      
CONECT   85   39                                                      
CONECT   86   40                                                      
CONECT   87   41                                                      
CONECT   88   42                                                      
MASTER        0    0    0    0    0    0    0    0   88    0   88    0
END
