COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.287   1.938   0.190  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.659   3.333  -0.210  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.499   1.768  -1.994  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.732   2.642  -2.234  1.00  0.00           C  
HETATM    5  C   UNL     1       8.091  -0.404   0.860  1.00  0.00           C  
HETATM    6  C   UNL     1       2.225  -3.032   0.384  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.173  -1.398   1.085  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.968  -1.713  -0.621  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.803   0.338   0.793  1.00  0.00           C  
HETATM   10  C   UNL     1       4.750  -0.540  -1.833  1.00  0.00           C  
HETATM   11  C   UNL     1       4.760   0.396  -0.588  1.00  0.00           C  
HETATM   12  C   UNL     1       3.297   0.303  -0.041  1.00  0.00           C  
HETATM   13  C   UNL     1       2.679  -0.877  -0.768  1.00  0.00           C  
HETATM   14  C   UNL     1       3.902  -1.721  -1.242  1.00  0.00           C  
HETATM   15  C   UNL     1       1.635  -1.707  -0.114  1.00  0.00           C  
HETATM   16  C   UNL     1       0.832  -1.128   1.004  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.189  -0.093   0.678  1.00  0.00           C  
HETATM   18  C   UNL     1       0.181   1.008  -0.276  1.00  0.00           C  
HETATM   19  C   UNL     1       2.644   1.614  -0.343  1.00  0.00           C  
HETATM   20  C   UNL     1       0.874   3.331  -0.394  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.071   1.882  -0.530  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.837   0.311  -2.315  1.00  0.00           C  
HETATM   23  C   UNL     1       1.333   2.077   1.710  1.00  0.00           C  
HETATM   24  C   UNL     1       5.749  -0.089   0.459  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.075  -2.427   0.399  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.771  -0.622   0.096  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.598   1.396   1.561  1.00  0.00           C  
HETATM   28  O   UNL     1       7.079   0.028  -0.051  1.00  0.00           O  
HETATM   29  O   UNL     1       1.673  -0.723   2.072  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.320  -0.789   0.113  1.00  0.00           O  
HETATM   31  O   UNL     1      -2.981  -0.395   1.704  1.00  0.00           O  
HETATM   32  O   UNL     1      -3.698   2.357   2.116  1.00  0.00           O  
HETATM   33  O   UNL     1      -5.553   0.099  -0.858  1.00  0.00           O  
HETATM   34  O   UNL     1      -4.865  -2.654  -1.213  1.00  0.00           O  
HETATM   35  O   UNL     1      -2.269  -3.398  -0.271  1.00  0.00           O  
HETATM   36  H   UNL     1      -0.935   3.598   0.809  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.126   4.025  -0.914  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.685   2.103  -2.637  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.491   3.681  -2.006  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.037   2.561  -3.277  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.545   2.308  -1.590  1.00  0.00           H  
HETATM   42  H   UNL     1       9.071  -0.283   0.399  1.00  0.00           H  
HETATM   43  H   UNL     1       8.042   0.195   1.770  1.00  0.00           H  
HETATM   44  H   UNL     1       7.933  -1.454   1.108  1.00  0.00           H  
HETATM   45  H   UNL     1       3.016  -2.829   1.106  1.00  0.00           H  
HETATM   46  H   UNL     1       1.441  -3.623   0.859  1.00  0.00           H  
HETATM   47  H   UNL     1       2.636  -3.586  -0.460  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.566  -1.894   1.841  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.348  -1.260  -1.395  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.174   0.825   0.048  1.00  0.00           H  
HETATM   51  H   UNL     1       4.228  -0.080  -2.656  1.00  0.00           H  
HETATM   52  H   UNL     1       5.748  -0.873  -2.072  1.00  0.00           H  
HETATM   53  H   UNL     1       4.967   1.414  -0.895  1.00  0.00           H  
HETATM   54  H   UNL     1       3.356   0.135   1.020  1.00  0.00           H  
HETATM   55  H   UNL     1       2.230  -0.464  -1.709  1.00  0.00           H  
HETATM   56  H   UNL     1       3.618  -2.399  -2.042  1.00  0.00           H  
HETATM   57  H   UNL     1       4.435  -2.196  -0.441  1.00  0.00           H  
HETATM   58  H   UNL     1       0.902  -1.988  -0.902  1.00  0.00           H  
HETATM   59  H   UNL     1       0.248  -1.991   1.409  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.556   0.343   1.614  1.00  0.00           H  
HETATM   61  H   UNL     1       0.476   0.563  -1.238  1.00  0.00           H  
HETATM   62  H   UNL     1       2.590   1.703  -1.436  1.00  0.00           H  
HETATM   63  H   UNL     1       3.325   2.406  -0.009  1.00  0.00           H  
HETATM   64  H   UNL     1       1.344   4.128   0.176  1.00  0.00           H  
HETATM   65  H   UNL     1       1.143   3.384  -1.447  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.881   1.568   0.127  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.975   0.198  -3.390  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.021  -0.332  -1.984  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.754   0.029  -1.798  1.00  0.00           H  
HETATM   70  H   UNL     1       1.886   2.977   1.976  1.00  0.00           H  
HETATM   71  H   UNL     1       0.317   2.146   2.099  1.00  0.00           H  
HETATM   72  H   UNL     1       1.829   1.206   2.139  1.00  0.00           H  
HETATM   73  H   UNL     1       5.651   0.516   1.360  1.00  0.00           H  
HETATM   74  H   UNL     1       5.543  -1.132   0.698  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.697  -2.921   1.145  1.00  0.00           H  
HETATM   76  H   UNL     1      -5.427  -1.079   0.836  1.00  0.00           H  
HETATM   77  H   UNL     1      -5.289   1.895   0.881  1.00  0.00           H  
HETATM   78  H   UNL     1      -5.159   0.917   2.363  1.00  0.00           H  
HETATM   79  H   UNL     1       2.349  -1.373   2.309  1.00  0.00           H  
HETATM   80  H   UNL     1      -4.134   3.060   2.618  1.00  0.00           H  
HETATM   81  H   UNL     1      -6.186  -0.449  -1.342  1.00  0.00           H  
HETATM   82  H   UNL     1      -4.424  -3.374  -1.684  1.00  0.00           H  
HETATM   83  H   UNL     1      -1.677  -3.889   0.315  1.00  0.00           H  
CONECT    1   18   20   23   19                                       
CONECT    2   21   20   36   37                                       
CONECT    3    4   22   21   38                                       
CONECT    4    3   39   40   41                                       
CONECT    5   28   42   43   44                                       
CONECT    6   15   45   46   47                                       
CONECT    7   25   30   31   48                                       
CONECT    8   34   26   25   49                                       
CONECT    9   26   27   31   50                                       
CONECT   10   14   11   51   52                                       
CONECT   11   12   10   24   53                                       
CONECT   12   13   19   11   54                                       
CONECT   13   15   14   12   55                                       
CONECT   14   13   10   56   57                                       
CONECT   15   16   13    6   58                                       
CONECT   16   29   17   15   59                                       
CONECT   17   30   16   18   60                                       
CONECT   18   21   17    1   61                                       
CONECT   19    1   12   62   63                                       
CONECT   20    2    1   64   65                                       
CONECT   21    3    2   18   66                                       
CONECT   22    3   67   68   69                                       
CONECT   23    1   70   71   72                                       
CONECT   24   11   28   73   74                                       
CONECT   25    8   35    7   75                                       
CONECT   26   33    8    9   76                                       
CONECT   27    9   32   77   78                                       
CONECT   28   24    5                                                 
CONECT   29   16   79                                                 
CONECT   30    7   17                                                 
CONECT   31    9    7                                                 
CONECT   32   27   80                                                 
CONECT   33   26   81                                                 
CONECT   34    8   82                                                 
CONECT   35   25   83                                                 
CONECT   36    2                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   12                                                      
CONECT   55   13                                                      
CONECT   56   14                                                      
CONECT   57   14                                                      
CONECT   58   15                                                      
CONECT   59   16                                                      
CONECT   60   17                                                      
CONECT   61   18                                                      
CONECT   62   19                                                      
CONECT   63   19                                                      
CONECT   64   20                                                      
CONECT   65   20                                                      
CONECT   66   21                                                      
CONECT   67   22                                                      
CONECT   68   22                                                      
CONECT   69   22                                                      
CONECT   70   23                                                      
CONECT   71   23                                                      
CONECT   72   23                                                      
CONECT   73   24                                                      
CONECT   74   24                                                      
CONECT   75   25                                                      
CONECT   76   26                                                      
CONECT   77   27                                                      
CONECT   78   27                                                      
CONECT   79   29                                                      
CONECT   80   32                                                      
CONECT   81   33                                                      
CONECT   82   34                                                      
CONECT   83   35                                                      
MASTER        0    0    0    0    0    0    0    0   83    0   83    0
END
