COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.524   0.468  -6.517  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.935   0.085  -6.512  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.718  -0.675  -5.202  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.826  -1.717  -5.031  1.00  0.00           C  
HETATM    5  O   UNL     1       1.553   1.459  -6.504  1.00  0.00           O  
HETATM    6  O   UNL     1      -3.217   0.716  -6.492  1.00  0.00           O  
HETATM    7  C   UNL     1       0.556  -0.321  -5.207  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.840   1.148  -6.659  1.00  0.00           C  
HETATM    9  O   UNL     1       0.318   0.565  -4.112  1.00  0.00           O  
HETATM   10  O   UNL     1      -0.941   1.766  -7.943  1.00  0.00           O  
HETATM   11  O   UNL     1      -0.451  -1.330  -5.227  1.00  0.00           O  
HETATM   12  O   UNL     1      -2.629  -2.424  -3.805  1.00  0.00           O  
HETATM   13  C   UNL     1       1.674   0.039  -0.258  1.00  0.00           C  
HETATM   14  C   UNL     1       2.577  -0.562  -1.338  1.00  0.00           C  
HETATM   15  C   UNL     1       2.213   0.054  -2.693  1.00  0.00           C  
HETATM   16  C   UNL     1       0.708  -0.128  -2.926  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.053   0.438  -1.726  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.557   0.289  -1.964  1.00  0.00           C  
HETATM   19  O   UNL     1       2.029  -0.505   1.014  1.00  0.00           O  
HETATM   20  O   UNL     1       2.941  -0.601  -3.733  1.00  0.00           O  
HETATM   21  O   UNL     1       0.311  -0.269  -0.543  1.00  0.00           O  
HETATM   22  O   UNL     1      -2.272   0.896  -0.886  1.00  0.00           O  
HETATM   23  O   UNL     1       3.943  -0.274  -1.034  1.00  0.00           O  
HETATM   24  C   UNL     1       1.159   0.093   1.976  1.00  0.00           C  
HETATM   25  C   UNL     1       1.487  -0.449   3.368  1.00  0.00           C  
HETATM   26  C   UNL     1       0.555   0.191   4.398  1.00  0.00           C  
HETATM   27  C   UNL     1       0.884  -0.351   5.791  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.047   0.289   6.821  1.00  0.00           C  
HETATM   29  C   UNL     1       0.280  -0.252   8.213  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.651   0.388   9.244  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.322  -0.154  10.636  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.254   0.486  11.666  1.00  0.00           C  
HETATM   33  C   UNL     1      -0.925  -0.056  13.058  1.00  0.00           C  
HETATM   34  C   UNL     1      -1.857   0.584  14.089  1.00  0.00           C  
HETATM   35  H   UNL     1       0.682  -0.209  -7.356  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.883  -0.609  -7.350  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.747   0.024  -4.367  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.794  -1.217  -5.011  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.796  -2.419  -5.864  1.00  0.00           H  
HETATM   40  H   UNL     1       2.393   0.989  -6.413  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.312   1.182  -7.334  1.00  0.00           H  
HETATM   42  H   UNL     1       1.534  -0.788  -5.089  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.956   1.902  -5.880  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.236   2.426  -7.992  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.347  -3.069  -3.736  1.00  0.00           H  
HETATM   46  H   UNL     1       1.804   1.121  -0.239  1.00  0.00           H  
HETATM   47  H   UNL     1       2.432  -1.641  -1.377  1.00  0.00           H  
HETATM   48  H   UNL     1       2.456   1.116  -2.691  1.00  0.00           H  
HETATM   49  H   UNL     1       0.482  -1.189  -3.033  1.00  0.00           H  
HETATM   50  H   UNL     1       0.192   1.493  -1.607  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.827   0.778  -2.900  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.813  -0.768  -2.020  1.00  0.00           H  
HETATM   53  H   UNL     1       3.880  -0.461  -3.548  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.213   0.781  -1.075  1.00  0.00           H  
HETATM   55  H   UNL     1       4.130  -0.679  -0.176  1.00  0.00           H  
HETATM   56  H   UNL     1       0.124  -0.144   1.728  1.00  0.00           H  
HETATM   57  H   UNL     1       1.295   1.174   1.966  1.00  0.00           H  
HETATM   58  H   UNL     1       2.522  -0.211   3.616  1.00  0.00           H  
HETATM   59  H   UNL     1       1.351  -1.530   3.378  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.478  -0.046   4.150  1.00  0.00           H  
HETATM   61  H   UNL     1       0.691   1.273   4.389  1.00  0.00           H  
HETATM   62  H   UNL     1       1.918  -0.112   6.039  1.00  0.00           H  
HETATM   63  H   UNL     1       0.748  -1.432   5.801  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.082   0.051   6.573  1.00  0.00           H  
HETATM   65  H   UNL     1       0.088   1.371   6.811  1.00  0.00           H  
HETATM   66  H   UNL     1       1.315  -0.014   8.461  1.00  0.00           H  
HETATM   67  H   UNL     1       0.144  -1.334   8.223  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.685   0.149   8.996  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.514   1.469   9.234  1.00  0.00           H  
HETATM   70  H   UNL     1       0.711   0.083  10.884  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.458  -1.236  10.646  1.00  0.00           H  
HETATM   72  H   UNL     1      -2.288   0.248  11.418  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.118   1.567  11.656  1.00  0.00           H  
HETATM   74  H   UNL     1       0.108   0.181  13.306  1.00  0.00           H  
HETATM   75  H   UNL     1      -1.062  -1.138  13.068  1.00  0.00           H  
HETATM   76  H   UNL     1      -1.623   0.197  15.080  1.00  0.00           H  
HETATM   77  H   UNL     1      -1.721   1.665  14.079  1.00  0.00           H  
HETATM   78  H   UNL     1      -2.892   0.346  13.841  1.00  0.00           H  
CONECT    1    5    7    8   35                                       
CONECT    2    3    6    8   36                                       
CONECT    3    2    4   11   37                                       
CONECT    4    3   12   38   39                                       
CONECT    5    1   40                                                 
CONECT    6    2   41                                                 
CONECT    7    1    9   11   42                                       
CONECT    8    1    2   10   43                                       
CONECT    9    7   16                                                 
CONECT   10    8   44                                                 
CONECT   11    3    7                                                 
CONECT   12    4   45                                                 
CONECT   13   14   19   21   46                                       
CONECT   14   13   15   23   47                                       
CONECT   15   14   16   20   48                                       
CONECT   16    9   15   17   49                                       
CONECT   17   16   18   21   50                                       
CONECT   18   17   22   51   52                                       
CONECT   19   13   24                                                 
CONECT   20   15   53                                                 
CONECT   21   13   17                                                 
CONECT   22   18   54                                                 
CONECT   23   14   55                                                 
CONECT   24   19   25   56   57                                       
CONECT   25   24   26   58   59                                       
CONECT   26   25   27   60   61                                       
CONECT   27   26   28   62   63                                       
CONECT   28   27   29   64   65                                       
CONECT   29   28   30   66   67                                       
CONECT   30   29   31   68   69                                       
CONECT   31   30   32   70   71                                       
CONECT   32   31   33   72   73                                       
CONECT   33   32   34   74   75                                       
CONECT   34   33   76   77   78                                       
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   20                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   25                                                      
CONECT   60   26                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   29                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   30                                                      
CONECT   70   31                                                      
CONECT   71   31                                                      
CONECT   72   32                                                      
CONECT   73   32                                                      
CONECT   74   33                                                      
CONECT   75   33                                                      
CONECT   76   34                                                      
CONECT   77   34                                                      
CONECT   78   34                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
