COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.854   6.502   0.616  1.00  0.00           C  
HETATM    2  C   UNL     1       5.928   6.063   1.754  1.00  0.00           C  
HETATM    3  C   UNL     1       4.528   6.635   1.508  1.00  0.00           C  
HETATM    4  C   UNL     1       4.028   6.167   0.139  1.00  0.00           C  
HETATM    5  C   UNL     1       6.263   6.039  -0.719  1.00  0.00           C  
HETATM    6  C   UNL     1      16.875 -13.775   1.420  1.00  0.00           C  
HETATM    7  C   UNL     1      16.817 -12.253   1.569  1.00  0.00           C  
HETATM    8  C   UNL     1      15.488 -11.737   1.016  1.00  0.00           C  
HETATM    9  C   UNL     1      15.430 -10.215   1.165  1.00  0.00           C  
HETATM   10  C   UNL     1      14.100  -9.698   0.612  1.00  0.00           C  
HETATM   11  C   UNL     1      14.043  -8.177   0.761  1.00  0.00           C  
HETATM   12  C   UNL     1      12.713  -7.660   0.208  1.00  0.00           C  
HETATM   13  C   UNL     1      12.655  -6.139   0.357  1.00  0.00           C  
HETATM   14  C   UNL     1      11.325  -5.622  -0.196  1.00  0.00           C  
HETATM   15  C   UNL     1      11.268  -4.100  -0.047  1.00  0.00           C  
HETATM   16  C   UNL     1       9.938  -3.584  -0.600  1.00  0.00           C  
HETATM   17  C   UNL     1       9.880  -2.062  -0.451  1.00  0.00           C  
HETATM   18  C   UNL     1       8.550  -1.546  -1.004  1.00  0.00           C  
HETATM   19  C   UNL     1       8.493  -0.024  -0.855  1.00  0.00           C  
HETATM   20  C   UNL     1       7.163   0.493  -1.408  1.00  0.00           C  
HETATM   21  O   UNL     1       6.089  -0.007  -0.608  1.00  0.00           O  
HETATM   22  C   UNL     1       7.156   2.022  -1.374  1.00  0.00           C  
HETATM   23  O   UNL     1       8.230   2.521  -2.173  1.00  0.00           O  
HETATM   24  C   UNL     1       5.826   2.539  -1.926  1.00  0.00           C  
HETATM   25  C   UNL     1       5.872   4.065  -2.021  1.00  0.00           C  
HETATM   26  O   UNL     1       6.195   4.612  -0.741  1.00  0.00           O  
HETATM   27  O   UNL     1       8.144   5.916   0.796  1.00  0.00           O  
HETATM   28  O   UNL     1       6.433   6.554   2.997  1.00  0.00           O  
HETATM   29  O   UNL     1       4.950   6.581  -0.871  1.00  0.00           O  
HETATM   30  C   UNL     1       2.655   6.783  -0.140  1.00  0.00           C  
HETATM   31  O   UNL     1       2.136   6.256  -1.363  1.00  0.00           O  
HETATM   32  O   UNL     1       4.584   8.063   1.534  1.00  0.00           O  
HETATM   33  C   UNL     1       4.376   8.629   2.829  1.00  0.00           C  
HETATM   34  C   UNL     1       4.456  10.131   2.739  1.00  0.00           C  
HETATM   35  C   UNL     1       3.563  10.873   3.346  1.00  0.00           C  
HETATM   36  N   UNL     1       4.737   2.137  -1.033  1.00  0.00           N  
HETATM   37  C   UNL     1       3.483   2.015  -1.512  1.00  0.00           C  
HETATM   38  O   UNL     1       3.256   2.239  -2.682  1.00  0.00           O  
HETATM   39  C   UNL     1       2.362   1.602  -0.593  1.00  0.00           C  
HETATM   40  C   UNL     1       1.053   1.540  -1.382  1.00  0.00           C  
HETATM   41  C   UNL     1      -0.085   1.121  -0.449  1.00  0.00           C  
HETATM   42  C   UNL     1      -1.395   1.059  -1.237  1.00  0.00           C  
HETATM   43  C   UNL     1      -2.533   0.639  -0.304  1.00  0.00           C  
HETATM   44  C   UNL     1      -3.842   0.578  -1.093  1.00  0.00           C  
HETATM   45  C   UNL     1      -4.980   0.158  -0.160  1.00  0.00           C  
HETATM   46  C   UNL     1      -6.290   0.097  -0.948  1.00  0.00           C  
HETATM   47  C   UNL     1      -7.427  -0.323  -0.015  1.00  0.00           C  
HETATM   48  C   UNL     1      -8.737  -0.384  -0.804  1.00  0.00           C  
HETATM   49  C   UNL     1      -9.875  -0.804   0.129  1.00  0.00           C  
HETATM   50  C   UNL     1     -11.185  -0.866  -0.659  1.00  0.00           C  
HETATM   51  C   UNL     1     -12.322  -1.285   0.274  1.00  0.00           C  
HETATM   52  C   UNL     1     -13.632  -1.347  -0.515  1.00  0.00           C  
HETATM   53  C   UNL     1     -14.770  -1.767   0.418  1.00  0.00           C  
HETATM   54  C   UNL     1     -16.080  -1.828  -0.370  1.00  0.00           C  
HETATM   55  C   UNL     1     -17.217  -2.248   0.563  1.00  0.00           C  
HETATM   56  C   UNL     1     -18.527  -2.309  -0.226  1.00  0.00           C  
HETATM   57  C   UNL     1     -19.665  -2.729   0.707  1.00  0.00           C  
HETATM   58  C   UNL     1     -20.974  -2.790  -0.081  1.00  0.00           C  
HETATM   59  C   UNL     1     -22.112  -3.210   0.851  1.00  0.00           C  
HETATM   60  C   UNL     1     -23.422  -3.272   0.063  1.00  0.00           C  
HETATM   61  C   UNL     1     -24.559  -3.691   0.996  1.00  0.00           C  
HETATM   62  C   UNL     1     -25.869  -3.753   0.207  1.00  0.00           C  
HETATM   63  C   UNL     1     -27.007  -4.173   1.140  1.00  0.00           C  
HETATM   64  H   UNL     1       6.944   7.588   0.617  1.00  0.00           H  
HETATM   65  H   UNL     1       5.877   4.975   1.784  1.00  0.00           H  
HETATM   66  H   UNL     1       3.849   6.283   2.285  1.00  0.00           H  
HETATM   67  H   UNL     1       3.946   5.080   0.134  1.00  0.00           H  
HETATM   68  H   UNL     1       6.896   6.386  -1.536  1.00  0.00           H  
HETATM   69  H   UNL     1      16.792 -14.040   0.366  1.00  0.00           H  
HETATM   70  H   UNL     1      17.823 -14.143   1.814  1.00  0.00           H  
HETATM   71  H   UNL     1      16.052 -14.226   1.974  1.00  0.00           H  
HETATM   72  H   UNL     1      16.900 -11.988   2.623  1.00  0.00           H  
HETATM   73  H   UNL     1      17.641 -11.802   1.015  1.00  0.00           H  
HETATM   74  H   UNL     1      15.405 -12.002  -0.038  1.00  0.00           H  
HETATM   75  H   UNL     1      14.664 -12.187   1.570  1.00  0.00           H  
HETATM   76  H   UNL     1      15.513  -9.950   2.219  1.00  0.00           H  
HETATM   77  H   UNL     1      16.253  -9.764   0.611  1.00  0.00           H  
HETATM   78  H   UNL     1      14.017  -9.964  -0.442  1.00  0.00           H  
HETATM   79  H   UNL     1      13.277 -10.149   1.166  1.00  0.00           H  
HETATM   80  H   UNL     1      14.125  -7.911   1.815  1.00  0.00           H  
HETATM   81  H   UNL     1      14.866  -7.726   0.207  1.00  0.00           H  
HETATM   82  H   UNL     1      12.630  -7.925  -0.846  1.00  0.00           H  
HETATM   83  H   UNL     1      11.889  -8.111   0.762  1.00  0.00           H  
HETATM   84  H   UNL     1      12.738  -5.873   1.411  1.00  0.00           H  
HETATM   85  H   UNL     1      13.479  -5.688  -0.197  1.00  0.00           H  
HETATM   86  H   UNL     1      11.242  -5.887  -1.250  1.00  0.00           H  
HETATM   87  H   UNL     1      10.502  -6.073   0.358  1.00  0.00           H  
HETATM   88  H   UNL     1      11.351  -3.835   1.007  1.00  0.00           H  
HETATM   89  H   UNL     1      12.091  -3.650  -0.601  1.00  0.00           H  
HETATM   90  H   UNL     1       9.855  -3.849  -1.654  1.00  0.00           H  
HETATM   91  H   UNL     1       9.114  -4.035  -0.046  1.00  0.00           H  
HETATM   92  H   UNL     1       9.963  -1.797   0.603  1.00  0.00           H  
HETATM   93  H   UNL     1      10.704  -1.612  -1.005  1.00  0.00           H  
HETATM   94  H   UNL     1       8.467  -1.811  -2.058  1.00  0.00           H  
HETATM   95  H   UNL     1       7.727  -1.996  -0.450  1.00  0.00           H  
HETATM   96  H   UNL     1       8.576   0.241   0.199  1.00  0.00           H  
HETATM   97  H   UNL     1       9.316   0.427  -1.409  1.00  0.00           H  
HETATM   98  H   UNL     1       7.040   0.151  -2.436  1.00  0.00           H  
HETATM   99  H   UNL     1       6.134   0.258   0.321  1.00  0.00           H  
HETATM  100  H   UNL     1       7.279   2.363  -0.346  1.00  0.00           H  
HETATM  101  H   UNL     1       8.228   2.195  -3.083  1.00  0.00           H  
HETATM  102  H   UNL     1       5.657   2.118  -2.918  1.00  0.00           H  
HETATM  103  H   UNL     1       6.630   4.362  -2.745  1.00  0.00           H  
HETATM  104  H   UNL     1       4.898   4.438  -2.340  1.00  0.00           H  
HETATM  105  H   UNL     1       8.782   6.148   0.106  1.00  0.00           H  
HETATM  106  H   UNL     1       7.320   6.237   3.214  1.00  0.00           H  
HETATM  107  H   UNL     1       1.975   6.541   0.677  1.00  0.00           H  
HETATM  108  H   UNL     1       2.753   7.866  -0.223  1.00  0.00           H  
HETATM  109  H   UNL     1       1.266   6.604  -1.603  1.00  0.00           H  
HETATM  110  H   UNL     1       3.392   8.339   3.198  1.00  0.00           H  
HETATM  111  H   UNL     1       5.142   8.265   3.513  1.00  0.00           H  
HETATM  112  H   UNL     1       5.250  10.597   2.174  1.00  0.00           H  
HETATM  113  H   UNL     1       3.620  11.949   3.282  1.00  0.00           H  
HETATM  114  H   UNL     1       2.769  10.407   3.911  1.00  0.00           H  
HETATM  115  H   UNL     1       4.918   1.958  -0.097  1.00  0.00           H  
HETATM  116  H   UNL     1       2.580   0.620  -0.173  1.00  0.00           H  
HETATM  117  H   UNL     1       2.267   2.329   0.214  1.00  0.00           H  
HETATM  118  H   UNL     1       0.835   2.523  -1.801  1.00  0.00           H  
HETATM  119  H   UNL     1       1.148   0.814  -2.188  1.00  0.00           H  
HETATM  120  H   UNL     1       0.133   0.139  -0.029  1.00  0.00           H  
HETATM  121  H   UNL     1      -0.180   1.847   0.358  1.00  0.00           H  
HETATM  122  H   UNL     1      -1.613   2.041  -1.657  1.00  0.00           H  
HETATM  123  H   UNL     1      -1.300   0.333  -2.044  1.00  0.00           H  
HETATM  124  H   UNL     1      -2.315  -0.343   0.116  1.00  0.00           H  
HETATM  125  H   UNL     1      -2.628   1.366   0.503  1.00  0.00           H  
HETATM  126  H   UNL     1      -4.060   1.560  -1.512  1.00  0.00           H  
HETATM  127  H   UNL     1      -3.747  -0.149  -1.899  1.00  0.00           H  
HETATM  128  H   UNL     1      -4.762  -0.824   0.260  1.00  0.00           H  
HETATM  129  H   UNL     1      -5.075   0.885   0.647  1.00  0.00           H  
HETATM  130  H   UNL     1      -6.508   1.079  -1.368  1.00  0.00           H  
HETATM  131  H   UNL     1      -6.194  -0.630  -1.755  1.00  0.00           H  
HETATM  132  H   UNL     1      -7.210  -1.305   0.404  1.00  0.00           H  
HETATM  133  H   UNL     1      -7.523   0.404   0.791  1.00  0.00           H  
HETATM  134  H   UNL     1      -8.955   0.598  -1.223  1.00  0.00           H  
HETATM  135  H   UNL     1      -8.642  -1.111  -1.610  1.00  0.00           H  
HETATM  136  H   UNL     1      -9.657  -1.786   0.549  1.00  0.00           H  
HETATM  137  H   UNL     1      -9.970  -0.077   0.936  1.00  0.00           H  
HETATM  138  H   UNL     1     -11.403   0.116  -1.079  1.00  0.00           H  
HETATM  139  H   UNL     1     -11.089  -1.592  -1.466  1.00  0.00           H  
HETATM  140  H   UNL     1     -12.104  -2.267   0.693  1.00  0.00           H  
HETATM  141  H   UNL     1     -12.418  -0.559   1.080  1.00  0.00           H  
HETATM  142  H   UNL     1     -13.850  -0.365  -0.934  1.00  0.00           H  
HETATM  143  H   UNL     1     -13.537  -2.074  -1.321  1.00  0.00           H  
HETATM  144  H   UNL     1     -14.552  -2.749   0.838  1.00  0.00           H  
HETATM  145  H   UNL     1     -14.865  -1.040   1.225  1.00  0.00           H  
HETATM  146  H   UNL     1     -16.297  -0.846  -0.790  1.00  0.00           H  
HETATM  147  H   UNL     1     -15.984  -2.555  -1.177  1.00  0.00           H  
HETATM  148  H   UNL     1     -16.999  -3.230   0.982  1.00  0.00           H  
HETATM  149  H   UNL     1     -17.312  -1.521   1.369  1.00  0.00           H  
HETATM  150  H   UNL     1     -18.745  -1.327  -0.646  1.00  0.00           H  
HETATM  151  H   UNL     1     -18.432  -3.036  -1.033  1.00  0.00           H  
HETATM  152  H   UNL     1     -19.447  -3.711   1.127  1.00  0.00           H  
HETATM  153  H   UNL     1     -19.760  -2.002   1.514  1.00  0.00           H  
HETATM  154  H   UNL     1     -21.192  -1.808  -0.501  1.00  0.00           H  
HETATM  155  H   UNL     1     -20.879  -3.517  -0.888  1.00  0.00           H  
HETATM  156  H   UNL     1     -21.894  -4.192   1.271  1.00  0.00           H  
HETATM  157  H   UNL     1     -22.207  -2.484   1.658  1.00  0.00           H  
HETATM  158  H   UNL     1     -23.640  -2.289  -0.357  1.00  0.00           H  
HETATM  159  H   UNL     1     -23.327  -3.998  -0.744  1.00  0.00           H  
HETATM  160  H   UNL     1     -24.342  -4.674   1.416  1.00  0.00           H  
HETATM  161  H   UNL     1     -24.655  -2.965   1.803  1.00  0.00           H  
HETATM  162  H   UNL     1     -26.087  -2.771  -0.212  1.00  0.00           H  
HETATM  163  H   UNL     1     -25.774  -4.480  -0.599  1.00  0.00           H  
HETATM  164  H   UNL     1     -26.789  -5.155   1.560  1.00  0.00           H  
HETATM  165  H   UNL     1     -27.102  -3.446   1.947  1.00  0.00           H  
HETATM  166  H   UNL     1     -27.940  -4.216   0.579  1.00  0.00           H  
CONECT    1   27    2    5   64                                       
CONECT    2   28    1    3   65                                       
CONECT    3    2   32    4   66                                       
CONECT    4    3   29   30   67                                       
CONECT    5    1   26   29   68                                       
CONECT    6    7   69   70   71                                       
CONECT    7    6    8   72   73                                       
CONECT    8    9    7   74   75                                       
CONECT    9    8   10   76   77                                       
CONECT   10    9   11   78   79                                       
CONECT   11   10   12   80   81                                       
CONECT   12   11   13   82   83                                       
CONECT   13   12   14   84   85                                       
CONECT   14   13   15   86   87                                       
CONECT   15   14   16   88   89                                       
CONECT   16   15   17   90   91                                       
CONECT   17   16   18   92   93                                       
CONECT   18   17   19   94   95                                       
CONECT   19   18   20   96   97                                       
CONECT   20   21   19   22   98                                       
CONECT   21   20   99                                                 
CONECT   22   20   23   24  100                                       
CONECT   23   22  101                                                 
CONECT   24   22   36   25  102                                       
CONECT   25   24   26  103  104                                       
CONECT   26   25    5                                                 
CONECT   27    1  105                                                 
CONECT   28    2  106                                                 
CONECT   29    5    4                                                 
CONECT   30    4   31  107  108                                       
CONECT   31   30  109                                                 
CONECT   32    3   33                                                 
CONECT   33   34   32  110  111                                       
CONECT   34   35   35   33  112                                       
CONECT   35   34   34  113  114                                       
CONECT   36   24   37  115                                            
CONECT   37   36   39   38   38                                       
CONECT   38   37   37                                                 
CONECT   39   40   37  116  117                                       
CONECT   40   41   39  118  119                                       
CONECT   41   42   40  120  121                                       
CONECT   42   43   41  122  123                                       
CONECT   43   44   42  124  125                                       
CONECT   44   45   43  126  127                                       
CONECT   45   46   44  128  129                                       
CONECT   46   45   47  130  131                                       
CONECT   47   46   48  132  133                                       
CONECT   48   47   49  134  135                                       
CONECT   49   48   50  136  137                                       
CONECT   50   49   51  138  139                                       
CONECT   51   50   52  140  141                                       
CONECT   52   51   53  142  143                                       
CONECT   53   52   54  144  145                                       
CONECT   54   53   55  146  147                                       
CONECT   55   54   56  148  149                                       
CONECT   56   57   55  150  151                                       
CONECT   57   58   56  152  153                                       
CONECT   58   59   57  154  155                                       
CONECT   59   60   58  156  157                                       
CONECT   60   61   59  158  159                                       
CONECT   61   62   60  160  161                                       
CONECT   62   63   61  162  163                                       
CONECT   63   62  164  165  166                                       
CONECT   64    1                                                      
CONECT   65    2                                                      
CONECT   66    3                                                      
CONECT   67    4                                                      
CONECT   68    5                                                      
CONECT   69    6                                                      
CONECT   70    6                                                      
CONECT   71    6                                                      
CONECT   72    7                                                      
CONECT   73    7                                                      
CONECT   74    8                                                      
CONECT   75    8                                                      
CONECT   76    9                                                      
CONECT   77    9                                                      
CONECT   78   10                                                      
CONECT   79   10                                                      
CONECT   80   11                                                      
CONECT   81   11                                                      
CONECT   82   12                                                      
CONECT   83   12                                                      
CONECT   84   13                                                      
CONECT   85   13                                                      
CONECT   86   14                                                      
CONECT   87   14                                                      
CONECT   88   15                                                      
CONECT   89   15                                                      
CONECT   90   16                                                      
CONECT   91   16                                                      
CONECT   92   17                                                      
CONECT   93   17                                                      
CONECT   94   18                                                      
CONECT   95   18                                                      
CONECT   96   19                                                      
CONECT   97   19                                                      
CONECT   98   20                                                      
CONECT   99   21                                                      
CONECT  100   22                                                      
CONECT  101   23                                                      
CONECT  102   24                                                      
CONECT  103   25                                                      
CONECT  104   25                                                      
CONECT  105   27                                                      
CONECT  106   28                                                      
CONECT  107   30                                                      
CONECT  108   30                                                      
CONECT  109   31                                                      
CONECT  110   33                                                      
CONECT  111   33                                                      
CONECT  112   34                                                      
CONECT  113   35                                                      
CONECT  114   35                                                      
CONECT  115   36                                                      
CONECT  116   39                                                      
CONECT  117   39                                                      
CONECT  118   40                                                      
CONECT  119   40                                                      
CONECT  120   41                                                      
CONECT  121   41                                                      
CONECT  122   42                                                      
CONECT  123   42                                                      
CONECT  124   43                                                      
CONECT  125   43                                                      
CONECT  126   44                                                      
CONECT  127   44                                                      
CONECT  128   45                                                      
CONECT  129   45                                                      
CONECT  130   46                                                      
CONECT  131   46                                                      
CONECT  132   47                                                      
CONECT  133   47                                                      
CONECT  134   48                                                      
CONECT  135   48                                                      
CONECT  136   49                                                      
CONECT  137   49                                                      
CONECT  138   50                                                      
CONECT  139   50                                                      
CONECT  140   51                                                      
CONECT  141   51                                                      
CONECT  142   52                                                      
CONECT  143   52                                                      
CONECT  144   53                                                      
CONECT  145   53                                                      
CONECT  146   54                                                      
CONECT  147   54                                                      
CONECT  148   55                                                      
CONECT  149   55                                                      
CONECT  150   56                                                      
CONECT  151   56                                                      
CONECT  152   57                                                      
CONECT  153   57                                                      
CONECT  154   58                                                      
CONECT  155   58                                                      
CONECT  156   59                                                      
CONECT  157   59                                                      
CONECT  158   60                                                      
CONECT  159   60                                                      
CONECT  160   61                                                      
CONECT  161   61                                                      
CONECT  162   62                                                      
CONECT  163   62                                                      
CONECT  164   63                                                      
CONECT  165   63                                                      
CONECT  166   63                                                      
MASTER        0    0    0    0    0    0    0    0  166    0  166    0
END
