COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1     -11.030  -2.942  -0.853  1.00  0.00           C  
HETATM    2  C   UNL     1     -11.592  -1.641  -0.275  1.00  0.00           C  
HETATM    3  C   UNL     1      -9.502  -2.883  -0.848  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.941  -4.128  -1.539  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.444  -6.313  -0.568  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.743  -5.059  -1.024  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.435  -4.070  -1.534  1.00  0.00           C  
HETATM    8  C   UNL     1      11.913  -2.635  -1.003  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.398  -4.335   0.645  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.719  -1.960   1.111  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.861  -2.585  -0.493  1.00  0.00           C  
HETATM   12  C   UNL     1       0.640  -2.448  -0.476  1.00  0.00           C  
HETATM   13  C   UNL     1       1.377  -3.222  -1.235  1.00  0.00           C  
HETATM   14  C   UNL     1       0.726  -4.273  -2.096  1.00  0.00           C  
HETATM   15  C   UNL     1       2.875  -3.059  -1.246  1.00  0.00           C  
HETATM   16  C   UNL     1       5.000  -3.884  -0.270  1.00  0.00           C  
HETATM   17  C   UNL     1       5.625  -3.493   0.813  1.00  0.00           C  
HETATM   18  C   UNL     1       9.738  -1.536  -0.545  1.00  0.00           C  
HETATM   19  C   UNL     1       8.992  -1.247  -1.822  1.00  0.00           C  
HETATM   20  C   UNL     1      11.234  -1.363  -0.492  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.895  -4.452   0.513  1.00  0.00           C  
HETATM   22  C   UNL     1     -16.716   2.028   0.790  1.00  0.00           C  
HETATM   23  C   UNL     1     -16.747   3.022   1.954  1.00  0.00           C  
HETATM   24  C   UNL     1     -18.102   3.736   1.970  1.00  0.00           C  
HETATM   25  C   UNL     1     -18.322   4.419   0.617  1.00  0.00           C  
HETATM   26  C   UNL     1     -18.231   3.372  -0.495  1.00  0.00           C  
HETATM   27  C   UNL     1     -18.391   4.056  -1.855  1.00  0.00           C  
HETATM   28  O   UNL     1     -15.435   1.398   0.735  1.00  0.00           O  
HETATM   29  O   UNL     1     -15.702   3.983   1.790  1.00  0.00           O  
HETATM   30  O   UNL     1     -18.112   4.718   3.009  1.00  0.00           O  
HETATM   31  O   UNL     1     -19.615   5.028   0.595  1.00  0.00           O  
HETATM   32  O   UNL     1     -16.959   2.724  -0.434  1.00  0.00           O  
HETATM   33  O   UNL     1     -18.422   3.066  -2.885  1.00  0.00           O  
HETATM   34  P   UNL     1     -15.217  -0.099   0.184  1.00  0.00           P  
HETATM   35  O   UNL     1     -13.643  -0.433   0.145  1.00  0.00           O  
HETATM   36  O   UNL     1     -15.779  -0.210  -1.180  1.00  0.00           O  
HETATM   37  O   UNL     1     -15.963  -1.143   1.158  1.00  0.00           O  
HETATM   38  C   UNL     1     -13.118  -1.648  -0.394  1.00  0.00           C  
HETATM   39  C   UNL     1     -11.498  -4.123   0.000  1.00  0.00           C  
HETATM   40  C   UNL     1      -5.247  -4.942  -0.893  1.00  0.00           C  
HETATM   41  C   UNL     1      -2.849  -3.167   0.869  1.00  0.00           C  
HETATM   42  C   UNL     1      -1.349  -3.030   0.887  1.00  0.00           C  
HETATM   43  C   UNL     1       3.502  -4.046  -0.259  1.00  0.00           C  
HETATM   44  C   UNL     1       4.838  -3.111   2.040  1.00  0.00           C  
HETATM   45  C   UNL     1       7.130  -3.426   0.833  1.00  0.00           C  
HETATM   46  C   UNL     1       7.582  -2.003   0.499  1.00  0.00           C  
HETATM   47  C   UNL     1       9.087  -1.936   0.518  1.00  0.00           C  
HETATM   48  C   UNL     1      13.410  -2.462  -0.950  1.00  0.00           C  
HETATM   49  C   UNL     1      14.136  -3.268  -0.216  1.00  0.00           C  
HETATM   50  C   UNL     1      13.468  -4.283   0.676  1.00  0.00           C  
HETATM   51  C   UNL     1      15.640  -3.180  -0.263  1.00  0.00           C  
HETATM   52  C   UNL     1      16.135  -2.287   0.877  1.00  0.00           C  
HETATM   53  C   UNL     1      17.638  -2.200   0.829  1.00  0.00           C  
HETATM   54  C   UNL     1      18.222  -1.040   0.651  1.00  0.00           C  
HETATM   55  C   UNL     1      19.720  -0.926   0.762  1.00  0.00           C  
HETATM   56  C   UNL     1      17.394   0.179   0.336  1.00  0.00           C  
HETATM   57  C   UNL     1      17.052   0.913   1.634  1.00  0.00           C  
HETATM   58  C   UNL     1      16.225   2.133   1.319  1.00  0.00           C  
HETATM   59  C   UNL     1      15.079   2.322   1.925  1.00  0.00           C  
HETATM   60  C   UNL     1      14.640   1.380   3.017  1.00  0.00           C  
HETATM   61  C   UNL     1      14.200   3.481   1.532  1.00  0.00           C  
HETATM   62  C   UNL     1      13.164   3.011   0.508  1.00  0.00           C  
HETATM   63  C   UNL     1      12.285   4.170   0.115  1.00  0.00           C  
HETATM   64  C   UNL     1      12.237   4.561  -1.135  1.00  0.00           C  
HETATM   65  C   UNL     1      13.121   3.905  -2.164  1.00  0.00           C  
HETATM   66  C   UNL     1      11.298   5.667  -1.542  1.00  0.00           C  
HETATM   67  C   UNL     1      12.048   7.001  -1.536  1.00  0.00           C  
HETATM   68  C   UNL     1      11.109   8.107  -1.943  1.00  0.00           C  
HETATM   69  C   UNL     1      10.865   9.096  -1.120  1.00  0.00           C  
HETATM   70  C   UNL     1      10.032  10.267  -1.574  1.00  0.00           C  
HETATM   71  C   UNL     1      11.418   9.064   0.281  1.00  0.00           C  
HETATM   72  H   UNL     1     -11.386  -3.069  -1.875  1.00  0.00           H  
HETATM   73  H   UNL     1     -11.310  -1.558   0.774  1.00  0.00           H  
HETATM   74  H   UNL     1     -11.188  -0.794  -0.828  1.00  0.00           H  
HETATM   75  H   UNL     1      -9.170  -1.992  -1.381  1.00  0.00           H  
HETATM   76  H   UNL     1      -9.142  -2.845   0.180  1.00  0.00           H  
HETATM   77  H   UNL     1      -9.272  -5.019  -1.006  1.00  0.00           H  
HETATM   78  H   UNL     1      -9.300  -4.166  -2.567  1.00  0.00           H  
HETATM   79  H   UNL     1      -7.813  -6.174   0.448  1.00  0.00           H  
HETATM   80  H   UNL     1      -8.282  -6.523  -1.233  1.00  0.00           H  
HETATM   81  H   UNL     1      -6.745  -7.148  -0.590  1.00  0.00           H  
HETATM   82  H   UNL     1      -6.926  -3.214  -1.952  1.00  0.00           H  
HETATM   83  H   UNL     1      11.622  -3.479  -0.378  1.00  0.00           H  
HETATM   84  H   UNL     1      11.606  -2.823  -2.032  1.00  0.00           H  
HETATM   85  H   UNL     1      -2.778  -5.214   0.553  1.00  0.00           H  
HETATM   86  H   UNL     1      -4.301  -2.108   2.020  1.00  0.00           H  
HETATM   87  H   UNL     1      -3.091  -1.076   1.221  1.00  0.00           H  
HETATM   88  H   UNL     1      -4.393  -1.823   0.266  1.00  0.00           H  
HETATM   89  H   UNL     1      -1.311  -1.625  -0.745  1.00  0.00           H  
HETATM   90  H   UNL     1      -1.150  -3.328  -1.237  1.00  0.00           H  
HETATM   91  H   UNL     1       1.107  -1.713   0.162  1.00  0.00           H  
HETATM   92  H   UNL     1       0.395  -3.822  -3.032  1.00  0.00           H  
HETATM   93  H   UNL     1       1.445  -5.064  -2.309  1.00  0.00           H  
HETATM   94  H   UNL     1      -0.132  -4.693  -1.571  1.00  0.00           H  
HETATM   95  H   UNL     1       3.254  -3.257  -2.248  1.00  0.00           H  
HETATM   96  H   UNL     1       3.132  -2.041  -0.954  1.00  0.00           H  
HETATM   97  H   UNL     1       5.559  -4.090  -1.171  1.00  0.00           H  
HETATM   98  H   UNL     1       8.221  -0.500  -1.632  1.00  0.00           H  
HETATM   99  H   UNL     1       9.687  -0.870  -2.572  1.00  0.00           H  
HETATM  100  H   UNL     1       8.527  -2.164  -2.186  1.00  0.00           H  
HETATM  101  H   UNL     1      11.542  -1.175   0.537  1.00  0.00           H  
HETATM  102  H   UNL     1      11.526  -0.519  -1.118  1.00  0.00           H  
HETATM  103  H   UNL     1      -5.270  -5.162   1.250  1.00  0.00           H  
HETATM  104  H   UNL     1      -5.351  -3.477   0.683  1.00  0.00           H  
HETATM  105  H   UNL     1     -17.487   1.272   0.937  1.00  0.00           H  
HETATM  106  H   UNL     1     -16.606   2.487   2.894  1.00  0.00           H  
HETATM  107  H   UNL     1     -18.895   3.010   2.147  1.00  0.00           H  
HETATM  108  H   UNL     1     -17.558   5.181   0.465  1.00  0.00           H  
HETATM  109  H   UNL     1     -19.022   2.633  -0.365  1.00  0.00           H  
HETATM  110  H   UNL     1     -19.320   4.624  -1.868  1.00  0.00           H  
HETATM  111  H   UNL     1     -17.550   4.729  -2.023  1.00  0.00           H  
HETATM  112  H   UNL     1     -14.815   3.599   1.766  1.00  0.00           H  
HETATM  113  H   UNL     1     -17.971   4.355   3.894  1.00  0.00           H  
HETATM  114  H   UNL     1     -19.745   5.700   1.278  1.00  0.00           H  
HETATM  115  H   UNL     1     -18.521   3.429  -3.776  1.00  0.00           H  
HETATM  116  H   UNL     1     -15.645  -1.126   2.071  1.00  0.00           H  
HETATM  117  H   UNL     1     -13.400  -1.731  -1.444  1.00  0.00           H  
HETATM  118  H   UNL     1     -13.522  -2.496   0.159  1.00  0.00           H  
HETATM  119  H   UNL     1     -11.142  -3.996   1.023  1.00  0.00           H  
HETATM  120  H   UNL     1     -12.587  -4.165  -0.003  1.00  0.00           H  
HETATM  121  H   UNL     1     -11.098  -5.049  -0.412  1.00  0.00           H  
HETATM  122  H   UNL     1      -4.790  -5.917  -1.063  1.00  0.00           H  
HETATM  123  H   UNL     1      -4.872  -4.232  -1.630  1.00  0.00           H  
HETATM  124  H   UNL     1      -0.899  -3.991   1.139  1.00  0.00           H  
HETATM  125  H   UNL     1      -1.060  -2.288   1.631  1.00  0.00           H  
HETATM  126  H   UNL     1       3.122  -3.848   0.744  1.00  0.00           H  
HETATM  127  H   UNL     1       3.245  -5.064  -0.550  1.00  0.00           H  
HETATM  128  H   UNL     1       4.601  -4.006   2.615  1.00  0.00           H  
HETATM  129  H   UNL     1       5.429  -2.431   2.654  1.00  0.00           H  
HETATM  130  H   UNL     1       3.913  -2.617   1.740  1.00  0.00           H  
HETATM  131  H   UNL     1       7.493  -3.700   1.823  1.00  0.00           H  
HETATM  132  H   UNL     1       7.534  -4.118   0.094  1.00  0.00           H  
HETATM  133  H   UNL     1       7.218  -1.730  -0.492  1.00  0.00           H  
HETATM  134  H   UNL     1       7.177  -1.311   1.238  1.00  0.00           H  
HETATM  135  H   UNL     1       9.629  -2.218   1.409  1.00  0.00           H  
HETATM  136  H   UNL     1      13.883  -1.674  -1.517  1.00  0.00           H  
HETATM  137  H   UNL     1      13.228  -5.174   0.097  1.00  0.00           H  
HETATM  138  H   UNL     1      14.141  -4.549   1.491  1.00  0.00           H  
HETATM  139  H   UNL     1      12.552  -3.858   1.087  1.00  0.00           H  
HETATM  140  H   UNL     1      16.065  -4.178  -0.154  1.00  0.00           H  
HETATM  141  H   UNL     1      15.949  -2.756  -1.218  1.00  0.00           H  
HETATM  142  H   UNL     1      15.709  -1.290   0.767  1.00  0.00           H  
HETATM  143  H   UNL     1      15.825  -2.712   1.832  1.00  0.00           H  
HETATM  144  H   UNL     1      18.235  -3.093   0.942  1.00  0.00           H  
HETATM  145  H   UNL     1      20.171  -1.097  -0.216  1.00  0.00           H  
HETATM  146  H   UNL     1      19.983   0.072   1.113  1.00  0.00           H  
HETATM  147  H   UNL     1      20.090  -1.669   1.468  1.00  0.00           H  
HETATM  148  H   UNL     1      17.959   0.842  -0.319  1.00  0.00           H  
HETATM  149  H   UNL     1      16.473  -0.125  -0.162  1.00  0.00           H  
HETATM  150  H   UNL     1      16.487   0.250   2.289  1.00  0.00           H  
HETATM  151  H   UNL     1      17.973   1.218   2.132  1.00  0.00           H  
HETATM  152  H   UNL     1      16.576   2.851   0.592  1.00  0.00           H  
HETATM  153  H   UNL     1      14.131   0.523   2.575  1.00  0.00           H  
HETATM  154  H   UNL     1      15.513   1.037   3.573  1.00  0.00           H  
HETATM  155  H   UNL     1      13.960   1.898   3.692  1.00  0.00           H  
HETATM  156  H   UNL     1      13.690   3.866   2.415  1.00  0.00           H  
HETATM  157  H   UNL     1      14.813   4.269   1.094  1.00  0.00           H  
HETATM  158  H   UNL     1      13.675   2.626  -0.374  1.00  0.00           H  
HETATM  159  H   UNL     1      12.552   2.223   0.947  1.00  0.00           H  
HETATM  160  H   UNL     1      11.695   4.679   0.863  1.00  0.00           H  
HETATM  161  H   UNL     1      12.609   3.038  -2.582  1.00  0.00           H  
HETATM  162  H   UNL     1      13.341   4.616  -2.960  1.00  0.00           H  
HETATM  163  H   UNL     1      14.051   3.586  -1.694  1.00  0.00           H  
HETATM  164  H   UNL     1      10.917   5.469  -2.544  1.00  0.00           H  
HETATM  165  H   UNL     1      10.466   5.714  -0.840  1.00  0.00           H  
HETATM  166  H   UNL     1      12.429   7.199  -0.534  1.00  0.00           H  
HETATM  167  H   UNL     1      12.880   6.953  -2.238  1.00  0.00           H  
HETATM  168  H   UNL     1      10.637   8.083  -2.915  1.00  0.00           H  
HETATM  169  H   UNL     1       8.981  10.070  -1.360  1.00  0.00           H  
HETATM  170  H   UNL     1      10.349  11.165  -1.045  1.00  0.00           H  
HETATM  171  H   UNL     1      10.163  10.411  -2.647  1.00  0.00           H  
HETATM  172  H   UNL     1      12.441   9.439   0.277  1.00  0.00           H  
HETATM  173  H   UNL     1      10.804   9.689   0.929  1.00  0.00           H  
HETATM  174  H   UNL     1      11.409   8.038   0.652  1.00  0.00           H  
CONECT    1    3    2   39   72                                       
CONECT    2    1   38   73   74                                       
CONECT    3    4    1   75   76                                       
CONECT    4    7    3   77   78                                       
CONECT    5    6   79   80   81                                       
CONECT    6    5    7    7   40                                       
CONECT    7    4    6    6   82                                       
CONECT    8   48   20   83   84                                       
CONECT    9   21   41   41   85                                       
CONECT   10   41   86   87   88                                       
CONECT   11   42   12   89   90                                       
CONECT   12   11   13   13   91                                       
CONECT   13   12   12   15   14                                       
CONECT   14   13   92   93   94                                       
CONECT   15   13   43   95   96                                       
CONECT   16   43   17   17   97                                       
CONECT   17   16   16   45   44                                       
CONECT   18   20   19   47   47                                       
CONECT   19   18   98   99  100                                       
CONECT   20    8   18  101  102                                       
CONECT   21   40    9  103  104                                       
CONECT   22   32   28   23  105                                       
CONECT   23   29   22   24  106                                       
CONECT   24   25   23   30  107                                       
CONECT   25   26   31   24  108                                       
CONECT   26   27   32   25  109                                       
CONECT   27   33   26  110  111                                       
CONECT   28   34   22                                                 
CONECT   29   23  112                                                 
CONECT   30   24  113                                                 
CONECT   31   25  114                                                 
CONECT   32   26   22                                                 
CONECT   33   27  115                                                 
CONECT   34   35   28   36   36                                       
CONECT   34   37                                                      
CONECT   35   38   34                                                 
CONECT   36   34   34                                                 
CONECT   37   34  116                                                 
CONECT   38    2   35  117  118                                       
CONECT   39    1  119  120  121                                       
CONECT   40    6   21  122  123                                       
CONECT   41   42   10    9    9                                       
CONECT   42   41   11  124  125                                       
CONECT   43   15   16  126  127                                       
CONECT   44   17  128  129  130                                       
CONECT   45   46   17  131  132                                       
CONECT   46   47   45  133  134                                       
CONECT   47   18   18   46  135                                       
CONECT   48   49   49    8  136                                       
CONECT   49   50   51   48   48                                       
CONECT   50   49  137  138  139                                       
CONECT   51   52   49  140  141                                       
CONECT   52   53   51  142  143                                       
CONECT   53   54   54   52  144                                       
CONECT   54   55   56   53   53                                       
CONECT   55   54  145  146  147                                       
CONECT   56   57   54  148  149                                       
CONECT   57   58   56  150  151                                       
CONECT   58   59   59   57  152                                       
CONECT   59   60   61   58   58                                       
CONECT   60   59  153  154  155                                       
CONECT   61   59   62  156  157                                       
CONECT   62   61   63  158  159                                       
CONECT   63   62   64   64  160                                       
CONECT   64   65   63   63   66                                       
CONECT   65   64  161  162  163                                       
CONECT   66   64   67  164  165                                       
CONECT   67   66   68  166  167                                       
CONECT   68   67   69   69  168                                       
CONECT   69   68   68   71   70                                       
CONECT   70   69  169  170  171                                       
CONECT   71   69  172  173  174                                       
CONECT   72    1                                                      
CONECT   73    2                                                      
CONECT   74    2                                                      
CONECT   75    3                                                      
CONECT   76    3                                                      
CONECT   77    4                                                      
CONECT   78    4                                                      
CONECT   79    5                                                      
CONECT   80    5                                                      
CONECT   81    5                                                      
CONECT   82    7                                                      
CONECT   83    8                                                      
CONECT   84    8                                                      
CONECT   85    9                                                      
CONECT   86   10                                                      
CONECT   87   10                                                      
CONECT   88   10                                                      
CONECT   89   11                                                      
CONECT   90   11                                                      
CONECT   91   12                                                      
CONECT   92   14                                                      
CONECT   93   14                                                      
CONECT   94   14                                                      
CONECT   95   15                                                      
CONECT   96   15                                                      
CONECT   97   16                                                      
CONECT   98   19                                                      
CONECT   99   19                                                      
CONECT  100   19                                                      
CONECT  101   20                                                      
CONECT  102   20                                                      
CONECT  103   21                                                      
CONECT  104   21                                                      
CONECT  105   22                                                      
CONECT  106   23                                                      
CONECT  107   24                                                      
CONECT  108   25                                                      
CONECT  109   26                                                      
CONECT  110   27                                                      
CONECT  111   27                                                      
CONECT  112   29                                                      
CONECT  113   30                                                      
CONECT  114   31                                                      
CONECT  115   33                                                      
CONECT  116   37                                                      
CONECT  117   38                                                      
CONECT  118   38                                                      
CONECT  119   39                                                      
CONECT  120   39                                                      
CONECT  121   39                                                      
CONECT  122   40                                                      
CONECT  123   40                                                      
CONECT  124   42                                                      
CONECT  125   42                                                      
CONECT  126   43                                                      
CONECT  127   43                                                      
CONECT  128   44                                                      
CONECT  129   44                                                      
CONECT  130   44                                                      
CONECT  131   45                                                      
CONECT  132   45                                                      
CONECT  133   46                                                      
CONECT  134   46                                                      
CONECT  135   47                                                      
CONECT  136   48                                                      
CONECT  137   50                                                      
CONECT  138   50                                                      
CONECT  139   50                                                      
CONECT  140   51                                                      
CONECT  141   51                                                      
CONECT  142   52                                                      
CONECT  143   52                                                      
CONECT  144   53                                                      
CONECT  145   55                                                      
CONECT  146   55                                                      
CONECT  147   55                                                      
CONECT  148   56                                                      
CONECT  149   56                                                      
CONECT  150   57                                                      
CONECT  151   57                                                      
CONECT  152   58                                                      
CONECT  153   60                                                      
CONECT  154   60                                                      
CONECT  155   60                                                      
CONECT  156   61                                                      
CONECT  157   61                                                      
CONECT  158   62                                                      
CONECT  159   62                                                      
CONECT  160   63                                                      
CONECT  161   65                                                      
CONECT  162   65                                                      
CONECT  163   65                                                      
CONECT  164   66                                                      
CONECT  165   66                                                      
CONECT  166   67                                                      
CONECT  167   67                                                      
CONECT  168   68                                                      
CONECT  169   70                                                      
CONECT  170   70                                                      
CONECT  171   70                                                      
CONECT  172   71                                                      
CONECT  173   71                                                      
CONECT  174   71                                                      
MASTER        0    0    0    0    0    0    0    0  174    0  174    0
END
