COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.459   1.139   2.929  1.00  0.00           O  
HETATM    2  C   UNL     1       5.471   0.701   2.020  1.00  0.00           C  
HETATM    3  C   UNL     1       4.983  -0.543   1.274  1.00  0.00           C  
HETATM    4  O   UNL     1       3.851  -0.204   0.471  1.00  0.00           O  
HETATM    5  C   UNL     1       6.104  -1.073   0.376  1.00  0.00           C  
HETATM    6  O   UNL     1       7.216  -1.467   1.183  1.00  0.00           O  
HETATM    7  C   UNL     1       8.468  -1.447   0.495  1.00  0.00           C  
HETATM    8  C   UNL     1       9.522  -2.177   1.333  1.00  0.00           C  
HETATM    9  O   UNL     1       9.087  -3.514   1.587  1.00  0.00           O  
HETATM   10  C   UNL     1       9.709  -1.438   2.661  1.00  0.00           C  
HETATM   11  O   UNL     1      10.743  -2.070   3.419  1.00  0.00           O  
HETATM   12  C   UNL     1      10.099   0.015   2.374  1.00  0.00           C  
HETATM   13  O   UNL     1      10.205   0.734   3.605  1.00  0.00           O  
HETATM   14  C   UNL     1       9.023   0.661   1.497  1.00  0.00           C  
HETATM   15  C   UNL     1       9.435   2.094   1.156  1.00  0.00           C  
HETATM   16  O   UNL     1       8.380   2.734   0.435  1.00  0.00           O  
HETATM   17  O   UNL     1       8.878  -0.093   0.291  1.00  0.00           O  
HETATM   18  C   UNL     1       5.589  -2.281  -0.412  1.00  0.00           C  
HETATM   19  O   UNL     1       6.606  -2.739  -1.305  1.00  0.00           O  
HETATM   20  C   UNL     1       4.351  -1.865  -1.212  1.00  0.00           C  
HETATM   21  O   UNL     1       3.818  -3.003  -1.894  1.00  0.00           O  
HETATM   22  C   UNL     1       3.297  -1.305  -0.252  1.00  0.00           C  
HETATM   23  O   UNL     1       2.161  -0.863  -0.998  1.00  0.00           O  
HETATM   24  C   UNL     1       1.069  -0.423  -0.187  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.085   0.025  -1.086  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.538  -1.148  -1.957  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.004  -2.298  -1.062  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.457  -3.471  -1.934  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.924  -4.621  -1.039  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.376  -5.794  -1.910  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.178  -6.346  -2.686  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.631  -7.519  -3.557  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.213  -8.620  -2.668  1.00  0.00           C  
HETATM   34  C   UNL     1      -3.411  -8.068  -1.893  1.00  0.00           C  
HETATM   35  C   UNL     1      -2.959  -6.895  -1.021  1.00  0.00           C  
HETATM   36  C   UNL     1      -1.254   0.496  -0.218  1.00  0.00           C  
HETATM   37  O   UNL     1      -2.332   0.914  -1.057  1.00  0.00           O  
HETATM   38  C   UNL     1      -3.480   1.376  -0.342  1.00  0.00           C  
HETATM   39  C   UNL     1      -4.517   1.912  -1.332  1.00  0.00           C  
HETATM   40  O   UNL     1      -3.973   3.031  -2.035  1.00  0.00           O  
HETATM   41  C   UNL     1      -5.768   2.348  -0.563  1.00  0.00           C  
HETATM   42  O   UNL     1      -6.769   2.782  -1.486  1.00  0.00           O  
HETATM   43  C   UNL     1      -6.297   1.161   0.247  1.00  0.00           C  
HETATM   44  O   UNL     1      -7.422   1.576   1.023  1.00  0.00           O  
HETATM   45  C   UNL     1      -8.665   1.525   0.319  1.00  0.00           C  
HETATM   46  C   UNL     1      -9.736   2.269   1.121  1.00  0.00           C  
HETATM   47  O   UNL     1      -9.317   3.617   1.342  1.00  0.00           O  
HETATM   48  C   UNL     1      -9.936   1.566   2.467  1.00  0.00           C  
HETATM   49  O   UNL     1     -10.986   2.210   3.191  1.00  0.00           O  
HETATM   50  C   UNL     1     -10.310   0.102   2.215  1.00  0.00           C  
HETATM   51  O   UNL     1     -10.428  -0.582   3.464  1.00  0.00           O  
HETATM   52  C   UNL     1      -9.216  -0.558   1.372  1.00  0.00           C  
HETATM   53  C   UNL     1      -9.611  -2.004   1.065  1.00  0.00           C  
HETATM   54  O   UNL     1      -8.540  -2.655   0.378  1.00  0.00           O  
HETATM   55  O   UNL     1      -9.060   0.163   0.148  1.00  0.00           O  
HETATM   56  C   UNL     1      -5.191   0.654   1.176  1.00  0.00           C  
HETATM   57  C   UNL     1      -5.692  -0.570   1.945  1.00  0.00           C  
HETATM   58  O   UNL     1      -4.696  -0.983   2.884  1.00  0.00           O  
HETATM   59  O   UNL     1      -4.046   0.294   0.400  1.00  0.00           O  
HETATM   60  C   UNL     1       0.382   1.175  -1.981  1.00  0.00           C  
HETATM   61  C   UNL     1       0.834   2.348  -1.109  1.00  0.00           C  
HETATM   62  C   UNL     1       1.301   3.498  -2.004  1.00  0.00           C  
HETATM   63  C   UNL     1       1.754   4.671  -1.133  1.00  0.00           C  
HETATM   64  C   UNL     1       2.220   5.821  -2.027  1.00  0.00           C  
HETATM   65  C   UNL     1       3.466   5.390  -2.804  1.00  0.00           C  
HETATM   66  C   UNL     1       3.933   6.539  -3.699  1.00  0.00           C  
HETATM   67  C   UNL     1       4.267   7.756  -2.833  1.00  0.00           C  
HETATM   68  C   UNL     1       3.022   8.187  -2.057  1.00  0.00           C  
HETATM   69  C   UNL     1       2.555   7.037  -1.162  1.00  0.00           C  
HETATM   70  H   UNL     1       4.701   1.925   3.437  1.00  0.00           H  
HETATM   71  H   UNL     1       5.683   1.494   1.303  1.00  0.00           H  
HETATM   72  H   UNL     1       6.378   0.459   2.574  1.00  0.00           H  
HETATM   73  H   UNL     1       4.700  -1.311   1.994  1.00  0.00           H  
HETATM   74  H   UNL     1       6.416  -0.291  -0.317  1.00  0.00           H  
HETATM   75  H   UNL     1       8.362  -1.944  -0.469  1.00  0.00           H  
HETATM   76  H   UNL     1      10.468  -2.197   0.791  1.00  0.00           H  
HETATM   77  H   UNL     1       8.944  -4.040   0.788  1.00  0.00           H  
HETATM   78  H   UNL     1       8.777  -1.462   3.226  1.00  0.00           H  
HETATM   79  H   UNL     1      10.565  -2.996   3.631  1.00  0.00           H  
HETATM   80  H   UNL     1      11.057   0.039   1.855  1.00  0.00           H  
HETATM   81  H   UNL     1      10.866   0.376   4.213  1.00  0.00           H  
HETATM   82  H   UNL     1       8.075   0.673   2.034  1.00  0.00           H  
HETATM   83  H   UNL     1       9.633   2.644   2.076  1.00  0.00           H  
HETATM   84  H   UNL     1      10.336   2.077   0.542  1.00  0.00           H  
HETATM   85  H   UNL     1       8.572   3.648   0.185  1.00  0.00           H  
HETATM   86  H   UNL     1       5.324  -3.081   0.280  1.00  0.00           H  
HETATM   87  H   UNL     1       6.347  -3.504  -1.837  1.00  0.00           H  
HETATM   88  H   UNL     1       4.626  -1.101  -1.938  1.00  0.00           H  
HETATM   89  H   UNL     1       3.031  -2.812  -2.421  1.00  0.00           H  
HETATM   90  H   UNL     1       2.993  -2.083   0.448  1.00  0.00           H  
HETATM   91  H   UNL     1       0.737  -1.242   0.451  1.00  0.00           H  
HETATM   92  H   UNL     1       1.392   0.413   0.434  1.00  0.00           H  
HETATM   93  H   UNL     1      -1.360  -0.829  -2.597  1.00  0.00           H  
HETATM   94  H   UNL     1       0.295  -1.484  -2.576  1.00  0.00           H  
HETATM   95  H   UNL     1      -0.182  -2.617  -0.422  1.00  0.00           H  
HETATM   96  H   UNL     1      -1.837  -1.962  -0.444  1.00  0.00           H  
HETATM   97  H   UNL     1      -2.280  -3.152  -2.574  1.00  0.00           H  
HETATM   98  H   UNL     1      -0.624  -3.807  -2.552  1.00  0.00           H  
HETATM   99  H   UNL     1      -1.101  -4.940  -0.399  1.00  0.00           H  
HETATM  100  H   UNL     1      -2.756  -4.286  -0.421  1.00  0.00           H  
HETATM  101  H   UNL     1      -3.138  -5.453  -2.612  1.00  0.00           H  
HETATM  102  H   UNL     1      -0.763  -5.562  -3.319  1.00  0.00           H  
HETATM  103  H   UNL     1      -0.417  -6.687  -1.984  1.00  0.00           H  
HETATM  104  H   UNL     1      -2.392  -7.178  -4.259  1.00  0.00           H  
HETATM  105  H   UNL     1      -0.777  -7.912  -4.110  1.00  0.00           H  
HETATM  106  H   UNL     1      -2.536  -9.456  -3.289  1.00  0.00           H  
HETATM  107  H   UNL     1      -1.452  -8.961  -1.967  1.00  0.00           H  
HETATM  108  H   UNL     1      -4.173  -7.727  -2.595  1.00  0.00           H  
HETATM  109  H   UNL     1      -3.826  -8.853  -1.260  1.00  0.00           H  
HETATM  110  H   UNL     1      -2.198  -7.236  -0.320  1.00  0.00           H  
HETATM  111  H   UNL     1      -3.812  -6.502  -0.469  1.00  0.00           H  
HETATM  112  H   UNL     1      -1.586  -0.323   0.420  1.00  0.00           H  
HETATM  113  H   UNL     1      -0.931   1.332   0.403  1.00  0.00           H  
HETATM  114  H   UNL     1      -3.186   2.171   0.343  1.00  0.00           H  
HETATM  115  H   UNL     1      -4.780   1.128  -2.043  1.00  0.00           H  
HETATM  116  H   UNL     1      -3.175   2.827  -2.541  1.00  0.00           H  
HETATM  117  H   UNL     1      -5.514   3.166   0.112  1.00  0.00           H  
HETATM  118  H   UNL     1      -6.499   3.528  -2.038  1.00  0.00           H  
HETATM  119  H   UNL     1      -6.597   0.362  -0.432  1.00  0.00           H  
HETATM  120  H   UNL     1      -8.548   1.996  -0.657  1.00  0.00           H  
HETATM  121  H   UNL     1     -10.674   2.266   0.566  1.00  0.00           H  
HETATM  122  H   UNL     1      -9.167   4.121   0.530  1.00  0.00           H  
HETATM  123  H   UNL     1      -9.012   1.614   3.044  1.00  0.00           H  
HETATM  124  H   UNL     1     -10.818   3.144   3.380  1.00  0.00           H  
HETATM  125  H   UNL     1     -11.259   0.055   1.682  1.00  0.00           H  
HETATM  126  H   UNL     1     -11.100  -0.213   4.053  1.00  0.00           H  
HETATM  127  H   UNL     1      -8.276  -0.547   1.922  1.00  0.00           H  
HETATM  128  H   UNL     1      -9.817  -2.530   1.998  1.00  0.00           H  
HETATM  129  H   UNL     1     -10.503  -2.012   0.439  1.00  0.00           H  
HETATM  130  H   UNL     1      -8.722  -3.578   0.152  1.00  0.00           H  
HETATM  131  H   UNL     1      -4.919   1.440   1.881  1.00  0.00           H  
HETATM  132  H   UNL     1      -6.609  -0.315   2.476  1.00  0.00           H  
HETATM  133  H   UNL     1      -5.891  -1.382   1.246  1.00  0.00           H  
HETATM  134  H   UNL     1      -4.947  -1.756   3.408  1.00  0.00           H  
HETATM  135  H   UNL     1       1.214   0.839  -2.599  1.00  0.00           H  
HETATM  136  H   UNL     1      -0.441   1.494  -2.621  1.00  0.00           H  
HETATM  137  H   UNL     1       0.002   2.684  -0.491  1.00  0.00           H  
HETATM  138  H   UNL     1       1.657   2.029  -0.469  1.00  0.00           H  
HETATM  139  H   UNL     1       2.134   3.162  -2.622  1.00  0.00           H  
HETATM  140  H   UNL     1       0.479   3.817  -2.644  1.00  0.00           H  
HETATM  141  H   UNL     1       0.921   5.007  -0.514  1.00  0.00           H  
HETATM  142  H   UNL     1       2.576   4.352  -0.492  1.00  0.00           H  
HETATM  143  H   UNL     1       1.427   6.081  -2.728  1.00  0.00           H  
HETATM  144  H   UNL     1       4.259   5.129  -2.103  1.00  0.00           H  
HETATM  145  H   UNL     1       3.227   4.523  -3.421  1.00  0.00           H  
HETATM  146  H   UNL     1       4.820   6.232  -4.252  1.00  0.00           H  
HETATM  147  H   UNL     1       3.139   6.799  -4.400  1.00  0.00           H  
HETATM  148  H   UNL     1       5.061   7.496  -2.133  1.00  0.00           H  
HETATM  149  H   UNL     1       4.600   8.575  -3.471  1.00  0.00           H  
HETATM  150  H   UNL     1       3.260   9.054  -1.440  1.00  0.00           H  
HETATM  151  H   UNL     1       2.228   8.447  -2.758  1.00  0.00           H  
HETATM  152  H   UNL     1       1.668   7.345  -0.609  1.00  0.00           H  
HETATM  153  H   UNL     1       3.348   6.778  -0.461  1.00  0.00           H  
CONECT    1    2   70                                                 
CONECT    2    1    3   71   72                                       
CONECT    3    5    2    4   73                                       
CONECT    4    3   22                                                 
CONECT    5    6   18    3   74                                       
CONECT    6    5    7                                                 
CONECT    7    6    8   17   75                                       
CONECT    8    9    7   10   76                                       
CONECT    9    8   77                                                 
CONECT   10    8   11   12   78                                       
CONECT   11   10   79                                                 
CONECT   12   10   14   13   80                                       
CONECT   13   12   81                                                 
CONECT   14   17   12   15   82                                       
CONECT   15   14   16   83   84                                       
CONECT   16   15   85                                                 
CONECT   17    7   14                                                 
CONECT   18   19    5   20   86                                       
CONECT   19   18   87                                                 
CONECT   20   21   18   22   88                                       
CONECT   21   20   89                                                 
CONECT   22   20   23    4   90                                       
CONECT   23   22   24                                                 
CONECT   24   23   25   91   92                                       
CONECT   25   60   24   36   26                                       
CONECT   26   25   27   93   94                                       
CONECT   27   28   26   95   96                                       
CONECT   28   27   29   97   98                                       
CONECT   29   30   28   99  100                                       
CONECT   30   31   35   29  101                                       
CONECT   31   32   30  102  103                                       
CONECT   32   33   31  104  105                                       
CONECT   33   32   34  106  107                                       
CONECT   34   33   35  108  109                                       
CONECT   35   34   30  110  111                                       
CONECT   36   25   37  112  113                                       
CONECT   37   38   36                                                 
CONECT   38   59   37   39  114                                       
CONECT   39   38   41   40  115                                       
CONECT   40   39  116                                                 
CONECT   41   39   43   42  117                                       
CONECT   42   41  118                                                 
CONECT   43   56   44   41  119                                       
CONECT   44   43   45                                                 
CONECT   45   44   55   46  120                                       
CONECT   46   48   47   45  121                                       
CONECT   47   46  122                                                 
CONECT   48   50   46   49  123                                       
CONECT   49   48  124                                                 
CONECT   50   51   48   52  125                                       
CONECT   51   50  126                                                 
CONECT   52   50   55   53  127                                       
CONECT   53   52   54  128  129                                       
CONECT   54   53  130                                                 
CONECT   55   52   45                                                 
CONECT   56   59   57   43  131                                       
CONECT   57   56   58  132  133                                       
CONECT   58   57  134                                                 
CONECT   59   38   56                                                 
CONECT   60   61   25  135  136                                       
CONECT   61   62   60  137  138                                       
CONECT   62   63   61  139  140                                       
CONECT   63   64   62  141  142                                       
CONECT   64   65   69   63  143                                       
CONECT   65   66   64  144  145                                       
CONECT   66   67   65  146  147                                       
CONECT   67   66   68  148  149                                       
CONECT   68   67   69  150  151                                       
CONECT   69   68   64  152  153                                       
CONECT   70    1                                                      
CONECT   71    2                                                      
CONECT   72    2                                                      
CONECT   73    3                                                      
CONECT   74    5                                                      
CONECT   75    7                                                      
CONECT   76    8                                                      
CONECT   77    9                                                      
CONECT   78   10                                                      
CONECT   79   11                                                      
CONECT   80   12                                                      
CONECT   81   13                                                      
CONECT   82   14                                                      
CONECT   83   15                                                      
CONECT   84   15                                                      
CONECT   85   16                                                      
CONECT   86   18                                                      
CONECT   87   19                                                      
CONECT   88   20                                                      
CONECT   89   21                                                      
CONECT   90   22                                                      
CONECT   91   24                                                      
CONECT   92   24                                                      
CONECT   93   26                                                      
CONECT   94   26                                                      
CONECT   95   27                                                      
CONECT   96   27                                                      
CONECT   97   28                                                      
CONECT   98   28                                                      
CONECT   99   29                                                      
CONECT  100   29                                                      
CONECT  101   30                                                      
CONECT  102   31                                                      
CONECT  103   31                                                      
CONECT  104   32                                                      
CONECT  105   32                                                      
CONECT  106   33                                                      
CONECT  107   33                                                      
CONECT  108   34                                                      
CONECT  109   34                                                      
CONECT  110   35                                                      
CONECT  111   35                                                      
CONECT  112   36                                                      
CONECT  113   36                                                      
CONECT  114   38                                                      
CONECT  115   39                                                      
CONECT  116   40                                                      
CONECT  117   41                                                      
CONECT  118   42                                                      
CONECT  119   43                                                      
CONECT  120   45                                                      
CONECT  121   46                                                      
CONECT  122   47                                                      
CONECT  123   48                                                      
CONECT  124   49                                                      
CONECT  125   50                                                      
CONECT  126   51                                                      
CONECT  127   52                                                      
CONECT  128   53                                                      
CONECT  129   53                                                      
CONECT  130   54                                                      
CONECT  131   56                                                      
CONECT  132   57                                                      
CONECT  133   57                                                      
CONECT  134   58                                                      
CONECT  135   60                                                      
CONECT  136   60                                                      
CONECT  137   61                                                      
CONECT  138   61                                                      
CONECT  139   62                                                      
CONECT  140   62                                                      
CONECT  141   63                                                      
CONECT  142   63                                                      
CONECT  143   64                                                      
CONECT  144   65                                                      
CONECT  145   65                                                      
CONECT  146   66                                                      
CONECT  147   66                                                      
CONECT  148   67                                                      
CONECT  149   67                                                      
CONECT  150   68                                                      
CONECT  151   68                                                      
CONECT  152   69                                                      
CONECT  153   69                                                      
MASTER        0    0    0    0    0    0    0    0  153    0  153    0
END
