COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.711  -3.027  -1.534  1.00  0.00           C  
HETATM    2  C   UNL     1       7.199  -1.452  -1.467  1.00  0.00           C  
HETATM    3  C   UNL     1       4.958  -0.481  -1.997  1.00  0.00           C  
HETATM    4  C   UNL     1       2.718   0.490  -2.527  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.292   1.723  -4.467  1.00  0.00           C  
HETATM    6  C   UNL     1      19.672  -6.911   0.586  1.00  0.00           C  
HETATM    7  C   UNL     1      17.432  -5.940   0.056  1.00  0.00           C  
HETATM    8  C   UNL     1      15.192  -4.969  -0.474  1.00  0.00           C  
HETATM    9  C   UNL     1      12.952  -3.998  -1.004  1.00  0.00           C  
HETATM   10  C   UNL     1       9.439  -2.422  -0.937  1.00  0.00           C  
HETATM   11  C   UNL     1       8.471  -2.056  -2.064  1.00  0.00           C  
HETATM   12  C   UNL     1       3.991  -0.114  -3.124  1.00  0.00           C  
HETATM   13  C   UNL     1       1.765   0.851  -3.638  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.270   3.539  -3.058  1.00  0.00           C  
HETATM   15  C   UNL     1      20.640  -7.277   1.713  1.00  0.00           C  
HETATM   16  C   UNL     1      18.400  -6.306   1.183  1.00  0.00           C  
HETATM   17  C   UNL     1      16.160  -5.335   0.653  1.00  0.00           C  
HETATM   18  C   UNL     1      13.919  -4.364   0.123  1.00  0.00           C  
HETATM   19  C   UNL     1      11.679  -3.393  -0.407  1.00  0.00           C  
HETATM   20  C   UNL     1       6.231  -1.085  -2.594  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.593   2.336  -3.945  1.00  0.00           C  
HETATM   22  C   UNL     1       2.017   4.060   1.040  1.00  0.00           C  
HETATM   23  C   UNL     1       1.724   3.408   2.393  1.00  0.00           C  
HETATM   24  C   UNL     1       2.528   4.116   3.485  1.00  0.00           C  
HETATM   25  C   UNL     1       4.022   3.998   3.176  1.00  0.00           C  
HETATM   26  C   UNL     1       4.315   4.650   1.823  1.00  0.00           C  
HETATM   27  C   UNL     1       3.510   3.942   0.731  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.657   1.439  -3.160  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.477   0.445  -2.378  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.962   0.775  -2.533  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.794  -0.234  -1.739  1.00  0.00           C  
HETATM   32  C   UNL     1      -8.281   0.096  -1.895  1.00  0.00           C  
HETATM   33  C   UNL     1      -9.113  -0.913  -1.100  1.00  0.00           C  
HETATM   34  C   UNL     1     -10.599  -0.583  -1.256  1.00  0.00           C  
HETATM   35  C   UNL     1     -11.431  -1.592  -0.462  1.00  0.00           C  
HETATM   36  C   UNL     1     -12.917  -1.262  -0.617  1.00  0.00           C  
HETATM   37  C   UNL     1     -13.749  -2.271   0.177  1.00  0.00           C  
HETATM   38  C   UNL     1     -15.234  -1.941   0.022  1.00  0.00           C  
HETATM   39  C   UNL     1     -16.067  -2.950   0.816  1.00  0.00           C  
HETATM   40  C   UNL     1     -17.553  -2.620   0.661  1.00  0.00           C  
HETATM   41  C   UNL     1     -18.385  -3.629   1.455  1.00  0.00           C  
HETATM   42  C   UNL     1     -19.871  -3.299   1.300  1.00  0.00           C  
HETATM   43  C   UNL     1     -20.703  -4.308   2.094  1.00  0.00           C  
HETATM   44  C   UNL     1     -22.189  -3.978   1.939  1.00  0.00           C  
HETATM   45  C   UNL     1     -23.021  -4.987   2.733  1.00  0.00           C  
HETATM   46  C   UNL     1     -24.507  -4.657   2.577  1.00  0.00           C  
HETATM   47  O   UNL     1       2.072   0.646  -4.788  1.00  0.00           O  
HETATM   48  O   UNL     1       0.575   1.401  -3.348  1.00  0.00           O  
HETATM   49  O   UNL     1      -0.371   3.139  -2.021  1.00  0.00           O  
HETATM   50  O   UNL     1       0.820   5.316  -1.559  1.00  0.00           O  
HETATM   51  O   UNL     1      -1.040   4.662   0.016  1.00  0.00           O  
HETATM   52  O   UNL     1       1.265   3.398   0.020  1.00  0.00           O  
HETATM   53  O   UNL     1       3.880   2.563   0.685  1.00  0.00           O  
HETATM   54  O   UNL     1       5.710   4.540   1.533  1.00  0.00           O  
HETATM   55  O   UNL     1       4.392   2.619   3.130  1.00  0.00           O  
HETATM   56  O   UNL     1       5.752   0.440   3.692  1.00  0.00           O  
HETATM   57  O   UNL     1       6.760   2.734   3.995  1.00  0.00           O  
HETATM   58  O   UNL     1       4.967   2.036   5.628  1.00  0.00           O  
HETATM   59  O   UNL     1       2.254   3.507   4.749  1.00  0.00           O  
HETATM   60  O   UNL     1       0.328   3.517   2.682  1.00  0.00           O  
HETATM   61  O   UNL     1      -2.318   1.344  -3.170  1.00  0.00           O  
HETATM   62  O   UNL     1      -4.205   2.320  -3.779  1.00  0.00           O  
HETATM   63  P   UNL     1       0.182   4.154  -0.900  1.00  0.00           P  
HETATM   64  P   UNL     1       5.495   1.974   4.109  1.00  0.00           P  
HETATM   65  H   UNL     1      10.457  -3.923  -2.100  1.00  0.00           H  
HETATM   66  H   UNL     1      11.183  -2.300  -2.196  1.00  0.00           H  
HETATM   67  H   UNL     1       6.727  -2.178  -0.805  1.00  0.00           H  
HETATM   68  H   UNL     1       7.453  -0.555  -0.901  1.00  0.00           H  
HETATM   69  H   UNL     1       5.213   0.415  -1.431  1.00  0.00           H  
HETATM   70  H   UNL     1       4.487  -1.207  -1.336  1.00  0.00           H  
HETATM   71  H   UNL     1       2.247  -0.236  -1.866  1.00  0.00           H  
HETATM   72  H   UNL     1       2.973   1.386  -1.961  1.00  0.00           H  
HETATM   73  H   UNL     1      -0.517   0.814  -5.026  1.00  0.00           H  
HETATM   74  H   UNL     1       0.209   2.437  -5.121  1.00  0.00           H  
HETATM   75  H   UNL     1      20.144  -6.184  -0.076  1.00  0.00           H  
HETATM   76  H   UNL     1      19.418  -7.806   0.020  1.00  0.00           H  
HETATM   77  H   UNL     1      17.904  -5.213  -0.606  1.00  0.00           H  
HETATM   78  H   UNL     1      17.178  -6.836  -0.510  1.00  0.00           H  
HETATM   79  H   UNL     1      15.663  -4.242  -1.136  1.00  0.00           H  
HETATM   80  H   UNL     1      14.938  -5.865  -1.040  1.00  0.00           H  
HETATM   81  H   UNL     1      13.423  -3.271  -1.666  1.00  0.00           H  
HETATM   82  H   UNL     1      12.697  -4.894  -1.570  1.00  0.00           H  
HETATM   83  H   UNL     1       8.967  -3.149  -0.275  1.00  0.00           H  
HETATM   84  H   UNL     1       9.693  -1.526  -0.371  1.00  0.00           H  
HETATM   85  H   UNL     1       8.217  -2.952  -2.631  1.00  0.00           H  
HETATM   86  H   UNL     1       8.943  -1.329  -2.726  1.00  0.00           H  
HETATM   87  H   UNL     1       4.462   0.613  -3.786  1.00  0.00           H  
HETATM   88  H   UNL     1       3.736  -1.010  -3.691  1.00  0.00           H  
HETATM   89  H   UNL     1      -0.805   4.320  -3.660  1.00  0.00           H  
HETATM   90  H   UNL     1      -2.189   3.922  -2.615  1.00  0.00           H  
HETATM   91  H   UNL     1      20.894  -6.381   2.280  1.00  0.00           H  
HETATM   92  H   UNL     1      20.169  -8.004   2.375  1.00  0.00           H  
HETATM   93  H   UNL     1      21.547  -7.708   1.288  1.00  0.00           H  
HETATM   94  H   UNL     1      17.928  -7.033   1.845  1.00  0.00           H  
HETATM   95  H   UNL     1      18.654  -5.410   1.749  1.00  0.00           H  
HETATM   96  H   UNL     1      15.688  -6.062   1.315  1.00  0.00           H  
HETATM   97  H   UNL     1      16.414  -4.439   1.219  1.00  0.00           H  
HETATM   98  H   UNL     1      13.448  -5.091   0.785  1.00  0.00           H  
HETATM   99  H   UNL     1      14.174  -3.468   0.689  1.00  0.00           H  
HETATM  100  H   UNL     1      11.933  -2.497   0.159  1.00  0.00           H  
HETATM  101  H   UNL     1      11.208  -4.120   0.255  1.00  0.00           H  
HETATM  102  H   UNL     1       6.702  -0.358  -3.256  1.00  0.00           H  
HETATM  103  H   UNL     1       5.977  -1.981  -3.161  1.00  0.00           H  
HETATM  104  H   UNL     1      -2.206   2.659  -4.786  1.00  0.00           H  
HETATM  105  H   UNL     1       1.734   5.112   1.075  1.00  0.00           H  
HETATM  106  H   UNL     1       2.006   2.355   2.358  1.00  0.00           H  
HETATM  107  H   UNL     1       2.246   5.168   3.520  1.00  0.00           H  
HETATM  108  H   UNL     1       4.595   4.503   3.954  1.00  0.00           H  
HETATM  109  H   UNL     1       4.033   5.702   1.858  1.00  0.00           H  
HETATM  110  H   UNL     1       3.719   4.406  -0.233  1.00  0.00           H  
HETATM  111  H   UNL     1      -4.286  -0.560  -2.755  1.00  0.00           H  
HETATM  112  H   UNL     1      -4.201   0.496  -1.325  1.00  0.00           H  
HETATM  113  H   UNL     1      -6.153   1.780  -2.156  1.00  0.00           H  
HETATM  114  H   UNL     1      -6.238   0.724  -3.587  1.00  0.00           H  
HETATM  115  H   UNL     1      -6.604  -1.239  -2.116  1.00  0.00           H  
HETATM  116  H   UNL     1      -6.519  -0.183  -0.686  1.00  0.00           H  
HETATM  117  H   UNL     1      -8.471   1.101  -1.518  1.00  0.00           H  
HETATM  118  H   UNL     1      -8.556   0.045  -2.948  1.00  0.00           H  
HETATM  119  H   UNL     1      -8.922  -1.918  -1.477  1.00  0.00           H  
HETATM  120  H   UNL     1      -8.837  -0.862  -0.047  1.00  0.00           H  
HETATM  121  H   UNL     1     -10.789   0.422  -0.879  1.00  0.00           H  
HETATM  122  H   UNL     1     -10.874  -0.634  -2.309  1.00  0.00           H  
HETATM  123  H   UNL     1     -11.240  -2.597  -0.839  1.00  0.00           H  
HETATM  124  H   UNL     1     -11.155  -1.541   0.592  1.00  0.00           H  
HETATM  125  H   UNL     1     -13.107  -0.257  -0.240  1.00  0.00           H  
HETATM  126  H   UNL     1     -13.192  -1.313  -1.670  1.00  0.00           H  
HETATM  127  H   UNL     1     -13.558  -3.276  -0.200  1.00  0.00           H  
HETATM  128  H   UNL     1     -13.473  -2.220   1.231  1.00  0.00           H  
HETATM  129  H   UNL     1     -15.425  -0.936   0.399  1.00  0.00           H  
HETATM  130  H   UNL     1     -15.510  -1.992  -1.031  1.00  0.00           H  
HETATM  131  H   UNL     1     -15.876  -3.955   0.439  1.00  0.00           H  
HETATM  132  H   UNL     1     -15.791  -2.899   1.870  1.00  0.00           H  
HETATM  133  H   UNL     1     -17.743  -1.615   1.038  1.00  0.00           H  
HETATM  134  H   UNL     1     -17.828  -2.671  -0.393  1.00  0.00           H  
HETATM  135  H   UNL     1     -18.194  -4.634   1.078  1.00  0.00           H  
HETATM  136  H   UNL     1     -18.109  -3.578   2.508  1.00  0.00           H  
HETATM  137  H   UNL     1     -20.061  -2.294   1.677  1.00  0.00           H  
HETATM  138  H   UNL     1     -20.146  -3.350   0.246  1.00  0.00           H  
HETATM  139  H   UNL     1     -20.512  -5.313   1.717  1.00  0.00           H  
HETATM  140  H   UNL     1     -20.427  -4.257   3.147  1.00  0.00           H  
HETATM  141  H   UNL     1     -22.379  -2.973   2.316  1.00  0.00           H  
HETATM  142  H   UNL     1     -22.464  -4.029   0.885  1.00  0.00           H  
HETATM  143  H   UNL     1     -22.830  -5.992   2.356  1.00  0.00           H  
HETATM  144  H   UNL     1     -22.745  -4.936   3.786  1.00  0.00           H  
HETATM  145  H   UNL     1     -25.099  -5.376   3.143  1.00  0.00           H  
HETATM  146  H   UNL     1     -24.697  -3.652   2.954  1.00  0.00           H  
HETATM  147  H   UNL     1     -24.782  -4.708   1.524  1.00  0.00           H  
HETATM  148  H   UNL     1      -1.506   3.952   0.479  1.00  0.00           H  
HETATM  149  H   UNL     1       4.816   2.412   0.493  1.00  0.00           H  
HETATM  150  H   UNL     1       5.969   4.933   0.688  1.00  0.00           H  
HETATM  151  H   UNL     1       6.407  -0.012   4.241  1.00  0.00           H  
HETATM  152  H   UNL     1       4.140   1.558   5.777  1.00  0.00           H  
HETATM  153  H   UNL     1       1.324   3.544   5.010  1.00  0.00           H  
HETATM  154  H   UNL     1       0.070   3.124   3.527  1.00  0.00           H  
CONECT    1   10   19   65   66                                       
CONECT    2   11   20   67   68                                       
CONECT    3   20   12   69   70                                       
CONECT    4   12   13   71   72                                       
CONECT    5   21   48   73   74                                       
CONECT    6   16   15   75   76                                       
CONECT    7   17   16   77   78                                       
CONECT    8   17   18   79   80                                       
CONECT    9   18   19   81   82                                       
CONECT   10   11    1   83   84                                       
CONECT   11   10    2   85   86                                       
CONECT   12    3    4   87   88                                       
CONECT   13   48    4   47   47                                       
CONECT   14   49   21   89   90                                       
CONECT   15    6   91   92   93                                       
CONECT   16    7    6   94   95                                       
CONECT   17    7    8   96   97                                       
CONECT   18    9    8   98   99                                       
CONECT   19    9    1  100  101                                       
CONECT   20    2    3  102  103                                       
CONECT   21   14   61    5  104                                       
CONECT   22   27   23   52  105                                       
CONECT   23   24   22   60  106                                       
CONECT   24   25   59   23  107                                       
CONECT   25   55   26   24  108                                       
CONECT   26   54   25   27  109                                       
CONECT   27   26   53   22  110                                       
CONECT   28   62   62   61   29                                       
CONECT   29   28   30  111  112                                       
CONECT   30   29   31  113  114                                       
CONECT   31   30   32  115  116                                       
CONECT   32   31   33  117  118                                       
CONECT   33   34   32  119  120                                       
CONECT   34   35   33  121  122                                       
CONECT   35   34   36  123  124                                       
CONECT   36   37   35  125  126                                       
CONECT   37   36   38  127  128                                       
CONECT   38   37   39  129  130                                       
CONECT   39   38   40  131  132                                       
CONECT   40   39   41  133  134                                       
CONECT   41   42   40  135  136                                       
CONECT   42   43   41  137  138                                       
CONECT   43   42   44  139  140                                       
CONECT   44   43   45  141  142                                       
CONECT   45   44   46  143  144                                       
CONECT   46   45  145  146  147                                       
CONECT   47   13   13                                                 
CONECT   48    5   13                                                 
CONECT   49   63   14                                                 
CONECT   50   63   63                                                 
CONECT   51   63  148                                                 
CONECT   52   22   63                                                 
CONECT   53   27  149                                                 
CONECT   54   26  150                                                 
CONECT   55   64   25                                                 
CONECT   56   64  151                                                 
CONECT   57   64   64                                                 
CONECT   58   64  152                                                 
CONECT   59   24  153                                                 
CONECT   60   23  154                                                 
CONECT   61   21   28                                                 
CONECT   62   28   28                                                 
CONECT   63   52   50   50   51                                       
CONECT   63   49                                                      
CONECT   64   57   57   56   58                                       
CONECT   64   55                                                      
CONECT   65    1                                                      
CONECT   66    1                                                      
CONECT   67    2                                                      
CONECT   68    2                                                      
CONECT   69    3                                                      
CONECT   70    3                                                      
CONECT   71    4                                                      
CONECT   72    4                                                      
CONECT   73    5                                                      
CONECT   74    5                                                      
CONECT   75    6                                                      
CONECT   76    6                                                      
CONECT   77    7                                                      
CONECT   78    7                                                      
CONECT   79    8                                                      
CONECT   80    8                                                      
CONECT   81    9                                                      
CONECT   82    9                                                      
CONECT   83   10                                                      
CONECT   84   10                                                      
CONECT   85   11                                                      
CONECT   86   11                                                      
CONECT   87   12                                                      
CONECT   88   12                                                      
CONECT   89   14                                                      
CONECT   90   14                                                      
CONECT   91   15                                                      
CONECT   92   15                                                      
CONECT   93   15                                                      
CONECT   94   16                                                      
CONECT   95   16                                                      
CONECT   96   17                                                      
CONECT   97   17                                                      
CONECT   98   18                                                      
CONECT   99   18                                                      
CONECT  100   19                                                      
CONECT  101   19                                                      
CONECT  102   20                                                      
CONECT  103   20                                                      
CONECT  104   21                                                      
CONECT  105   22                                                      
CONECT  106   23                                                      
CONECT  107   24                                                      
CONECT  108   25                                                      
CONECT  109   26                                                      
CONECT  110   27                                                      
CONECT  111   29                                                      
CONECT  112   29                                                      
CONECT  113   30                                                      
CONECT  114   30                                                      
CONECT  115   31                                                      
CONECT  116   31                                                      
CONECT  117   32                                                      
CONECT  118   32                                                      
CONECT  119   33                                                      
CONECT  120   33                                                      
CONECT  121   34                                                      
CONECT  122   34                                                      
CONECT  123   35                                                      
CONECT  124   35                                                      
CONECT  125   36                                                      
CONECT  126   36                                                      
CONECT  127   37                                                      
CONECT  128   37                                                      
CONECT  129   38                                                      
CONECT  130   38                                                      
CONECT  131   39                                                      
CONECT  132   39                                                      
CONECT  133   40                                                      
CONECT  134   40                                                      
CONECT  135   41                                                      
CONECT  136   41                                                      
CONECT  137   42                                                      
CONECT  138   42                                                      
CONECT  139   43                                                      
CONECT  140   43                                                      
CONECT  141   44                                                      
CONECT  142   44                                                      
CONECT  143   45                                                      
CONECT  144   45                                                      
CONECT  145   46                                                      
CONECT  146   46                                                      
CONECT  147   46                                                      
CONECT  148   51                                                      
CONECT  149   53                                                      
CONECT  150   54                                                      
CONECT  151   56                                                      
CONECT  152   58                                                      
CONECT  153   59                                                      
CONECT  154   60                                                      
MASTER        0    0    0    0    0    0    0    0  154    0  154    0
END
