COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK     1       1.898   0.456  -7.617  1.00  0.00           C  
HETATM    2  C   UNK     1       1.763  -1.021  -7.995  1.00  0.00           C  
HETATM    3  C   UNK     1       0.500  -1.194  -8.810  1.00  0.00           C  
HETATM    4  C   UNK     1      -0.791  -0.641  -8.252  1.00  0.00           C  
HETATM    5  C   UNK     1      -0.570   0.824  -7.862  1.00  0.00           C  
HETATM    6  C   UNK     1      -1.822   1.342  -7.148  1.00  0.00           C  
HETATM    7  N   UNK     1      -1.564  -0.259  10.962  1.00  0.00           N  
HETATM    8  C   UNK     1      -0.100  -0.360  10.913  1.00  0.00           C  
HETATM    9  C   UNK     1       0.411   0.267   9.616  1.00  0.00           C  
HETATM   10  C   UNK     1      -0.190  -0.472   8.419  1.00  0.00           C  
HETATM   11  C   UNK     1       0.321   0.155   7.121  1.00  0.00           C  
HETATM   12  C   UNK     1      -0.280  -0.584   5.925  1.00  0.00           C  
HETATM   13  N   UNK     1       0.210   0.016   4.682  1.00  0.00           N  
HETATM   14  C   UNK     1      -0.189  -0.474   3.492  1.00  0.00           C  
HETATM   15  O   UNK     1      -0.954  -1.414   3.450  1.00  0.00           O  
HETATM   16  C   UNK     1       0.314   0.144   2.214  1.00  0.00           C  
HETATM   17  C   UNK     1      -0.286  -0.595   1.017  1.00  0.00           C  
HETATM   18  C   UNK     1       0.225   0.032  -0.280  1.00  0.00           C  
HETATM   19  C   UNK     1       1.750  -0.072  -0.330  1.00  0.00           C  
HETATM   20  C   UNK     1      -0.376  -0.707  -1.476  1.00  0.00           C  
HETATM   21  C   UNK     1      -1.918  -0.555  -1.481  1.00  0.00           C  
HETATM   22  C   UNK     1       0.096  -0.075  -2.781  1.00  0.00           C  
HETATM   23  C   UNK     1       1.341  -0.656  -3.443  1.00  0.00           C  
HETATM   24  C   UNK     1       0.267   1.433  -2.595  1.00  0.00           C  
HETATM   25  C   UNK     1      -1.107  -0.293  -3.739  1.00  0.00           C  
HETATM   26  C   UNK     1      -2.290   0.089  -2.844  1.00  0.00           C  
HETATM   27  C   UNK     1      -0.889   0.582  -4.958  1.00  0.00           C  
HETATM   28  C   UNK     1      -2.086   0.490  -5.905  1.00  0.00           C  
HETATM   29  C   UNK     1       0.377   0.074  -5.665  1.00  0.00           C  
HETATM   30  C   UNK     1       1.596   0.112  -4.750  1.00  0.00           C  
HETATM   31  C   UNK     1       0.628   0.936  -6.917  1.00  0.00           C  
HETATM   32  C   UNK     1       0.812   2.390  -6.478  1.00  0.00           C  
HETATM   33  O   UNK     1       0.524  -1.757  -9.878  1.00  0.00           O  
HETATM   34  C   UNK     1       0.492   0.367  12.092  1.00  0.00           C  
HETATM   35  O   UNK     1       1.658  -0.041  12.617  1.00  0.00           O  
HETATM   36  O   UNK     1      -0.081   1.320  12.564  1.00  0.00           O  
HETATM   37  H   UNK     1       2.750   0.584  -6.949  1.00  0.00           H  
HETATM   38  H   UNK     1       2.051   1.049  -8.518  1.00  0.00           H  
HETATM   39  H   UNK     1       1.702  -1.627  -7.091  1.00  0.00           H  
HETATM   40  H   UNK     1       2.626  -1.328  -8.587  1.00  0.00           H  
HETATM   41  H   UNK     1      -1.083  -1.214  -7.371  1.00  0.00           H  
HETATM   42  H   UNK     1      -1.573  -0.705  -9.008  1.00  0.00           H  
HETATM   43  H   UNK     1      -0.387   1.417  -8.758  1.00  0.00           H  
HETATM   44  H   UNK     1      -2.677   1.278  -7.821  1.00  0.00           H  
HETATM   45  H   UNK     1      -1.669   2.380  -6.852  1.00  0.00           H  
HETATM   46  H   UNK     1      -1.789   0.723  10.926  1.00  0.00           H  
HETATM   47  H   UNK     1      -1.912  -0.667  10.107  1.00  0.00           H  
HETATM   48  H   UNK     1       0.193  -1.409  10.950  1.00  0.00           H  
HETATM   49  H   UNK     1       1.498   0.192   9.580  1.00  0.00           H  
HETATM   50  H   UNK     1       0.118   1.316   9.579  1.00  0.00           H  
HETATM   51  H   UNK     1      -1.276  -0.397   8.455  1.00  0.00           H  
HETATM   52  H   UNK     1       0.103  -1.521   8.456  1.00  0.00           H  
HETATM   53  H   UNK     1       1.408   0.080   7.085  1.00  0.00           H  
HETATM   54  H   UNK     1       0.028   1.204   7.085  1.00  0.00           H  
HETATM   55  H   UNK     1      -1.366  -0.509   5.961  1.00  0.00           H  
HETATM   56  H   UNK     1       0.013  -1.633   5.961  1.00  0.00           H  
HETATM   57  H   UNK     1       0.822   0.768   4.715  1.00  0.00           H  
HETATM   58  H   UNK     1       1.401   0.069   2.178  1.00  0.00           H  
HETATM   59  H   UNK     1       0.021   1.193   2.177  1.00  0.00           H  
HETATM   60  H   UNK     1      -1.373  -0.520   1.053  1.00  0.00           H  
HETATM   61  H   UNK     1       0.006  -1.644   1.054  1.00  0.00           H  
HETATM   62  H   UNK     1      -0.068   1.081  -0.316  1.00  0.00           H  
HETATM   63  H   UNK     1       2.043  -1.122  -0.293  1.00  0.00           H  
HETATM   64  H   UNK     1       2.115   0.374  -1.254  1.00  0.00           H  
HETATM   65  H   UNK     1       2.179   0.454   0.522  1.00  0.00           H  
HETATM   66  H   UNK     1      -0.101  -1.761  -1.445  1.00  0.00           H  
HETATM   67  H   UNK     1      -2.391  -1.533  -1.388  1.00  0.00           H  
HETATM   68  H   UNK     1      -2.233   0.092  -0.662  1.00  0.00           H  
HETATM   69  H   UNK     1       1.148  -1.706  -3.663  1.00  0.00           H  
HETATM   70  H   UNK     1       2.205  -0.566  -2.785  1.00  0.00           H  
HETATM   71  H   UNK     1       0.515   1.892  -3.552  1.00  0.00           H  
HETATM   72  H   UNK     1      -0.662   1.860  -2.218  1.00  0.00           H  
HETATM   73  H   UNK     1       1.069   1.623  -1.882  1.00  0.00           H  
HETATM   74  H   UNK     1      -1.175  -1.341  -4.032  1.00  0.00           H  
HETATM   75  H   UNK     1      -3.218  -0.333  -3.230  1.00  0.00           H  
HETATM   76  H   UNK     1      -2.369   1.172  -2.750  1.00  0.00           H  
HETATM   77  H   UNK     1      -0.746   1.617  -4.647  1.00  0.00           H  
HETATM   78  H   UNK     1      -2.235  -0.548  -6.201  1.00  0.00           H  
HETATM   79  H   UNK     1      -2.979   0.854  -5.397  1.00  0.00           H  
HETATM   80  H   UNK     1       0.200  -0.955  -5.976  1.00  0.00           H  
HETATM   81  H   UNK     1       2.445  -0.334  -5.268  1.00  0.00           H  
HETATM   82  H   UNK     1       1.831   1.150  -4.513  1.00  0.00           H  
HETATM   83  H   UNK     1       1.006   3.012  -7.351  1.00  0.00           H  
HETATM   84  H   UNK     1      -0.091   2.736  -5.978  1.00  0.00           H  
HETATM   85  H   UNK     1       1.656   2.457  -5.790  1.00  0.00           H  
HETATM   86  H   UNK     1       2.038   0.425  13.373  1.00  0.00           H  
CONECT    1    2   31   37   38                                       
CONECT    2    1    3   39   40                                       
CONECT    3    2    4   33   33                                       
CONECT    4    3    5   41   42                                       
CONECT    5    4    6   31   43                                       
CONECT    6    5   28   44   45                                       
CONECT    7    8   46   47                                            
CONECT    8    7    9   34   48                                       
CONECT    9    8   10   49   50                                       
CONECT   10    9   11   51   52                                       
CONECT   11   10   12   53   54                                       
CONECT   12   11   13   55   56                                       
CONECT   13   12   14   57                                            
CONECT   14   13   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   58   59                                       
CONECT   17   16   18   60   61                                       
CONECT   18   17   19   20   62                                       
CONECT   19   18   63   64   65                                       
CONECT   20   18   21   22   66                                       
CONECT   21   20   26   67   68                                       
CONECT   22   20   23   24   25                                       
CONECT   23   22   30   69   70                                       
CONECT   24   22   71   72   73                                       
CONECT   25   22   26   27   74                                       
CONECT   26   21   25   75   76                                       
CONECT   27   25   28   29   77                                       
CONECT   28    6   27   78   79                                       
CONECT   29   27   30   31   80                                       
CONECT   30   23   29   81   82                                       
CONECT   31    1    5   29   32                                       
CONECT   32   31   83   84   85                                       
CONECT   33    3    3                                                 
CONECT   34    8   35   36   36                                       
CONECT   35   34   86                                                 
CONECT   36   34   34                                                 
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   11                                                      
CONECT   55   12                                                      
CONECT   56   12                                                      
CONECT   57   13                                                      
CONECT   58   16                                                      
CONECT   59   16                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   19                                                      
CONECT   64   19                                                      
CONECT   65   19                                                      
CONECT   66   20                                                      
CONECT   67   21                                                      
CONECT   68   21                                                      
CONECT   69   23                                                      
CONECT   70   23                                                      
CONECT   71   24                                                      
CONECT   72   24                                                      
CONECT   73   24                                                      
CONECT   74   25                                                      
CONECT   75   26                                                      
CONECT   76   26                                                      
CONECT   77   27                                                      
CONECT   78   28                                                      
CONECT   79   28                                                      
CONECT   80   29                                                      
CONECT   81   30                                                      
CONECT   82   30                                                      
CONECT   83   32                                                      
CONECT   84   32                                                      
CONECT   85   32                                                      
CONECT   86   35                                                      
MASTER        0    0    0    0    0    0    0    0   86    0   86    0
END
