COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.663   0.249   0.176  1.00  0.00           C  
HETATM    2  C   UNL     1       0.818  -0.701  -0.670  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.578  -0.836  -0.036  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.231   0.536   0.018  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.703   0.531   0.442  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.452  -0.452  -0.451  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.959  -0.429  -0.339  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.475  -1.144   0.909  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.761   1.956   0.503  1.00  0.00           C  
HETATM   10  C   UNL     1       1.001   1.625   0.255  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.391  -1.433   1.367  1.00  0.00           C  
HETATM   12  C   UNL     1       0.673  -0.132  -2.086  1.00  0.00           C  
HETATM   13  C   UNL     1       2.915  -1.982  -1.306  1.00  0.00           C  
HETATM   14  C   UNL     1       4.058   2.618  -0.147  1.00  0.00           C  
HETATM   15  C   UNL     1       4.253   2.942  -1.606  1.00  0.00           C  
HETATM   16  C   UNL     1       3.756  -1.620   1.014  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.859  -1.852  -0.305  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.424  -1.814  -0.853  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.545  -1.177  -1.563  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.519   0.992  -0.399  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.271   1.938   0.171  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.403   1.499   0.860  1.00  0.00           C  
HETATM   23  C   UNL     1       3.702  -1.058  -0.382  1.00  0.00           C  
HETATM   24  C   UNL     1       1.476  -2.078  -0.802  1.00  0.00           C  
HETATM   25  C   UNL     1       4.105   1.180   0.320  1.00  0.00           C  
HETATM   26  C   UNL     1       3.849   3.581   0.715  1.00  0.00           C  
HETATM   27  C   UNL     1       5.451   0.559  -0.083  1.00  0.00           C  
HETATM   28  C   UNL     1       3.063   0.330  -0.426  1.00  0.00           C  
HETATM   29  C   UNL     1       5.132  -0.733  -0.833  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.858   0.241   1.927  1.00  0.00           C  
HETATM   31  O   UNL     1       4.303  -2.826   1.231  1.00  0.00           O  
HETATM   32  O   UNL     1       3.308  -0.985   1.939  1.00  0.00           O  
HETATM   33  O   UNL     1      -6.898   0.965  -0.009  1.00  0.00           O  
HETATM   34  H   UNL     1       1.744  -0.127   1.204  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.248   0.956  -1.012  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.215  -0.139  -1.501  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.167  -0.592   1.798  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.563  -1.197   0.874  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.063  -2.152   0.947  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.141   2.974   0.326  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.936   1.723   1.549  1.00  0.00           H  
HETATM   42  H   UNL     1       1.592   2.266   0.919  1.00  0.00           H  
HETATM   43  H   UNL     1       0.944   2.091  -0.721  1.00  0.00           H  
HETATM   44  H   UNL     1       0.105  -0.705   2.009  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.365  -1.685   1.788  1.00  0.00           H  
HETATM   46  H   UNL     1       0.220  -2.333   1.301  1.00  0.00           H  
HETATM   47  H   UNL     1       1.659  -0.024  -2.537  1.00  0.00           H  
HETATM   48  H   UNL     1       0.070  -0.811  -2.690  1.00  0.00           H  
HETATM   49  H   UNL     1       0.186   0.841  -2.038  1.00  0.00           H  
HETATM   50  H   UNL     1       2.941  -1.606  -2.329  1.00  0.00           H  
HETATM   51  H   UNL     1       3.369  -2.980  -1.292  1.00  0.00           H  
HETATM   52  H   UNL     1       5.313   3.103  -1.804  1.00  0.00           H  
HETATM   53  H   UNL     1       3.892   2.113  -2.214  1.00  0.00           H  
HETATM   54  H   UNL     1       3.696   3.845  -1.855  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.860  -2.181   0.726  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.427  -2.568  -0.904  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.469  -1.509  -1.897  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.995  -2.814  -0.784  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.185  -2.206  -1.566  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.633  -1.174  -1.504  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.229  -0.678  -2.479  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.462   1.349  -1.434  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.747   2.659   0.794  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.124   2.179  -0.880  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.871   2.488   0.846  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.320   1.166   1.889  1.00  0.00           H  
HETATM   67  H   UNL     1       1.457  -2.619   0.137  1.00  0.00           H  
HETATM   68  H   UNL     1       0.899  -2.661  -1.534  1.00  0.00           H  
HETATM   69  H   UNL     1       3.958   1.132   1.398  1.00  0.00           H  
HETATM   70  H   UNL     1       3.815   4.608   0.381  1.00  0.00           H  
HETATM   71  H   UNL     1       3.709   3.349   1.761  1.00  0.00           H  
HETATM   72  H   UNL     1       5.997   1.243  -0.734  1.00  0.00           H  
HETATM   73  H   UNL     1       6.045   0.342   0.805  1.00  0.00           H  
HETATM   74  H   UNL     1       3.014   0.682  -1.464  1.00  0.00           H  
HETATM   75  H   UNL     1       5.808  -1.529  -0.532  1.00  0.00           H  
HETATM   76  H   UNL     1       5.161  -0.574  -1.907  1.00  0.00           H  
HETATM   77  H   UNL     1      -2.146   0.842   2.491  1.00  0.00           H  
HETATM   78  H   UNL     1      -3.872   0.488   2.241  1.00  0.00           H  
HETATM   79  H   UNL     1      -2.668  -0.817   2.112  1.00  0.00           H  
HETATM   80  H   UNL     1       4.315  -3.145   2.144  1.00  0.00           H  
HETATM   81  H   UNL     1      -7.327   1.832  -0.021  1.00  0.00           H  
CONECT    1    2   28   10   34                                       
CONECT    2   24    3    1   12                                       
CONECT    3   11   18    2    4                                       
CONECT    4    3    5   22   35                                       
CONECT    5   30    6    4   21                                       
CONECT    6   17    7    5   36                                       
CONECT    7    8    6   19   20                                       
CONECT    8    7   37   38   39                                       
CONECT    9   20   21   40   41                                       
CONECT   10    1   22   42   43                                       
CONECT   11    3   44   45   46                                       
CONECT   12    2   47   48   49                                       
CONECT   13   24   23   50   51                                       
CONECT   14   25   15   26   26                                       
CONECT   15   14   52   53   54                                       
CONECT   16   32   32   31   23                                       
CONECT   17   18    6   55   56                                       
CONECT   18   17    3   57   58                                       
CONECT   19    7   59   60   61                                       
CONECT   20    7   33    9   62                                       
CONECT   21    5    9   63   64                                       
CONECT   22    4   10   65   66                                       
CONECT   23   16   13   29   28                                       
CONECT   24   13    2   67   68                                       
CONECT   25   27   28   14   69                                       
CONECT   26   14   14   70   71                                       
CONECT   27   29   25   72   73                                       
CONECT   28   23    1   25   74                                       
CONECT   29   23   27   75   76                                       
CONECT   30    5   77   78   79                                       
CONECT   31   16   80                                                 
CONECT   32   16   16                                                 
CONECT   33   20   81                                                 
CONECT   34    1                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   15                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
CONECT   55   17                                                      
CONECT   56   17                                                      
CONECT   57   18                                                      
CONECT   58   18                                                      
CONECT   59   19                                                      
CONECT   60   19                                                      
CONECT   61   19                                                      
CONECT   62   20                                                      
CONECT   63   21                                                      
CONECT   64   21                                                      
CONECT   65   22                                                      
CONECT   66   22                                                      
CONECT   67   24                                                      
CONECT   68   24                                                      
CONECT   69   25                                                      
CONECT   70   26                                                      
CONECT   71   26                                                      
CONECT   72   27                                                      
CONECT   73   27                                                      
CONECT   74   28                                                      
CONECT   75   29                                                      
CONECT   76   29                                                      
CONECT   77   30                                                      
CONECT   78   30                                                      
CONECT   79   30                                                      
CONECT   80   31                                                      
CONECT   81   33                                                      
MASTER        0    0    0    0    0    0    0    0   81    0   81    0
END
