COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1      -7.476   2.020  -0.061  1.00  0.00           P  
HETATM    2  O   UNL     1      -8.325   0.683  -0.355  1.00  0.00           O  
HETATM    3  O   UNL     1      -7.755   3.023  -1.113  1.00  0.00           O  
HETATM    4  O   UNL     1      -5.905   1.668  -0.059  1.00  0.00           O  
HETATM    5  O   UNL     1      -7.894   2.617   1.374  1.00  0.00           O  
HETATM    6  C   UNL     1      -9.743   0.684  -0.524  1.00  0.00           C  
HETATM    7  C   UNL     1     -10.226  -0.744  -0.787  1.00  0.00           C  
HETATM    8  C   UNL     1      -9.470  -1.326  -1.982  1.00  0.00           C  
HETATM    9  O   UNL     1      -8.041  -1.233  -1.743  1.00  0.00           O  
HETATM   10  O   UNL     1      -7.699  -2.178  -3.711  1.00  0.00           O  
HETATM   11  C   UNL     1      -7.230  -1.704  -2.703  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.735  -1.641  -2.524  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.049  -2.239  -3.754  1.00  0.00           C  
HETATM   14  O   UNL     1      -9.980  -1.562   0.387  1.00  0.00           O  
HETATM   15  O   UNL     1     -11.741  -2.782  -0.154  1.00  0.00           O  
HETATM   16  C   UNL     1     -10.825  -2.581   0.608  1.00  0.00           C  
HETATM   17  C   UNL     1     -10.632  -3.473   1.807  1.00  0.00           C  
HETATM   18  C   UNL     1     -11.723  -4.547   1.825  1.00  0.00           C  
HETATM   19  C   UNL     1     -11.527  -5.453   3.042  1.00  0.00           C  
HETATM   20  P   UNL     1       0.220   3.186   0.646  1.00  0.00           P  
HETATM   21  O   UNL     1       1.462   2.166   0.545  1.00  0.00           O  
HETATM   22  O   UNL     1       0.181   3.840   2.117  1.00  0.00           O  
HETATM   23  O   UNL     1      -1.153   2.388   0.378  1.00  0.00           O  
HETATM   24  O   UNL     1       0.375   4.254  -0.366  1.00  0.00           O  
HETATM   25  C   UNL     1       2.824   2.588   0.632  1.00  0.00           C  
HETATM   26  C   UNL     1       3.744   1.373   0.498  1.00  0.00           C  
HETATM   27  C   UNL     1       5.201   1.838   0.466  1.00  0.00           C  
HETATM   28  O   UNL     1       6.067   0.698   0.220  1.00  0.00           O  
HETATM   29  O   UNL     1       7.805   2.061   0.311  1.00  0.00           O  
HETATM   30  C   UNL     1       7.387   0.937   0.162  1.00  0.00           C  
HETATM   31  C   UNL     1       8.348  -0.196  -0.090  1.00  0.00           C  
HETATM   32  C   UNL     1       9.779   0.343  -0.108  1.00  0.00           C  
HETATM   33  C   UNL     1      10.755  -0.808  -0.364  1.00  0.00           C  
HETATM   34  C   UNL     1      12.186  -0.269  -0.382  1.00  0.00           C  
HETATM   35  C   UNL     1      13.161  -1.419  -0.638  1.00  0.00           C  
HETATM   36  C   UNL     1      14.593  -0.880  -0.656  1.00  0.00           C  
HETATM   37  C   UNL     1      15.568  -2.031  -0.911  1.00  0.00           C  
HETATM   38  C   UNL     1      17.000  -1.492  -0.930  1.00  0.00           C  
HETATM   39  C   UNL     1      17.975  -2.643  -1.186  1.00  0.00           C  
HETATM   40  C   UNL     1      19.407  -2.103  -1.204  1.00  0.00           C  
HETATM   41  O   UNL     1       3.544   0.487   1.631  1.00  0.00           O  
HETATM   42  O   UNL     1       4.075  -1.218   0.329  1.00  0.00           O  
HETATM   43  C   UNL     1       3.744  -0.823   1.422  1.00  0.00           C  
HETATM   44  C   UNL     1       3.555  -1.804   2.551  1.00  0.00           C  
HETATM   45  C   UNL     1       3.843  -3.220   2.050  1.00  0.00           C  
HETATM   46  C   UNL     1       3.652  -4.215   3.197  1.00  0.00           C  
HETATM   47  C   UNL     1      -2.425   3.033   0.296  1.00  0.00           C  
HETATM   48  C   UNL     1      -3.511   1.988   0.034  1.00  0.00           C  
HETATM   49  O   UNL     1      -3.303   1.398  -1.251  1.00  0.00           O  
HETATM   50  C   UNL     1      -4.885   2.661   0.070  1.00  0.00           C  
HETATM   51  H   UNL     1      -7.738   2.012   2.112  1.00  0.00           H  
HETATM   52  H   UNL     1     -10.217   1.067   0.380  1.00  0.00           H  
HETATM   53  H   UNL     1     -10.008   1.319  -1.370  1.00  0.00           H  
HETATM   54  H   UNL     1     -11.295  -0.732  -1.004  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.749  -2.371  -2.115  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.724  -0.765  -2.882  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.426  -0.603  -2.405  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.357  -3.278  -3.874  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.333  -1.672  -4.641  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.654  -3.951   1.751  1.00  0.00           H  
HETATM   61  H   UNL     1     -10.694  -2.877   2.717  1.00  0.00           H  
HETATM   62  H   UNL     1     -12.701  -4.069   1.881  1.00  0.00           H  
HETATM   63  H   UNL     1     -11.661  -5.143   0.914  1.00  0.00           H  
HETATM   64  H   UNL     1     -11.589  -4.857   3.952  1.00  0.00           H  
HETATM   65  H   UNL     1     -12.304  -6.217   3.054  1.00  0.00           H  
HETATM   66  H   UNL     1     -10.549  -5.930   2.986  1.00  0.00           H  
HETATM   67  H   UNL     1       0.081   3.197   2.831  1.00  0.00           H  
HETATM   68  H   UNL     1       3.037   3.295  -0.170  1.00  0.00           H  
HETATM   69  H   UNL     1       2.995   3.069   1.595  1.00  0.00           H  
HETATM   70  H   UNL     1       3.512   0.841  -0.425  1.00  0.00           H  
HETATM   71  H   UNL     1       5.331   2.571  -0.330  1.00  0.00           H  
HETATM   72  H   UNL     1       5.460   2.291   1.423  1.00  0.00           H  
HETATM   73  H   UNL     1       8.249  -0.938   0.702  1.00  0.00           H  
HETATM   74  H   UNL     1       8.121  -0.658  -1.051  1.00  0.00           H  
HETATM   75  H   UNL     1       9.878   1.085  -0.901  1.00  0.00           H  
HETATM   76  H   UNL     1      10.006   0.805   0.853  1.00  0.00           H  
HETATM   77  H   UNL     1      10.656  -1.550   0.429  1.00  0.00           H  
HETATM   78  H   UNL     1      10.528  -1.270  -1.324  1.00  0.00           H  
HETATM   79  H   UNL     1      12.285   0.474  -1.174  1.00  0.00           H  
HETATM   80  H   UNL     1      12.413   0.193   0.579  1.00  0.00           H  
HETATM   81  H   UNL     1      13.063  -2.162   0.155  1.00  0.00           H  
HETATM   82  H   UNL     1      12.935  -1.882  -1.599  1.00  0.00           H  
HETATM   83  H   UNL     1      14.691  -0.138  -1.449  1.00  0.00           H  
HETATM   84  H   UNL     1      14.820  -0.418   0.305  1.00  0.00           H  
HETATM   85  H   UNL     1      15.470  -2.773  -0.119  1.00  0.00           H  
HETATM   86  H   UNL     1      15.342  -2.493  -1.872  1.00  0.00           H  
HETATM   87  H   UNL     1      17.098  -0.750  -1.722  1.00  0.00           H  
HETATM   88  H   UNL     1      17.227  -1.030   0.031  1.00  0.00           H  
HETATM   89  H   UNL     1      17.877  -3.385  -0.393  1.00  0.00           H  
HETATM   90  H   UNL     1      17.749  -3.105  -2.146  1.00  0.00           H  
HETATM   91  H   UNL     1      19.505  -1.361  -1.996  1.00  0.00           H  
HETATM   92  H   UNL     1      19.634  -1.641  -0.243  1.00  0.00           H  
HETATM   93  H   UNL     1      20.102  -2.923  -1.386  1.00  0.00           H  
HETATM   94  H   UNL     1       4.239  -1.559   3.363  1.00  0.00           H  
HETATM   95  H   UNL     1       2.528  -1.748   2.912  1.00  0.00           H  
HETATM   96  H   UNL     1       3.159  -3.465   1.238  1.00  0.00           H  
HETATM   97  H   UNL     1       4.870  -3.276   1.689  1.00  0.00           H  
HETATM   98  H   UNL     1       4.336  -3.970   4.009  1.00  0.00           H  
HETATM   99  H   UNL     1       2.625  -4.160   3.558  1.00  0.00           H  
HETATM  100  H   UNL     1       3.857  -5.225   2.840  1.00  0.00           H  
HETATM  101  H   UNL     1      -2.633   3.546   1.235  1.00  0.00           H  
HETATM  102  H   UNL     1      -2.413   3.758  -0.519  1.00  0.00           H  
HETATM  103  H   UNL     1      -3.465   1.215   0.801  1.00  0.00           H  
HETATM  104  H   UNL     1      -3.332   2.029  -1.983  1.00  0.00           H  
HETATM  105  H   UNL     1      -4.964   3.371  -0.753  1.00  0.00           H  
HETATM  106  H   UNL     1      -5.008   3.187   1.016  1.00  0.00           H  
HETATM  107  H   UNL     1      -5.451  -2.209  -1.638  1.00  0.00           H  
HETATM  108  H   UNL     1      -3.967  -2.194  -3.625  1.00  0.00           H  
CONECT    1    3    3    5    2                                       
CONECT    1    4                                                      
CONECT    2    1    6                                                 
CONECT    3    1    1                                                 
CONECT    4    1   50                                                 
CONECT    5    1   51                                                 
CONECT    6    2   52   53    7                                       
CONECT    7    6   14    8   54                                       
CONECT    8    7   55   56    9                                       
CONECT    9    8   11                                                 
CONECT   10   11   11                                                 
CONECT   11    9   10   10   12                                       
CONECT   12   11   57   13  107                                       
CONECT   13   12   58   59  108                                       
CONECT   14    7   16                                                 
CONECT   15   16   16                                                 
CONECT   16   15   15   14   17                                       
CONECT   17   16   60   61   18                                       
CONECT   18   17   62   63   19                                       
CONECT   19   18   64   65   66                                       
CONECT   20   22   21   23   24                                       
CONECT   20   24                                                      
CONECT   21   20   25                                                 
CONECT   22   20   67                                                 
CONECT   23   20   47                                                 
CONECT   24   20   20                                                 
CONECT   25   21   68   69   26                                       
CONECT   26   25   27   70   41                                       
CONECT   27   26   71   72   28                                       
CONECT   28   27   30                                                 
CONECT   29   30   30                                                 
CONECT   30   28   29   29   31                                       
CONECT   31   30   32   73   74                                       
CONECT   32   31   75   76   33                                       
CONECT   33   32   34   77   78                                       
CONECT   34   33   79   80   35                                       
CONECT   35   34   81   82   36                                       
CONECT   36   35   37   83   84                                       
CONECT   37   36   85   86   38                                       
CONECT   38   37   39   87   88                                       
CONECT   39   38   89   90   40                                       
CONECT   40   39   91   92   93                                       
CONECT   41   26   43                                                 
CONECT   42   43   43                                                 
CONECT   43   42   42   41   44                                       
CONECT   44   43   94   95   45                                       
CONECT   45   44   46   96   97                                       
CONECT   46   45   98   99  100                                       
CONECT   47   23   48  101  102                                       
CONECT   48   47   50  103   49                                       
CONECT   49   48  104                                                 
CONECT   50   48    4  105  106                                       
CONECT   51    5                                                      
CONECT   52    6                                                      
CONECT   53    6                                                      
CONECT   54    7                                                      
CONECT   55    8                                                      
CONECT   56    8                                                      
CONECT   57   12                                                      
CONECT   58   13                                                      
CONECT   59   13                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   18                                                      
CONECT   64   19                                                      
CONECT   65   19                                                      
CONECT   66   19                                                      
CONECT   67   22                                                      
CONECT   68   25                                                      
CONECT   69   25                                                      
CONECT   70   26                                                      
CONECT   71   27                                                      
CONECT   72   27                                                      
CONECT   73   31                                                      
CONECT   74   31                                                      
CONECT   75   32                                                      
CONECT   76   32                                                      
CONECT   77   33                                                      
CONECT   78   33                                                      
CONECT   79   34                                                      
CONECT   80   34                                                      
CONECT   81   35                                                      
CONECT   82   35                                                      
CONECT   83   36                                                      
CONECT   84   36                                                      
CONECT   85   37                                                      
CONECT   86   37                                                      
CONECT   87   38                                                      
CONECT   88   38                                                      
CONECT   89   39                                                      
CONECT   90   39                                                      
CONECT   91   40                                                      
CONECT   92   40                                                      
CONECT   93   40                                                      
CONECT   94   44                                                      
CONECT   95   44                                                      
CONECT   96   45                                                      
CONECT   97   45                                                      
CONECT   98   46                                                      
CONECT   99   46                                                      
CONECT  100   46                                                      
CONECT  101   47                                                      
CONECT  102   47                                                      
CONECT  103   48                                                      
CONECT  104   49                                                      
CONECT  105   50                                                      
CONECT  106   50                                                      
CONECT  107   12                                                      
CONECT  108   13                                                      
MASTER        0    0    0    0    0    0    0    0  108    0  108    0
END
