COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.094  -1.435  -1.574  1.00  0.00           O  
HETATM    2  P   UNL     1       6.847  -1.907  -0.390  1.00  0.00           P  
HETATM    3  O   UNL     1       6.319  -3.368   0.034  1.00  0.00           O  
HETATM    4  O   UNL     1       8.415  -1.985  -0.747  1.00  0.00           O  
HETATM    5  O   UNL     1       6.624  -0.881   0.830  1.00  0.00           O  
HETATM    6  C   UNL     1       6.895   0.519   0.730  1.00  0.00           C  
HETATM    7  C   UNL     1       6.581   1.186   2.044  1.00  0.00           C  
HETATM    8  C   UNL     1       5.941   2.329   2.062  1.00  0.00           C  
HETATM    9  C   UNL     1       5.521   2.937   3.375  1.00  0.00           C  
HETATM   10  C   UNL     1       5.624   3.035   0.768  1.00  0.00           C  
HETATM   11  C   UNL     1       4.221   2.639   0.302  1.00  0.00           C  
HETATM   12  C   UNL     1       3.904   3.345  -0.991  1.00  0.00           C  
HETATM   13  C   UNL     1       3.648   2.650  -2.072  1.00  0.00           C  
HETATM   14  C   UNL     1       3.182   3.347  -3.324  1.00  0.00           C  
HETATM   15  C   UNL     1       3.819   1.153  -2.062  1.00  0.00           C  
HETATM   16  C   UNL     1       2.489   0.490  -1.698  1.00  0.00           C  
HETATM   17  C   UNL     1       2.660  -1.008  -1.688  1.00  0.00           C  
HETATM   18  C   UNL     1       2.516  -1.676  -0.571  1.00  0.00           C  
HETATM   19  C   UNL     1       2.637  -3.178  -0.571  1.00  0.00           C  
HETATM   20  C   UNL     1       2.228  -0.943   0.714  1.00  0.00           C  
HETATM   21  C   UNL     1       0.715  -0.849   0.920  1.00  0.00           C  
HETATM   22  C   UNL     1       0.428  -0.116   2.205  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.205   1.030   2.178  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.576   1.717   3.467  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.563   1.662   0.858  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.987   1.259   0.469  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.345   1.890  -0.852  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.590   1.136  -1.894  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.086   1.757  -3.174  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.377  -0.354  -1.812  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.704  -1.042  -1.486  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.490  -2.532  -1.404  1.00  0.00           C  
HETATM   33  C   UNL     1      -3.733  -3.168  -0.285  1.00  0.00           C  
HETATM   34  C   UNL     1      -3.673  -4.673  -0.246  1.00  0.00           C  
HETATM   35  C   UNL     1      -4.071  -2.395   0.963  1.00  0.00           C  
HETATM   36  C   UNL     1      -5.590  -2.252   1.079  1.00  0.00           C  
HETATM   37  C   UNL     1      -5.928  -1.479   2.327  1.00  0.00           C  
HETATM   38  C   UNL     1      -6.565  -0.338   2.238  1.00  0.00           C  
HETATM   39  C   UNL     1      -7.045   0.357   3.487  1.00  0.00           C  
HETATM   40  C   UNL     1      -6.818   0.281   0.888  1.00  0.00           C  
HETATM   41  C   UNL     1      -8.207  -0.125   0.392  1.00  0.00           C  
HETATM   42  C   UNL     1      -8.460   0.493  -0.958  1.00  0.00           C  
HETATM   43  C   UNL     1      -9.540   1.207  -1.160  1.00  0.00           C  
HETATM   44  C   UNL     1     -10.566   1.348  -0.065  1.00  0.00           C  
HETATM   45  C   UNL     1      -9.756   1.887  -2.487  1.00  0.00           C  
HETATM   46  H   UNL     1       6.422  -4.038  -0.655  1.00  0.00           H  
HETATM   47  H   UNL     1       8.970  -2.287  -0.015  1.00  0.00           H  
HETATM   48  H   UNL     1       7.947   0.669   0.488  1.00  0.00           H  
HETATM   49  H   UNL     1       6.276   0.953  -0.055  1.00  0.00           H  
HETATM   50  H   UNL     1       6.884   0.723   2.971  1.00  0.00           H  
HETATM   51  H   UNL     1       6.315   3.585   3.746  1.00  0.00           H  
HETATM   52  H   UNL     1       4.613   3.522   3.230  1.00  0.00           H  
HETATM   53  H   UNL     1       5.331   2.145   4.098  1.00  0.00           H  
HETATM   54  H   UNL     1       5.664   4.113   0.924  1.00  0.00           H  
HETATM   55  H   UNL     1       6.353   2.750   0.010  1.00  0.00           H  
HETATM   56  H   UNL     1       4.181   1.561   0.146  1.00  0.00           H  
HETATM   57  H   UNL     1       3.492   2.924   1.060  1.00  0.00           H  
HETATM   58  H   UNL     1       3.889   4.424  -1.028  1.00  0.00           H  
HETATM   59  H   UNL     1       4.046   3.625  -3.928  1.00  0.00           H  
HETATM   60  H   UNL     1       2.539   2.677  -3.895  1.00  0.00           H  
HETATM   61  H   UNL     1       2.624   4.244  -3.054  1.00  0.00           H  
HETATM   62  H   UNL     1       4.134   0.817  -3.050  1.00  0.00           H  
HETATM   63  H   UNL     1       4.575   0.878  -1.327  1.00  0.00           H  
HETATM   64  H   UNL     1       2.174   0.826  -0.710  1.00  0.00           H  
HETATM   65  H   UNL     1       1.733   0.764  -2.433  1.00  0.00           H  
HETATM   66  H   UNL     1       2.902  -1.529  -2.602  1.00  0.00           H  
HETATM   67  H   UNL     1       3.675  -3.459  -0.392  1.00  0.00           H  
HETATM   68  H   UNL     1       2.007  -3.594   0.216  1.00  0.00           H  
HETATM   69  H   UNL     1       2.316  -3.569  -1.537  1.00  0.00           H  
HETATM   70  H   UNL     1       2.676  -1.484   1.548  1.00  0.00           H  
HETATM   71  H   UNL     1       2.651   0.060   0.663  1.00  0.00           H  
HETATM   72  H   UNL     1       0.268  -0.308   0.086  1.00  0.00           H  
HETATM   73  H   UNL     1       0.292  -1.852   0.972  1.00  0.00           H  
HETATM   74  H   UNL     1       0.745  -0.536   3.149  1.00  0.00           H  
HETATM   75  H   UNL     1      -1.565   1.386   3.784  1.00  0.00           H  
HETATM   76  H   UNL     1       0.155   1.466   4.236  1.00  0.00           H  
HETATM   77  H   UNL     1      -0.586   2.796   3.314  1.00  0.00           H  
HETATM   78  H   UNL     1      -0.505   2.747   0.946  1.00  0.00           H  
HETATM   79  H   UNL     1       0.133   1.322   0.091  1.00  0.00           H  
HETATM   80  H   UNL     1      -2.046   0.174   0.380  1.00  0.00           H  
HETATM   81  H   UNL     1      -2.684   1.599   1.235  1.00  0.00           H  
HETATM   82  H   UNL     1      -2.400   2.966  -0.939  1.00  0.00           H  
HETATM   83  H   UNL     1      -2.235   2.028  -3.799  1.00  0.00           H  
HETATM   84  H   UNL     1      -3.714   1.042  -3.706  1.00  0.00           H  
HETATM   85  H   UNL     1      -3.667   2.650  -2.944  1.00  0.00           H  
HETATM   86  H   UNL     1      -2.003  -0.720  -2.769  1.00  0.00           H  
HETATM   87  H   UNL     1      -1.651  -0.575  -1.030  1.00  0.00           H  
HETATM   88  H   UNL     1      -4.077  -0.676  -0.530  1.00  0.00           H  
HETATM   89  H   UNL     1      -4.430  -0.822  -2.268  1.00  0.00           H  
HETATM   90  H   UNL     1      -3.137  -3.075  -2.268  1.00  0.00           H  
HETATM   91  H   UNL     1      -4.657  -5.082  -0.479  1.00  0.00           H  
HETATM   92  H   UNL     1      -2.950  -5.028  -0.980  1.00  0.00           H  
HETATM   93  H   UNL     1      -3.371  -4.999   0.749  1.00  0.00           H  
HETATM   94  H   UNL     1      -3.688  -2.926   1.835  1.00  0.00           H  
HETATM   95  H   UNL     1      -3.616  -1.405   0.912  1.00  0.00           H  
HETATM   96  H   UNL     1      -5.972  -1.721   0.208  1.00  0.00           H  
HETATM   97  H   UNL     1      -6.045  -3.241   1.130  1.00  0.00           H  
HETATM   98  H   UNL     1      -5.645  -1.865   3.295  1.00  0.00           H  
HETATM   99  H   UNL     1      -6.268   1.028   3.851  1.00  0.00           H  
HETATM  100  H   UNL     1      -7.944   0.931   3.261  1.00  0.00           H  
HETATM  101  H   UNL     1      -7.272  -0.386   4.252  1.00  0.00           H  
HETATM  102  H   UNL     1      -6.765   1.367   0.970  1.00  0.00           H  
HETATM  103  H   UNL     1      -6.064  -0.068   0.182  1.00  0.00           H  
HETATM  104  H   UNL     1      -8.261  -1.211   0.311  1.00  0.00           H  
HETATM  105  H   UNL     1      -8.961   0.223   1.098  1.00  0.00           H  
HETATM  106  H   UNL     1      -7.751   0.348  -1.760  1.00  0.00           H  
HETATM  107  H   UNL     1     -10.327   2.218   0.546  1.00  0.00           H  
HETATM  108  H   UNL     1     -11.554   1.474  -0.508  1.00  0.00           H  
HETATM  109  H   UNL     1     -10.558   0.453   0.557  1.00  0.00           H  
HETATM  110  H   UNL     1      -9.321   2.886  -2.459  1.00  0.00           H  
HETATM  111  H   UNL     1      -9.278   1.306  -3.276  1.00  0.00           H  
HETATM  112  H   UNL     1     -10.825   1.962  -2.688  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    5    1    1    4                                       
CONECT    2    3                                                      
CONECT    3    2   46                                                 
CONECT    4    2   47                                                 
CONECT    5    6    2                                                 
CONECT    6    7    5   48   49                                       
CONECT    7    8    8    6   50                                       
CONECT    8   10    9    7    7                                       
CONECT    9    8   51   52   53                                       
CONECT   10   11    8   54   55                                       
CONECT   11   12   10   56   57                                       
CONECT   12   13   13   11   58                                       
CONECT   13   14   15   12   12                                       
CONECT   14   13   59   60   61                                       
CONECT   15   16   13   62   63                                       
CONECT   16   17   15   64   65                                       
CONECT   17   18   18   16   66                                       
CONECT   18   20   17   17   19                                       
CONECT   19   18   67   68   69                                       
CONECT   20   21   18   70   71                                       
CONECT   21   22   20   72   73                                       
CONECT   22   23   23   21   74                                       
CONECT   23   24   25   22   22                                       
CONECT   24   23   75   76   77                                       
CONECT   25   26   23   78   79                                       
CONECT   26   27   25   80   81                                       
CONECT   27   28   28   26   82                                       
CONECT   28   30   29   27   27                                       
CONECT   29   28   83   84   85                                       
CONECT   30   31   28   86   87                                       
CONECT   31   32   30   88   89                                       
CONECT   32   33   33   31   90                                       
CONECT   33   34   35   32   32                                       
CONECT   34   33   91   92   93                                       
CONECT   35   36   33   94   95                                       
CONECT   36   35   37   96   97                                       
CONECT   37   36   38   38   98                                       
CONECT   38   40   37   37   39                                       
CONECT   39   38   99  100  101                                       
CONECT   40   41   38  102  103                                       
CONECT   41   42   40  104  105                                       
CONECT   42   43   43   41  106                                       
CONECT   43   45   44   42   42                                       
CONECT   44   43  107  108  109                                       
CONECT   45   43  110  111  112                                       
CONECT   46    3                                                      
CONECT   47    4                                                      
CONECT   48    6                                                      
CONECT   49    6                                                      
CONECT   50    7                                                      
CONECT   51    9                                                      
CONECT   52    9                                                      
CONECT   53    9                                                      
CONECT   54   10                                                      
CONECT   55   10                                                      
CONECT   56   11                                                      
CONECT   57   11                                                      
CONECT   58   12                                                      
CONECT   59   14                                                      
CONECT   60   14                                                      
CONECT   61   14                                                      
CONECT   62   15                                                      
CONECT   63   15                                                      
CONECT   64   16                                                      
CONECT   65   16                                                      
CONECT   66   17                                                      
CONECT   67   19                                                      
CONECT   68   19                                                      
CONECT   69   19                                                      
CONECT   70   20                                                      
CONECT   71   20                                                      
CONECT   72   21                                                      
CONECT   73   21                                                      
CONECT   74   22                                                      
CONECT   75   24                                                      
CONECT   76   24                                                      
CONECT   77   24                                                      
CONECT   78   25                                                      
CONECT   79   25                                                      
CONECT   80   26                                                      
CONECT   81   26                                                      
CONECT   82   27                                                      
CONECT   83   29                                                      
CONECT   84   29                                                      
CONECT   85   29                                                      
CONECT   86   30                                                      
CONECT   87   30                                                      
CONECT   88   31                                                      
CONECT   89   31                                                      
CONECT   90   32                                                      
CONECT   91   34                                                      
CONECT   92   34                                                      
CONECT   93   34                                                      
CONECT   94   35                                                      
CONECT   95   35                                                      
CONECT   96   36                                                      
CONECT   97   36                                                      
CONECT   98   37                                                      
CONECT   99   39                                                      
CONECT  100   39                                                      
CONECT  101   39                                                      
CONECT  102   40                                                      
CONECT  103   40                                                      
CONECT  104   41                                                      
CONECT  105   41                                                      
CONECT  106   42                                                      
CONECT  107   44                                                      
CONECT  108   44                                                      
CONECT  109   44                                                      
CONECT  110   45                                                      
CONECT  111   45                                                      
CONECT  112   45                                                      
MASTER        0    0    0    0    0    0    0    0  112    0  112    0
END
