COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.809   3.684  -4.367  1.00  0.00           C  
HETATM    2  O   UNL     1      -5.672   2.611  -4.750  1.00  0.00           O  
HETATM    3  O   UNL     1      -2.986   2.196  -3.816  1.00  0.00           O  
HETATM    4  P   UNL     1      -1.179   4.940  -0.916  1.00  0.00           P  
HETATM    5  C   UNL     1      -0.464   3.146   2.974  1.00  0.00           C  
HETATM    6  C   UNL     1       2.906   2.966   1.660  1.00  0.00           C  
HETATM    7  O   UNL     1       1.581   2.754   1.711  1.00  0.00           O  
HETATM    8  C   UNL     1       0.772   3.784   2.338  1.00  0.00           C  
HETATM    9  C   UNL     1       3.809   1.941   1.025  1.00  0.00           C  
HETATM   10  O   UNL     1       3.374   3.979   2.124  1.00  0.00           O  
HETATM   11  C   UNL     1       0.335   4.802   1.282  1.00  0.00           C  
HETATM   12  C   UNL     1       5.259   2.423   1.098  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.304   2.577   1.935  1.00  0.00           O  
HETATM   14  C   UNL     1      -3.008   4.380  -2.782  1.00  0.00           C  
HETATM   15  C   UNL     1       6.176   1.382   0.453  1.00  0.00           C  
HETATM   16  O   UNL     1      -2.717   1.924   3.503  1.00  0.00           O  
HETATM   17  C   UNL     1      -3.848   3.202  -3.279  1.00  0.00           C  
HETATM   18  C   UNL     1       7.626   1.865   0.526  1.00  0.00           C  
HETATM   19  C   UNL     1      12.928  -1.449   0.288  1.00  0.00           C  
HETATM   20  C   UNL     1       8.543   0.823  -0.119  1.00  0.00           C  
HETATM   21  C   UNL     1      13.948  -2.397  -0.346  1.00  0.00           C  
HETATM   22  C   UNL     1       9.993   1.306  -0.046  1.00  0.00           C  
HETATM   23  C   UNL     1      13.611  -3.839   0.039  1.00  0.00           C  
HETATM   24  C   UNL     1      10.910   0.265  -0.691  1.00  0.00           C  
HETATM   25  C   UNL     1      14.631  -4.787  -0.594  1.00  0.00           C  
HETATM   26  C   UNL     1      12.339   0.740  -0.619  1.00  0.00           C  
HETATM   27  C   UNL     1      13.259  -0.029  -0.091  1.00  0.00           C  
HETATM   28  C   UNL     1      14.295  -6.229  -0.209  1.00  0.00           C  
HETATM   29  O   UNL     1      -0.528   4.166   0.337  1.00  0.00           O  
HETATM   30  C   UNL     1      15.315  -7.177  -0.843  1.00  0.00           C  
HETATM   31  O   UNL     1      -2.193   3.956  -1.687  1.00  0.00           O  
HETATM   32  C   UNL     1      14.979  -8.620  -0.458  1.00  0.00           C  
HETATM   33  O   UNL     1      -0.014   5.407  -1.923  1.00  0.00           O  
HETATM   34  C   UNL     1      15.999  -9.568  -1.092  1.00  0.00           C  
HETATM   35  O   UNL     1      -1.918   6.128  -0.431  1.00  0.00           O  
HETATM   36  C   UNL     1     -11.935  -3.597  -0.012  1.00  0.00           C  
HETATM   37  C   UNL     1     -13.144  -4.213   0.696  1.00  0.00           C  
HETATM   38  C   UNL     1     -14.080  -4.836  -0.341  1.00  0.00           C  
HETATM   39  C   UNL     1     -15.288  -5.452   0.367  1.00  0.00           C  
HETATM   40  C   UNL     1      -2.436   1.974   2.329  1.00  0.00           C  
HETATM   41  C   UNL     1      -3.358   1.361   1.307  1.00  0.00           C  
HETATM   42  C   UNL     1      -4.567   0.744   2.015  1.00  0.00           C  
HETATM   43  C   UNL     1      -5.503   0.121   0.977  1.00  0.00           C  
HETATM   44  C   UNL     1      -6.711  -0.495   1.685  1.00  0.00           C  
HETATM   45  C   UNL     1      -7.647  -1.118   0.648  1.00  0.00           C  
HETATM   46  C   UNL     1      -8.855  -1.734   1.356  1.00  0.00           C  
HETATM   47  C   UNL     1      -9.791  -2.357   0.318  1.00  0.00           C  
HETATM   48  C   UNL     1     -10.999  -2.974   1.026  1.00  0.00           C  
HETATM   49  C   UNL     1     -16.224  -6.075  -0.671  1.00  0.00           C  
HETATM   50  C   UNL     1     -18.368  -7.315  -1.000  1.00  0.00           C  
HETATM   51  C   UNL     1     -17.432  -6.692   0.037  1.00  0.00           C  
HETATM   52  H   UNL     1      -4.239   4.018  -5.234  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.406   4.512  -3.984  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.310   2.846  -5.438  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.447   2.496  -4.561  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.153   2.359   3.661  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.025   3.905   3.520  1.00  0.00           H  
HETATM   58  H   UNL     1       1.358   4.288   3.107  1.00  0.00           H  
HETATM   59  H   UNL     1       3.714   0.993   1.556  1.00  0.00           H  
HETATM   60  H   UNL     1       3.524   1.802  -0.018  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.197   5.621   1.765  1.00  0.00           H  
HETATM   62  H   UNL     1       1.213   5.192   0.767  1.00  0.00           H  
HETATM   63  H   UNL     1       5.354   3.370   0.567  1.00  0.00           H  
HETATM   64  H   UNL     1       5.544   2.561   2.141  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.371   4.739  -3.591  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.667   5.183  -2.454  1.00  0.00           H  
HETATM   67  H   UNL     1       6.081   0.435   0.984  1.00  0.00           H  
HETATM   68  H   UNL     1       5.891   1.244  -0.590  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.418   2.786  -2.449  1.00  0.00           H  
HETATM   70  H   UNL     1       7.721   2.812  -0.005  1.00  0.00           H  
HETATM   71  H   UNL     1       7.911   2.003   1.569  1.00  0.00           H  
HETATM   72  H   UNL     1      11.929  -1.697  -0.071  1.00  0.00           H  
HETATM   73  H   UNL     1      12.960  -1.552   1.373  1.00  0.00           H  
HETATM   74  H   UNL     1       8.448  -0.123   0.412  1.00  0.00           H  
HETATM   75  H   UNL     1       8.259   0.685  -1.162  1.00  0.00           H  
HETATM   76  H   UNL     1      13.915  -2.293  -1.430  1.00  0.00           H  
HETATM   77  H   UNL     1      14.947  -2.149   0.013  1.00  0.00           H  
HETATM   78  H   UNL     1      10.089   2.253  -0.577  1.00  0.00           H  
HETATM   79  H   UNL     1      10.278   1.444   0.997  1.00  0.00           H  
HETATM   80  H   UNL     1      13.644  -3.943   1.124  1.00  0.00           H  
HETATM   81  H   UNL     1      12.613  -4.088  -0.319  1.00  0.00           H  
HETATM   82  H   UNL     1      10.815  -0.682  -0.160  1.00  0.00           H  
HETATM   83  H   UNL     1      10.626   0.126  -1.734  1.00  0.00           H  
HETATM   84  H   UNL     1      14.599  -4.684  -1.679  1.00  0.00           H  
HETATM   85  H   UNL     1      15.630  -4.539  -0.235  1.00  0.00           H  
HETATM   86  H   UNL     1      12.604   1.714  -1.002  1.00  0.00           H  
HETATM   87  H   UNL     1      14.255   0.356   0.072  1.00  0.00           H  
HETATM   88  H   UNL     1      14.328  -6.333   0.875  1.00  0.00           H  
HETATM   89  H   UNL     1      13.296  -6.478  -0.568  1.00  0.00           H  
HETATM   90  H   UNL     1      15.283  -7.074  -1.928  1.00  0.00           H  
HETATM   91  H   UNL     1      16.314  -6.929  -0.484  1.00  0.00           H  
HETATM   92  H   UNL     1      15.011  -8.723   0.626  1.00  0.00           H  
HETATM   93  H   UNL     1      13.980  -8.868  -0.817  1.00  0.00           H  
HETATM   94  H   UNL     1       0.513   4.678  -2.280  1.00  0.00           H  
HETATM   95  H   UNL     1      16.998  -9.319  -0.733  1.00  0.00           H  
HETATM   96  H   UNL     1      15.759 -10.595  -0.818  1.00  0.00           H  
HETATM   97  H   UNL     1      15.966  -9.464  -2.176  1.00  0.00           H  
HETATM   98  H   UNL     1     -11.403  -4.372  -0.562  1.00  0.00           H  
HETATM   99  H   UNL     1     -12.274  -2.826  -0.704  1.00  0.00           H  
HETATM  100  H   UNL     1     -12.805  -4.983   1.389  1.00  0.00           H  
HETATM  101  H   UNL     1     -13.676  -3.438   1.247  1.00  0.00           H  
HETATM  102  H   UNL     1     -14.418  -4.066  -1.034  1.00  0.00           H  
HETATM  103  H   UNL     1     -13.547  -5.611  -0.892  1.00  0.00           H  
HETATM  104  H   UNL     1     -14.949  -6.223   1.059  1.00  0.00           H  
HETATM  105  H   UNL     1     -15.821  -4.677   0.918  1.00  0.00           H  
HETATM  106  H   UNL     1      -3.697   2.131   0.614  1.00  0.00           H  
HETATM  107  H   UNL     1      -2.826   0.586   0.756  1.00  0.00           H  
HETATM  108  H   UNL     1      -4.228  -0.026   2.708  1.00  0.00           H  
HETATM  109  H   UNL     1      -5.099   1.519   2.566  1.00  0.00           H  
HETATM  110  H   UNL     1      -5.841   0.892   0.285  1.00  0.00           H  
HETATM  111  H   UNL     1      -4.970  -0.654   0.426  1.00  0.00           H  
HETATM  112  H   UNL     1      -6.372  -1.265   2.378  1.00  0.00           H  
HETATM  113  H   UNL     1      -7.244   0.280   2.236  1.00  0.00           H  
HETATM  114  H   UNL     1      -7.986  -0.348  -0.045  1.00  0.00           H  
HETATM  115  H   UNL     1      -7.114  -1.893   0.097  1.00  0.00           H  
HETATM  116  H   UNL     1      -8.516  -2.505   2.048  1.00  0.00           H  
HETATM  117  H   UNL     1      -9.388  -0.959   1.907  1.00  0.00           H  
HETATM  118  H   UNL     1     -10.130  -1.587  -0.375  1.00  0.00           H  
HETATM  119  H   UNL     1      -9.258  -3.132  -0.233  1.00  0.00           H  
HETATM  120  H   UNL     1     -11.532  -2.198   1.577  1.00  0.00           H  
HETATM  121  H   UNL     1     -10.661  -3.744   1.719  1.00  0.00           H  
HETATM  122  H   UNL     1     -16.563  -5.305  -1.363  1.00  0.00           H  
HETATM  123  H   UNL     1     -15.691  -6.850  -1.222  1.00  0.00           H  
HETATM  124  H   UNL     1     -18.707  -6.544  -1.693  1.00  0.00           H  
HETATM  125  H   UNL     1     -17.835  -8.090  -1.551  1.00  0.00           H  
HETATM  126  H   UNL     1     -19.229  -7.754  -0.496  1.00  0.00           H  
HETATM  127  H   UNL     1     -17.093  -7.462   0.730  1.00  0.00           H  
HETATM  128  H   UNL     1     -17.965  -5.917   0.588  1.00  0.00           H  
CONECT    1    2   17   52   53                                       
CONECT    2    1   54                                                 
CONECT    3   17   55                                                 
CONECT    4   31   35   35   29                                       
CONECT    4   33                                                      
CONECT    5   13    8   56   57                                       
CONECT    6    7   10   10    9                                       
CONECT    7    8    6                                                 
CONECT    8   11    5    7   58                                       
CONECT    9    6   12   59   60                                       
CONECT   10    6    6                                                 
CONECT   11   29    8   61   62                                       
CONECT   12    9   15   63   64                                       
CONECT   13   40    5                                                 
CONECT   14   17   31   65   66                                       
CONECT   15   12   18   67   68                                       
CONECT   16   40   40                                                 
CONECT   17    1    3   14   69                                       
CONECT   18   15   20   70   71                                       
CONECT   19   27   21   72   73                                       
CONECT   20   18   22   74   75                                       
CONECT   21   19   23   76   77                                       
CONECT   22   20   24   78   79                                       
CONECT   23   21   25   80   81                                       
CONECT   24   22   26   82   83                                       
CONECT   25   23   28   84   85                                       
CONECT   26   24   27   27   86                                       
CONECT   27   26   26   19   87                                       
CONECT   28   25   30   88   89                                       
CONECT   29    4   11                                                 
CONECT   30   28   32   90   91                                       
CONECT   31   14    4                                                 
CONECT   32   30   34   92   93                                       
CONECT   33    4   94                                                 
CONECT   34   32   95   96   97                                       
CONECT   35    4    4                                                 
CONECT   36   48   37   98   99                                       
CONECT   37   36   38  100  101                                       
CONECT   38   37   39  102  103                                       
CONECT   39   38   49  104  105                                       
CONECT   40   16   16   13   41                                       
CONECT   41   40   42  106  107                                       
CONECT   42   41   43  108  109                                       
CONECT   43   42   44  110  111                                       
CONECT   44   43   45  112  113                                       
CONECT   45   44   46  114  115                                       
CONECT   46   45   47  116  117                                       
CONECT   47   46   48  118  119                                       
CONECT   48   47   36  120  121                                       
CONECT   49   39   51  122  123                                       
CONECT   50   51  124  125  126                                       
CONECT   51   49   50  127  128                                       
CONECT   52    1                                                      
CONECT   53    1                                                      
CONECT   54    2                                                      
CONECT   55    3                                                      
CONECT   56    5                                                      
CONECT   57    5                                                      
CONECT   58    8                                                      
CONECT   59    9                                                      
CONECT   60    9                                                      
CONECT   61   11                                                      
CONECT   62   11                                                      
CONECT   63   12                                                      
CONECT   64   12                                                      
CONECT   65   14                                                      
CONECT   66   14                                                      
CONECT   67   15                                                      
CONECT   68   15                                                      
CONECT   69   17                                                      
CONECT   70   18                                                      
CONECT   71   18                                                      
CONECT   72   19                                                      
CONECT   73   19                                                      
CONECT   74   20                                                      
CONECT   75   20                                                      
CONECT   76   21                                                      
CONECT   77   21                                                      
CONECT   78   22                                                      
CONECT   79   22                                                      
CONECT   80   23                                                      
CONECT   81   23                                                      
CONECT   82   24                                                      
CONECT   83   24                                                      
CONECT   84   25                                                      
CONECT   85   25                                                      
CONECT   86   26                                                      
CONECT   87   27                                                      
CONECT   88   28                                                      
CONECT   89   28                                                      
CONECT   90   30                                                      
CONECT   91   30                                                      
CONECT   92   32                                                      
CONECT   93   32                                                      
CONECT   94   33                                                      
CONECT   95   34                                                      
CONECT   96   34                                                      
CONECT   97   34                                                      
CONECT   98   36                                                      
CONECT   99   36                                                      
CONECT  100   37                                                      
CONECT  101   37                                                      
CONECT  102   38                                                      
CONECT  103   38                                                      
CONECT  104   39                                                      
CONECT  105   39                                                      
CONECT  106   41                                                      
CONECT  107   41                                                      
CONECT  108   42                                                      
CONECT  109   42                                                      
CONECT  110   43                                                      
CONECT  111   43                                                      
CONECT  112   44                                                      
CONECT  113   44                                                      
CONECT  114   45                                                      
CONECT  115   45                                                      
CONECT  116   46                                                      
CONECT  117   46                                                      
CONECT  118   47                                                      
CONECT  119   47                                                      
CONECT  120   48                                                      
CONECT  121   48                                                      
CONECT  122   49                                                      
CONECT  123   49                                                      
CONECT  124   50                                                      
CONECT  125   50                                                      
CONECT  126   50                                                      
CONECT  127   51                                                      
CONECT  128   51                                                      
MASTER        0    0    0    0    0    0    0    0  128    0  128    0
END
