COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.009  -3.579   1.331  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.061  -4.422   2.070  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.763  -2.336   1.830  1.00  0.00           C  
HETATM    4  C   UNL     1       3.630  -3.018  -0.781  1.00  0.00           C  
HETATM    5  C   UNL     1       3.541   4.724   0.497  1.00  0.00           C  
HETATM    6  C   UNL     1       2.228   5.097   0.581  1.00  0.00           C  
HETATM    7  C   UNL     1       1.226   4.149   0.407  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.360   2.886  -1.153  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.381   1.782  -1.423  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.708   0.408  -1.490  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.108   2.306  -0.499  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.307   3.373   0.195  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.223   4.565   0.506  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.741  -1.052   0.244  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.531  -2.258  -0.624  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.237  -3.017  -0.751  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.045  -3.749  -0.190  1.00  0.00           C  
HETATM   18  C   UNL     1       2.339  -3.593  -0.251  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.804  -3.107  -0.644  1.00  0.00           C  
HETATM   20  C   UNL     1       3.549  -1.517  -0.732  1.00  0.00           C  
HETATM   21  C   UNL     1       4.602  -0.762  -0.441  1.00  0.00           C  
HETATM   22  C   UNL     1       3.835   3.371   0.242  1.00  0.00           C  
HETATM   23  C   UNL     1       2.762   2.461   0.069  1.00  0.00           C  
HETATM   24  C   UNL     1       3.043   1.112  -0.180  1.00  0.00           C  
HETATM   25  C   UNL     1       4.361   0.682  -0.222  1.00  0.00           C  
HETATM   26  C   UNL     1       5.415   1.591  -0.061  1.00  0.00           C  
HETATM   27  C   UNL     1       5.160   2.910   0.161  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.418   5.938  -0.141  1.00  0.00           C  
HETATM   29  C   UNL     1       4.798  -3.500   0.082  1.00  0.00           C  
HETATM   30  C   UNL     1       3.838  -3.474  -2.227  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.269  -3.209   2.993  1.00  0.00           C  
HETATM   32  N   UNL     1       1.498   2.891   0.156  1.00  0.00           N  
HETATM   33  N   UNL     1      -3.998   0.164  -0.229  1.00  0.00           N  
HETATM   34  N   UNL     1      -3.503   1.259   0.468  1.00  0.00           N  
HETATM   35  N   UNL     1      -1.014   3.545  -0.224  1.00  0.00           N  
HETATM   36  N   UNL     1      -2.412  -3.048  -0.057  1.00  0.00           N  
HETATM   37  O   UNL     1      -3.673  -1.195   1.446  1.00  0.00           O  
HETATM   38  O   UNL     1      -1.154  -2.412  -1.798  1.00  0.00           O  
HETATM   39  O   UNL     1       1.166  -3.193  -0.771  1.00  0.00           O  
HETATM   40  O   UNL     1       2.359  -4.411   0.638  1.00  0.00           O  
HETATM   41  O   UNL     1      -2.783   4.049   1.082  1.00  0.00           O  
HETATM   42  H   UNL     1       0.996  -3.675   1.743  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.933  -4.662   1.461  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.647  -5.292   2.579  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.109  -1.524   2.146  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.554  -2.006   1.156  1.00  0.00           H  
HETATM   47  H   UNL     1       4.332   5.449   0.623  1.00  0.00           H  
HETATM   48  H   UNL     1       1.970   6.126   0.782  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.087   3.363  -2.094  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.803   3.628  -0.488  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.122   1.778  -0.624  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.880   1.982  -2.372  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.465  -0.362  -1.638  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.000   0.389  -2.319  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.487   1.836  -1.270  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.530   4.600   1.552  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.282  -1.944  -1.637  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.116  -4.808  -0.437  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.629  -2.516  -1.041  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.647  -3.982  -1.275  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.042  -3.429   0.370  1.00  0.00           H  
HETATM   62  H   UNL     1       2.607  -1.031  -0.963  1.00  0.00           H  
HETATM   63  H   UNL     1       5.576  -1.188  -0.298  1.00  0.00           H  
HETATM   64  H   UNL     1       2.237   0.410  -0.339  1.00  0.00           H  
HETATM   65  H   UNL     1       6.436   1.244  -0.112  1.00  0.00           H  
HETATM   66  H   UNL     1       5.979   3.605   0.275  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.130   5.889  -1.191  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.465   6.230  -0.065  1.00  0.00           H  
HETATM   69  H   UNL     1       0.202   6.673   0.372  1.00  0.00           H  
HETATM   70  H   UNL     1       4.847  -4.588   0.052  1.00  0.00           H  
HETATM   71  H   UNL     1       5.729  -3.084  -0.302  1.00  0.00           H  
HETATM   72  H   UNL     1       4.650  -3.171   1.110  1.00  0.00           H  
HETATM   73  H   UNL     1       3.008  -3.126  -2.841  1.00  0.00           H  
HETATM   74  H   UNL     1       4.771  -3.057  -2.608  1.00  0.00           H  
HETATM   75  H   UNL     1       3.885  -4.562  -2.261  1.00  0.00           H  
HETATM   76  H   UNL     1      -2.313  -3.031   3.252  1.00  0.00           H  
HETATM   77  H   UNL     1      -0.610  -3.203   3.861  1.00  0.00           H  
HETATM   78  H   UNL     1      -4.186   1.610   1.122  1.00  0.00           H  
HETATM   79  H   UNL     1      -0.638   3.029  -0.954  1.00  0.00           H  
HETATM   80  H   UNL     1      -2.510  -3.558   0.762  1.00  0.00           H  
CONECT    1    2    3   17   42                                       
CONECT    2   31    1   43   44                                       
CONECT    3   31    1   45   46                                       
CONECT    4   29   20   18   30                                       
CONECT    5   22   22    6   47                                       
CONECT    6    5    7    7   48                                       
CONECT    7    6    6   32   13                                       
CONECT    8    9   11   49   50                                       
CONECT    9   10    8   51   52                                       
CONECT   10   33    9   53   54                                       
CONECT   11   34    8   12   55                                       
CONECT   12   41   41   11   35                                       
CONECT   13    7   35   28   56                                       
CONECT   14   33   37   37   15                                       
CONECT   15   36   14   19   57                                       
CONECT   16   38   38   17   36                                       
CONECT   17    1   39   16   58                                       
CONECT   18   39    4   40   40                                       
CONECT   19   15   59   60   61                                       
CONECT   20    4   21   21   62                                       
CONECT   21   20   20   25   63                                       
CONECT   22   27    5    5   23                                       
CONECT   23   22   24   32   32                                       
CONECT   24   25   25   23   64                                       
CONECT   25   26   21   24   24                                       
CONECT   26   27   27   25   65                                       
CONECT   27   26   26   22   66                                       
CONECT   28   13   67   68   69                                       
CONECT   29    4   70   71   72                                       
CONECT   30    4   73   74   75                                       
CONECT   31    2    3   76   77                                       
CONECT   32   23   23    7                                            
CONECT   33   10   34   14                                            
CONECT   34   33   11   78                                            
CONECT   35   12   13   79                                            
CONECT   36   16   15   80                                            
CONECT   37   14   14                                                 
CONECT   38   16   16                                                 
CONECT   39   17   18                                                 
CONECT   40   18   18                                                 
CONECT   41   12   12                                                 
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    2                                                      
CONECT   45    3                                                      
CONECT   46    3                                                      
CONECT   47    5                                                      
CONECT   48    6                                                      
CONECT   49    8                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52    9                                                      
CONECT   53   10                                                      
CONECT   54   10                                                      
CONECT   55   11                                                      
CONECT   56   13                                                      
CONECT   57   15                                                      
CONECT   58   17                                                      
CONECT   59   19                                                      
CONECT   60   19                                                      
CONECT   61   19                                                      
CONECT   62   20                                                      
CONECT   63   21                                                      
CONECT   64   24                                                      
CONECT   65   26                                                      
CONECT   66   27                                                      
CONECT   67   28                                                      
CONECT   68   28                                                      
CONECT   69   28                                                      
CONECT   70   29                                                      
CONECT   71   29                                                      
CONECT   72   29                                                      
CONECT   73   30                                                      
CONECT   74   30                                                      
CONECT   75   30                                                      
CONECT   76   31                                                      
CONECT   77   31                                                      
CONECT   78   34                                                      
CONECT   79   35                                                      
CONECT   80   36                                                      
MASTER        0    0    0    0    0    0    0    0   80    0   80    0
END
