COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.760   1.721  -0.521  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.871   2.437   0.242  1.00  0.00           C  
HETATM    3  O   UNL     1      -5.173   3.666  -0.449  1.00  0.00           O  
HETATM    4  C   UNL     1      -6.151   1.616   0.327  1.00  0.00           C  
HETATM    5  O   UNL     1      -6.761   1.535  -0.964  1.00  0.00           O  
HETATM    6  C   UNL     1      -5.891   0.206   0.863  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.797  -0.449   0.030  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.634  -1.913   0.383  1.00  0.00           C  
HETATM    9  O   UNL     1      -5.348  -2.760  -0.103  1.00  0.00           O  
HETATM   10  C   UNL     1      -2.344  -2.470   0.748  1.00  0.00           C  
HETATM   11  O   UNL     1      -3.668  -2.242   1.246  1.00  0.00           O  
HETATM   12  C   UNL     1      -1.525  -1.203   0.506  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.266  -0.314  -0.502  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.520   0.313   0.027  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.380   0.792  -1.079  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.031   0.298  -1.601  1.00  0.00           C  
HETATM   17  C   UNL     1       0.663  -0.445  -0.476  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.222  -1.665  -0.143  1.00  0.00           C  
HETATM   19  C   UNL     1       0.693  -2.510   0.747  1.00  0.00           C  
HETATM   20  C   UNL     1       2.102  -2.312   0.126  1.00  0.00           C  
HETATM   21  C   UNL     1       1.992  -1.116  -0.852  1.00  0.00           C  
HETATM   22  C   UNL     1       0.886   0.459   0.736  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.230   0.608   1.488  1.00  0.00           C  
HETATM   24  C   UNL     1       3.151  -0.144  -0.636  1.00  0.00           C  
HETATM   25  C   UNL     1       3.025   1.025  -1.615  1.00  0.00           C  
HETATM   26  C   UNL     1       4.476  -0.869  -0.876  1.00  0.00           C  
HETATM   27  O   UNL     1       4.530  -1.329  -2.228  1.00  0.00           O  
HETATM   28  C   UNL     1       5.638   0.092  -0.617  1.00  0.00           C  
HETATM   29  O   UNL     1       6.876  -0.603  -0.777  1.00  0.00           O  
HETATM   30  C   UNL     1       5.540   0.638   0.809  1.00  0.00           C  
HETATM   31  C   UNL     1       6.682   1.626   1.056  1.00  0.00           C  
HETATM   32  C   UNL     1       6.581   2.782   0.060  1.00  0.00           C  
HETATM   33  C   UNL     1       6.585   2.172   2.482  1.00  0.00           C  
HETATM   34  C   UNL     1       5.641  -0.518   1.806  1.00  0.00           C  
HETATM   35  H   UNL     1      -4.027   1.644  -1.580  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.842   2.306  -0.435  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.547   2.716   1.245  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.845   4.207  -0.014  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.849   2.124   1.005  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.000   2.392  -1.341  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.656   0.229   1.920  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.815  -0.384   0.747  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.158  -0.433  -1.016  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.809  -3.098   1.461  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.421  -3.014  -0.195  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.281  -0.729   1.453  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.565  -0.957  -1.354  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.917   1.239  -1.925  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.223   1.566  -0.336  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.192  -0.374  -2.449  1.00  0.00           H  
HETATM   51  H   UNL     1       0.574   1.147  -1.925  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.458  -2.215  -1.059  1.00  0.00           H  
HETATM   53  H   UNL     1       0.669  -2.160   1.778  1.00  0.00           H  
HETATM   54  H   UNL     1       0.403  -3.564   0.704  1.00  0.00           H  
HETATM   55  H   UNL     1       2.824  -2.083   0.911  1.00  0.00           H  
HETATM   56  H   UNL     1       2.409  -3.209  -0.411  1.00  0.00           H  
HETATM   57  H   UNL     1       1.961  -1.461  -1.882  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.076   0.810   1.110  1.00  0.00           H  
HETATM   59  H   UNL     1       1.396  -0.102   1.519  1.00  0.00           H  
HETATM   60  H   UNL     1       1.496   1.314   0.445  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.090   1.105   1.936  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.035  -0.326   2.015  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.356   1.256   1.562  1.00  0.00           H  
HETATM   64  H   UNL     1       3.123   0.234   0.386  1.00  0.00           H  
HETATM   65  H   UNL     1       2.145   1.617  -1.363  1.00  0.00           H  
HETATM   66  H   UNL     1       3.915   1.651  -1.550  1.00  0.00           H  
HETATM   67  H   UNL     1       2.925   0.640  -2.630  1.00  0.00           H  
HETATM   68  H   UNL     1       4.552  -1.720  -0.199  1.00  0.00           H  
HETATM   69  H   UNL     1       4.468  -0.623  -2.886  1.00  0.00           H  
HETATM   70  H   UNL     1       5.590   0.919  -1.326  1.00  0.00           H  
HETATM   71  H   UNL     1       6.987  -1.352  -0.177  1.00  0.00           H  
HETATM   72  H   UNL     1       4.585   1.147   0.939  1.00  0.00           H  
HETATM   73  H   UNL     1       7.637   1.117   0.927  1.00  0.00           H  
HETATM   74  H   UNL     1       5.626   3.291   0.189  1.00  0.00           H  
HETATM   75  H   UNL     1       7.395   3.486   0.236  1.00  0.00           H  
HETATM   76  H   UNL     1       6.651   2.394  -0.956  1.00  0.00           H  
HETATM   77  H   UNL     1       6.657   1.348   3.192  1.00  0.00           H  
HETATM   78  H   UNL     1       7.398   2.875   2.658  1.00  0.00           H  
HETATM   79  H   UNL     1       5.630   2.681   2.612  1.00  0.00           H  
HETATM   80  H   UNL     1       6.632  -0.968   1.741  1.00  0.00           H  
HETATM   81  H   UNL     1       5.478  -0.143   2.816  1.00  0.00           H  
HETATM   82  H   UNL     1       4.886  -1.268   1.570  1.00  0.00           H  
CONECT    1   14   35   36    2                                       
CONECT    2    4    1   37    3                                       
CONECT    3    2   38                                                 
CONECT    4    2    6   39    5                                       
CONECT    5    4   40                                                 
CONECT    6    4    7   41   42                                       
CONECT    7    6    8   43   14                                       
CONECT    8    7    9    9   11                                       
CONECT    9    8    8                                                 
CONECT   10   11   44   45   12                                       
CONECT   11    8   10                                                 
CONECT   12   10   46   13   18                                       
CONECT   13   15   12   47   14                                       
CONECT   14    1   13    7   23                                       
CONECT   15   13   48   49   16                                       
CONECT   16   15   17   50   51                                       
CONECT   17   16   18   22   21                                       
CONECT   18   17   12   19   52                                       
CONECT   19   18   53   54   20                                       
CONECT   20   19   55   56   21                                       
CONECT   21   17   24   20   57                                       
CONECT   22   17   58   59   60                                       
CONECT   23   14   61   62   63                                       
CONECT   24   21   64   25   26                                       
CONECT   25   24   65   66   67                                       
CONECT   26   28   24   68   27                                       
CONECT   27   26   69                                                 
CONECT   28   26   30   70   29                                       
CONECT   29   28   71                                                 
CONECT   30   28   31   34   72                                       
CONECT   31   30   33   73   32                                       
CONECT   32   31   74   75   76                                       
CONECT   33   31   77   78   79                                       
CONECT   34   30   80   81   82                                       
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   16                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   25                                                      
CONECT   67   25                                                      
CONECT   68   26                                                      
CONECT   69   27                                                      
CONECT   70   28                                                      
CONECT   71   29                                                      
CONECT   72   30                                                      
CONECT   73   31                                                      
CONECT   74   32                                                      
CONECT   75   32                                                      
CONECT   76   32                                                      
CONECT   77   33                                                      
CONECT   78   33                                                      
CONECT   79   33                                                      
CONECT   80   34                                                      
CONECT   81   34                                                      
CONECT   82   34                                                      
MASTER        0    0    0    0    0    0    0    0   82    0   82    0
END
