COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.826   1.759  -0.663  1.00  0.00           C  
HETATM    2  C   UNL     1       7.713   0.639  -1.141  1.00  0.00           C  
HETATM    3  C   UNL     1       7.738  -0.481  -0.438  1.00  0.00           C  
HETATM    4  C   UNL     1       8.581  -1.670  -0.795  1.00  0.00           C  
HETATM    5  C   UNL     1       9.043  -1.570  -2.251  1.00  0.00           C  
HETATM    6  C   UNL     1       9.644  -0.176  -2.476  1.00  0.00           C  
HETATM    7  C   UNL     1       8.515   0.855  -2.391  1.00  0.00           C  
HETATM    8  C   UNL     1       9.804  -1.719   0.123  1.00  0.00           C  
HETATM    9  C   UNL     1       7.761  -2.948  -0.611  1.00  0.00           C  
HETATM   10  C   UNL     1       6.921  -0.563   0.717  1.00  0.00           C  
HETATM   11  C   UNL     1       5.577  -0.386   0.614  1.00  0.00           C  
HETATM   12  C   UNL     1       4.758  -0.551   1.745  1.00  0.00           C  
HETATM   13  C   UNL     1       3.409  -0.373   1.641  1.00  0.00           C  
HETATM   14  C   UNL     1       2.591  -0.538   2.768  1.00  0.00           C  
HETATM   15  C   UNL     1       1.222  -0.464   2.642  1.00  0.00           C  
HETATM   16  C   UNL     1       0.641  -0.339   1.374  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.042   0.810   1.040  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.156   1.851   1.968  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.839   3.000   1.633  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.420   3.125   0.366  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.103   4.273   0.032  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.225   5.395   1.031  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.684   4.399  -1.238  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.579   3.465  -1.674  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.015   2.449  -0.805  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.979   1.580  -1.205  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.583   1.705  -2.580  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.418   0.555  -0.329  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.367  -0.300  -0.723  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.834  -1.389   0.208  1.00  0.00           C  
HETATM   31  C   UNL     1      -8.303  -1.225   0.469  1.00  0.00           C  
HETATM   32  C   UNL     1      -9.222  -1.952  -0.081  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.947  -3.065  -1.049  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.526  -2.941  -1.605  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.560  -2.753  -0.429  1.00  0.00           C  
HETATM   36  C   UNL     1      -6.782  -3.861   0.602  1.00  0.00           C  
HETATM   37  C   UNL     1      -5.117  -2.803  -0.936  1.00  0.00           C  
HETATM   38  C   UNL     1      -8.734  -0.149   1.431  1.00  0.00           C  
HETATM   39  C   UNL     1       0.764  -1.461   0.375  1.00  0.00           C  
HETATM   40  C   UNL     1       5.369  -0.925   3.070  1.00  0.00           C  
HETATM   41  H   UNL     1       6.979   2.637  -1.291  1.00  0.00           H  
HETATM   42  H   UNL     1       5.783   1.448  -0.722  1.00  0.00           H  
HETATM   43  H   UNL     1       7.074   2.004   0.370  1.00  0.00           H  
HETATM   44  H   UNL     1       9.799  -2.330  -2.448  1.00  0.00           H  
HETATM   45  H   UNL     1       8.192  -1.714  -2.916  1.00  0.00           H  
HETATM   46  H   UNL     1      10.391   0.029  -1.710  1.00  0.00           H  
HETATM   47  H   UNL     1      10.105  -0.132  -3.463  1.00  0.00           H  
HETATM   48  H   UNL     1       7.864   0.756  -3.260  1.00  0.00           H  
HETATM   49  H   UNL     1       8.945   1.857  -2.376  1.00  0.00           H  
HETATM   50  H   UNL     1       9.477  -1.802   1.159  1.00  0.00           H  
HETATM   51  H   UNL     1      10.418  -2.582  -0.135  1.00  0.00           H  
HETATM   52  H   UNL     1      10.388  -0.807  -0.001  1.00  0.00           H  
HETATM   53  H   UNL     1       6.933  -2.954  -1.320  1.00  0.00           H  
HETATM   54  H   UNL     1       8.396  -3.816  -0.786  1.00  0.00           H  
HETATM   55  H   UNL     1       7.368  -2.984   0.405  1.00  0.00           H  
HETATM   56  H   UNL     1       7.366  -0.767   1.680  1.00  0.00           H  
HETATM   57  H   UNL     1       5.140  -0.117  -0.336  1.00  0.00           H  
HETATM   58  H   UNL     1       2.971  -0.104   0.691  1.00  0.00           H  
HETATM   59  H   UNL     1       3.036  -0.722   3.735  1.00  0.00           H  
HETATM   60  H   UNL     1       0.596  -0.504   3.521  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.490   0.906   0.062  1.00  0.00           H  
HETATM   62  H   UNL     1       0.292   1.755   2.946  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.927   3.804   2.349  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.332   2.322  -0.350  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.429   6.120   0.862  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.193   5.883   0.912  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.143   4.993   2.040  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.424   5.234  -1.871  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.953   3.507  -2.686  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.582   2.359   0.181  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.007   1.106  -3.286  1.00  0.00           H  
HETATM   72  H   UNL     1      -6.613   1.350  -2.559  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.566   2.750  -2.891  1.00  0.00           H  
HETATM   74  H   UNL     1      -4.986   0.465   0.656  1.00  0.00           H  
HETATM   75  H   UNL     1      -6.800  -0.210  -1.708  1.00  0.00           H  
HETATM   76  H   UNL     1      -6.290  -1.316   1.150  1.00  0.00           H  
HETATM   77  H   UNL     1     -10.251  -1.744   0.172  1.00  0.00           H  
HETATM   78  H   UNL     1      -9.052  -4.023  -0.538  1.00  0.00           H  
HETATM   79  H   UNL     1      -9.662  -3.015  -1.870  1.00  0.00           H  
HETATM   80  H   UNL     1      -7.266  -3.848  -2.151  1.00  0.00           H  
HETATM   81  H   UNL     1      -7.467  -2.080  -2.270  1.00  0.00           H  
HETATM   82  H   UNL     1      -6.602  -4.831   0.138  1.00  0.00           H  
HETATM   83  H   UNL     1      -6.094  -3.724   1.436  1.00  0.00           H  
HETATM   84  H   UNL     1      -7.808  -3.818   0.967  1.00  0.00           H  
HETATM   85  H   UNL     1      -4.960  -2.008  -1.664  1.00  0.00           H  
HETATM   86  H   UNL     1      -4.433  -2.669  -0.098  1.00  0.00           H  
HETATM   87  H   UNL     1      -4.931  -3.769  -1.406  1.00  0.00           H  
HETATM   88  H   UNL     1      -8.902   0.780   0.886  1.00  0.00           H  
HETATM   89  H   UNL     1      -9.658  -0.452   1.925  1.00  0.00           H  
HETATM   90  H   UNL     1      -7.956   0.004   2.178  1.00  0.00           H  
HETATM   91  H   UNL     1      -0.121  -2.095   0.431  1.00  0.00           H  
HETATM   92  H   UNL     1       0.851  -1.045  -0.629  1.00  0.00           H  
HETATM   93  H   UNL     1       1.650  -2.053   0.601  1.00  0.00           H  
HETATM   94  H   UNL     1       5.630  -0.020   3.618  1.00  0.00           H  
HETATM   95  H   UNL     1       4.652  -1.507   3.650  1.00  0.00           H  
HETATM   96  H   UNL     1       6.267  -1.520   2.901  1.00  0.00           H  
CONECT    1    2   41   42   43                                       
CONECT    2    3    3    1    7                                       
CONECT    3   10    4    2    2                                       
CONECT    4    9    8    3    5                                       
CONECT    5    4    6   44   45                                       
CONECT    6    5    7   46   47                                       
CONECT    7    2    6   48   49                                       
CONECT    8    4   50   51   52                                       
CONECT    9    4   53   54   55                                       
CONECT   10   11   11    3   56                                       
CONECT   11   12   10   10   57                                       
CONECT   12   13   13   40   11                                       
CONECT   13   14   12   12   58                                       
CONECT   14   15   15   13   59                                       
CONECT   15   16   14   14   60                                       
CONECT   16   17   17   15   39                                       
CONECT   17   18   16   16   61                                       
CONECT   18   19   19   17   62                                       
CONECT   19   20   18   18   63                                       
CONECT   20   21   21   19   64                                       
CONECT   21   22   23   20   20                                       
CONECT   22   21   65   66   67                                       
CONECT   23   24   24   21   68                                       
CONECT   24   25   23   23   69                                       
CONECT   25   26   26   24   70                                       
CONECT   26   28   27   25   25                                       
CONECT   27   26   71   72   73                                       
CONECT   28   29   29   26   74                                       
CONECT   29   30   28   28   75                                       
CONECT   30   35   31   29   76                                       
CONECT   31   32   32   30   38                                       
CONECT   32   33   31   31   77                                       
CONECT   33   34   32   78   79                                       
CONECT   34   33   35   80   81                                       
CONECT   35   36   34   37   30                                       
CONECT   36   35   82   83   84                                       
CONECT   37   35   85   86   87                                       
CONECT   38   31   88   89   90                                       
CONECT   39   16   91   92   93                                       
CONECT   40   12   94   95   96                                       
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    5                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    8                                                      
CONECT   52    8                                                      
CONECT   53    9                                                      
CONECT   54    9                                                      
CONECT   55    9                                                      
CONECT   56   10                                                      
CONECT   57   11                                                      
CONECT   58   13                                                      
CONECT   59   14                                                      
CONECT   60   15                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   19                                                      
CONECT   64   20                                                      
CONECT   65   22                                                      
CONECT   66   22                                                      
CONECT   67   22                                                      
CONECT   68   23                                                      
CONECT   69   24                                                      
CONECT   70   25                                                      
CONECT   71   27                                                      
CONECT   72   27                                                      
CONECT   73   27                                                      
CONECT   74   28                                                      
CONECT   75   29                                                      
CONECT   76   30                                                      
CONECT   77   32                                                      
CONECT   78   33                                                      
CONECT   79   33                                                      
CONECT   80   34                                                      
CONECT   81   34                                                      
CONECT   82   36                                                      
CONECT   83   36                                                      
CONECT   84   36                                                      
CONECT   85   37                                                      
CONECT   86   37                                                      
CONECT   87   37                                                      
CONECT   88   38                                                      
CONECT   89   38                                                      
CONECT   90   38                                                      
CONECT   91   39                                                      
CONECT   92   39                                                      
CONECT   93   39                                                      
CONECT   94   40                                                      
CONECT   95   40                                                      
CONECT   96   40                                                      
MASTER        0    0    0    0    0    0    0    0   96    0   96    0
END
