COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.556   3.828  -1.396  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.149   2.768  -0.726  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.042   1.838   0.022  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.531   2.114  -0.260  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.769   3.626  -0.304  1.00  0.00           C  
HETATM    6  O   UNL     1       8.514  -2.933  -0.073  1.00  0.00           O  
HETATM    7  C   UNL     1       8.197  -1.545   0.050  1.00  0.00           C  
HETATM    8  C   UNL     1       6.706  -1.337  -0.219  1.00  0.00           C  
HETATM    9  C   UNL     1       6.366   0.149  -0.087  1.00  0.00           C  
HETATM   10  C   UNL     1       4.875   0.358  -0.356  1.00  0.00           C  
HETATM   11  C   UNL     1       4.550   1.857  -0.325  1.00  0.00           C  
HETATM   12  O   UNL     1       4.699   2.352   1.007  1.00  0.00           O  
HETATM   13  C   UNL     1       3.105   2.051  -0.787  1.00  0.00           C  
HETATM   14  C   UNL     1       4.054  -0.340   0.730  1.00  0.00           C  
HETATM   15  O   UNL     1       4.161  -1.756   0.568  1.00  0.00           O  
HETATM   16  C   UNL     1       2.612   0.065   0.629  1.00  0.00           C  
HETATM   17  C   UNL     1       2.194   1.123  -0.038  1.00  0.00           C  
HETATM   18  C   UNL     1       0.757   1.409  -0.047  1.00  0.00           C  
HETATM   19  C   UNL     1       0.287   2.481  -0.717  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.915   2.065   1.544  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.236   1.513   2.120  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.264   1.547   0.976  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.992   1.426  -1.546  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.001   4.231  -1.477  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.768   0.132   0.682  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.630  -0.354   1.849  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.574  -0.808   0.504  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.072  -2.189   0.073  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.878  -3.129  -0.105  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.376  -4.510  -0.536  1.00  0.00           C  
HETATM   31  O   UNL     1      -3.980  -4.417  -1.827  1.00  0.00           O  
HETATM   32  C   UNL     1      -2.197  -5.482  -0.593  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.407  -5.018   0.474  1.00  0.00           C  
HETATM   34  H   UNL     1      -0.820   4.434  -1.904  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.792   0.805  -0.222  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.834   3.823  -0.426  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.420   4.076   0.625  1.00  0.00           H  
HETATM   38  H   UNL     1       9.445  -3.140   0.085  1.00  0.00           H  
HETATM   39  H   UNL     1       8.436  -1.206   1.058  1.00  0.00           H  
HETATM   40  H   UNL     1       8.780  -0.974  -0.673  1.00  0.00           H  
HETATM   41  H   UNL     1       6.467  -1.676  -1.227  1.00  0.00           H  
HETATM   42  H   UNL     1       6.123  -1.908   0.504  1.00  0.00           H  
HETATM   43  H   UNL     1       6.605   0.489   0.920  1.00  0.00           H  
HETATM   44  H   UNL     1       6.949   0.720  -0.810  1.00  0.00           H  
HETATM   45  H   UNL     1       4.617  -0.055  -1.332  1.00  0.00           H  
HETATM   46  H   UNL     1       5.226   2.391  -0.992  1.00  0.00           H  
HETATM   47  H   UNL     1       4.508   3.296   1.099  1.00  0.00           H  
HETATM   48  H   UNL     1       2.802   3.081  -0.603  1.00  0.00           H  
HETATM   49  H   UNL     1       3.036   1.841  -1.855  1.00  0.00           H  
HETATM   50  H   UNL     1       4.439  -0.058   1.710  1.00  0.00           H  
HETATM   51  H   UNL     1       3.665  -2.265   1.224  1.00  0.00           H  
HETATM   52  H   UNL     1       1.876  -0.545   1.131  1.00  0.00           H  
HETATM   53  H   UNL     1       0.074   0.761   0.482  1.00  0.00           H  
HETATM   54  H   UNL     1       0.970   3.129  -1.246  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.064   1.512   1.942  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.817   3.128   1.764  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.094   0.489   2.464  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.574   2.141   2.945  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.100   2.193   1.243  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.748   0.364  -1.498  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.069   1.547  -1.658  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.486   1.876  -2.401  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.078   5.318  -1.446  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.429   3.863  -2.410  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.363   0.141  -0.231  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.429   0.364   2.034  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.063  -1.323   1.602  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.013  -0.449   2.742  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.907  -0.407  -0.260  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.035  -0.894   1.448  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.739  -2.589   0.837  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.611  -2.102  -0.870  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.211  -2.728  -0.869  1.00  0.00           H  
HETATM   74  H   UNL     1      -2.339  -3.215   0.839  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.383  -4.100  -2.519  1.00  0.00           H  
HETATM   76  H   UNL     1      -1.736  -5.553   0.392  1.00  0.00           H  
HETATM   77  H   UNL     1      -2.552  -6.466  -0.900  1.00  0.00           H  
HETATM   78  H   UNL     1      -1.462  -5.120  -1.312  1.00  0.00           H  
HETATM   79  H   UNL     1      -5.248  -4.325   0.515  1.00  0.00           H  
HETATM   80  H   UNL     1      -4.762  -6.002   0.167  1.00  0.00           H  
HETATM   81  H   UNL     1      -3.947  -5.089   1.459  1.00  0.00           H  
CONECT    1   24    2    2   34                                       
CONECT    2    1    1   19    3                                       
CONECT    3    2    4   20   35                                       
CONECT    4   23    5    3   22                                       
CONECT    5   24    4   36   37                                       
CONECT    6    7   38                                                 
CONECT    7    8    6   39   40                                       
CONECT    8    7    9   41   42                                       
CONECT    9    8   10   43   44                                       
CONECT   10   11    9   14   45                                       
CONECT   11   13   10   12   46                                       
CONECT   12   11   47                                                 
CONECT   13   11   17   48   49                                       
CONECT   14   10   16   15   50                                       
CONECT   15   14   51                                                 
CONECT   16   17   17   14   52                                       
CONECT   17   13   18   16   16                                       
CONECT   18   19   19   17   53                                       
CONECT   19    2   18   18   54                                       
CONECT   20    3   21   55   56                                       
CONECT   21   22   20   57   58                                       
CONECT   22    4   25   21   59                                       
CONECT   23    4   60   61   62                                       
CONECT   24    1    5   63   64                                       
CONECT   25   22   27   26   65                                       
CONECT   26   25   66   67   68                                       
CONECT   27   25   28   69   70                                       
CONECT   28   29   27   71   72                                       
CONECT   29   30   28   73   74                                       
CONECT   30   32   29   33   31                                       
CONECT   31   30   75                                                 
CONECT   32   30   76   77   78                                       
CONECT   33   30   79   80   81                                       
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   26                                                      
CONECT   67   26                                                      
CONECT   68   26                                                      
CONECT   69   27                                                      
CONECT   70   27                                                      
CONECT   71   28                                                      
CONECT   72   28                                                      
CONECT   73   29                                                      
CONECT   74   29                                                      
CONECT   75   31                                                      
CONECT   76   32                                                      
CONECT   77   32                                                      
CONECT   78   32                                                      
CONECT   79   33                                                      
CONECT   80   33                                                      
CONECT   81   33                                                      
MASTER        0    0    0    0    0    0    0    0   81    0   81    0
END
