COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       0.572  -2.039   2.676  1.00  0.00           P  
HETATM    2  O   UNL     1       1.654  -3.014   2.413  1.00  0.00           O  
HETATM    3  O   UNL     1      -0.346  -2.569   3.887  1.00  0.00           O  
HETATM    4  O   UNL     1       1.217  -0.618   3.074  1.00  0.00           O  
HETATM    5  C   UNL     1      21.556   2.383  -4.866  1.00  0.00           C  
HETATM    6  C   UNL     1      20.732   1.994  -3.638  1.00  0.00           C  
HETATM    7  C   UNL     1      19.252   2.275  -3.907  1.00  0.00           C  
HETATM    8  C   UNL     1      18.427   1.886  -2.679  1.00  0.00           C  
HETATM    9  C   UNL     1      16.947   2.166  -2.948  1.00  0.00           C  
HETATM   10  C   UNL     1      16.122   1.777  -1.720  1.00  0.00           C  
HETATM   11  C   UNL     1      14.643   2.058  -1.989  1.00  0.00           C  
HETATM   12  C   UNL     1      13.818   1.669  -0.761  1.00  0.00           C  
HETATM   13  C   UNL     1      12.338   1.949  -1.030  1.00  0.00           C  
HETATM   14  C   UNL     1      11.513   1.561   0.199  1.00  0.00           C  
HETATM   15  C   UNL     1      10.034   1.841  -0.071  1.00  0.00           C  
HETATM   16  C   UNL     1       9.209   1.452   1.158  1.00  0.00           C  
HETATM   17  C   UNL     1       7.729   1.733   0.888  1.00  0.00           C  
HETATM   18  C   UNL     1       6.904   1.344   2.116  1.00  0.00           C  
HETATM   19  C   UNL     1       5.424   1.624   1.847  1.00  0.00           C  
HETATM   20  C   UNL     1       4.612   1.241   3.057  1.00  0.00           C  
HETATM   21  O   UNL     1       5.160   0.790   4.035  1.00  0.00           O  
HETATM   22  O   UNL     1       3.279   1.401   3.049  1.00  0.00           O  
HETATM   23  C   UNL     1       2.561   1.011   4.249  1.00  0.00           C  
HETATM   24  C   UNL     1       2.152  -0.460   4.143  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.953  -2.968   0.689  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.437  -3.054  -0.749  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.104  -4.232  -1.461  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.620  -4.027  -1.475  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.136  -3.942  -0.037  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.469  -2.763   0.675  1.00  0.00           C  
HETATM   31  O   UNL     1      -0.330  -1.867   1.354  1.00  0.00           O  
HETATM   32  O   UNL     1      -0.748  -1.842  -1.440  1.00  0.00           O  
HETATM   33  O   UNL     1      -0.622  -4.312  -2.804  1.00  0.00           O  
HETATM   34  O   UNL     1      -3.243  -5.128  -2.140  1.00  0.00           O  
HETATM   35  O   UNL     1      -4.552  -3.751  -0.050  1.00  0.00           O  
HETATM   36  O   UNL     1      -2.951  -2.683   2.018  1.00  0.00           O  
HETATM   37  P   UNL     1      -4.145  -4.957  -3.463  1.00  0.00           P  
HETATM   38  O   UNL     1      -3.367  -4.247  -4.502  1.00  0.00           O  
HETATM   39  O   UNL     1      -4.575  -6.408  -4.011  1.00  0.00           O  
HETATM   40  O   UNL     1      -5.465  -4.106  -3.105  1.00  0.00           O  
HETATM   41  P   UNL     1      -5.583  -4.784   0.630  1.00  0.00           P  
HETATM   42  O   UNL     1      -7.077  -4.190   0.539  1.00  0.00           O  
HETATM   43  O   UNL     1      -5.518  -6.194  -0.144  1.00  0.00           O  
HETATM   44  O   UNL     1      -5.217  -4.984   2.050  1.00  0.00           O  
HETATM   45  C   UNL     1       1.310   1.879   4.399  1.00  0.00           C  
HETATM   46  O   UNL     1       0.399   1.609   3.302  1.00  0.00           O  
HETATM   47  C   UNL     1      -0.755   2.294   3.285  1.00  0.00           C  
HETATM   48  O   UNL     1      -0.997   3.092   4.159  1.00  0.00           O  
HETATM   49  C   UNL     1      -1.751   2.067   2.177  1.00  0.00           C  
HETATM   50  C   UNL     1      -2.970   2.965   2.394  1.00  0.00           C  
HETATM   51  C   UNL     1      -3.980   2.735   1.268  1.00  0.00           C  
HETATM   52  C   UNL     1      -5.200   3.633   1.486  1.00  0.00           C  
HETATM   53  C   UNL     1      -6.210   3.403   0.360  1.00  0.00           C  
HETATM   54  C   UNL     1      -7.429   4.301   0.578  1.00  0.00           C  
HETATM   55  C   UNL     1      -8.440   4.071  -0.548  1.00  0.00           C  
HETATM   56  C   UNL     1      -9.659   4.969  -0.331  1.00  0.00           C  
HETATM   57  C   UNL     1     -10.669   4.739  -1.456  1.00  0.00           C  
HETATM   58  C   UNL     1     -11.889   5.637  -1.239  1.00  0.00           C  
HETATM   59  C   UNL     1     -12.899   5.407  -2.364  1.00  0.00           C  
HETATM   60  C   UNL     1     -14.118   6.305  -2.147  1.00  0.00           C  
HETATM   61  C   UNL     1     -15.129   6.075  -3.272  1.00  0.00           C  
HETATM   62  C   UNL     1     -16.348   6.973  -3.055  1.00  0.00           C  
HETATM   63  C   UNL     1     -17.358   6.743  -4.181  1.00  0.00           C  
HETATM   64  H   UNL     1      -1.077  -1.979   4.115  1.00  0.00           H  
HETATM   65  H   UNL     1      21.420   3.444  -5.074  1.00  0.00           H  
HETATM   66  H   UNL     1      22.611   2.183  -4.674  1.00  0.00           H  
HETATM   67  H   UNL     1      21.226   1.799  -5.725  1.00  0.00           H  
HETATM   68  H   UNL     1      20.868   0.933  -3.429  1.00  0.00           H  
HETATM   69  H   UNL     1      21.062   2.578  -2.779  1.00  0.00           H  
HETATM   70  H   UNL     1      19.115   3.336  -4.115  1.00  0.00           H  
HETATM   71  H   UNL     1      18.922   1.690  -4.766  1.00  0.00           H  
HETATM   72  H   UNL     1      18.563   0.824  -2.470  1.00  0.00           H  
HETATM   73  H   UNL     1      18.757   2.470  -1.820  1.00  0.00           H  
HETATM   74  H   UNL     1      16.811   3.227  -3.156  1.00  0.00           H  
HETATM   75  H   UNL     1      16.617   1.582  -3.807  1.00  0.00           H  
HETATM   76  H   UNL     1      16.259   0.716  -1.511  1.00  0.00           H  
HETATM   77  H   UNL     1      16.452   2.361  -0.861  1.00  0.00           H  
HETATM   78  H   UNL     1      14.506   3.119  -2.197  1.00  0.00           H  
HETATM   79  H   UNL     1      14.313   1.474  -2.848  1.00  0.00           H  
HETATM   80  H   UNL     1      13.954   0.608  -0.552  1.00  0.00           H  
HETATM   81  H   UNL     1      14.148   2.253   0.098  1.00  0.00           H  
HETATM   82  H   UNL     1      12.202   3.011  -1.238  1.00  0.00           H  
HETATM   83  H   UNL     1      12.008   1.365  -1.889  1.00  0.00           H  
HETATM   84  H   UNL     1      11.650   0.499   0.407  1.00  0.00           H  
HETATM   85  H   UNL     1      11.843   2.145   1.058  1.00  0.00           H  
HETATM   86  H   UNL     1       9.897   2.902  -0.279  1.00  0.00           H  
HETATM   87  H   UNL     1       9.704   1.257  -0.930  1.00  0.00           H  
HETATM   88  H   UNL     1       9.345   0.391   1.366  1.00  0.00           H  
HETATM   89  H   UNL     1       9.539   2.036   2.016  1.00  0.00           H  
HETATM   90  H   UNL     1       7.593   2.794   0.680  1.00  0.00           H  
HETATM   91  H   UNL     1       7.399   1.148   0.029  1.00  0.00           H  
HETATM   92  H   UNL     1       7.041   0.283   2.325  1.00  0.00           H  
HETATM   93  H   UNL     1       7.234   1.928   2.976  1.00  0.00           H  
HETATM   94  H   UNL     1       5.288   2.685   1.639  1.00  0.00           H  
HETATM   95  H   UNL     1       5.095   1.040   0.988  1.00  0.00           H  
HETATM   96  H   UNL     1       3.205   1.147   5.118  1.00  0.00           H  
HETATM   97  H   UNL     1       1.692  -0.777   5.079  1.00  0.00           H  
HETATM   98  H   UNL     1       3.034  -1.069   3.947  1.00  0.00           H  
HETATM   99  H   UNL     1      -0.716  -3.892   1.215  1.00  0.00           H  
HETATM  100  H   UNL     1       0.643  -3.199  -0.739  1.00  0.00           H  
HETATM  101  H   UNL     1      -0.867  -5.156  -0.934  1.00  0.00           H  
HETATM  102  H   UNL     1      -2.857  -3.103  -2.002  1.00  0.00           H  
HETATM  103  H   UNL     1      -2.899  -4.866   0.490  1.00  0.00           H  
HETATM  104  H   UNL     1      -2.706  -1.839   0.148  1.00  0.00           H  
HETATM  105  H   UNL     1      -0.449  -1.826  -2.359  1.00  0.00           H  
HETATM  106  H   UNL     1       0.334  -4.442  -2.872  1.00  0.00           H  
HETATM  107  H   UNL     1      -2.570  -1.957   2.530  1.00  0.00           H  
HETATM  108  H   UNL     1      -5.121  -6.381  -4.808  1.00  0.00           H  
HETATM  109  H   UNL     1      -6.024  -4.513  -2.429  1.00  0.00           H  
HETATM  110  H   UNL     1      -7.752  -4.761   0.931  1.00  0.00           H  
HETATM  111  H   UNL     1      -5.747  -6.139  -1.082  1.00  0.00           H  
HETATM  112  H   UNL     1       0.819   1.647   5.344  1.00  0.00           H  
HETATM  113  H   UNL     1       1.594   2.931   4.386  1.00  0.00           H  
HETATM  114  H   UNL     1      -1.289   2.306   1.219  1.00  0.00           H  
HETATM  115  H   UNL     1      -2.064   1.023   2.178  1.00  0.00           H  
HETATM  116  H   UNL     1      -3.432   2.726   3.352  1.00  0.00           H  
HETATM  117  H   UNL     1      -2.657   4.009   2.393  1.00  0.00           H  
HETATM  118  H   UNL     1      -3.518   2.974   0.311  1.00  0.00           H  
HETATM  119  H   UNL     1      -4.294   1.691   1.270  1.00  0.00           H  
HETATM  120  H   UNL     1      -5.661   3.394   2.444  1.00  0.00           H  
HETATM  121  H   UNL     1      -4.886   4.677   1.485  1.00  0.00           H  
HETATM  122  H   UNL     1      -5.748   3.642  -0.597  1.00  0.00           H  
HETATM  123  H   UNL     1      -6.523   2.359   0.361  1.00  0.00           H  
HETATM  124  H   UNL     1      -7.891   4.062   1.535  1.00  0.00           H  
HETATM  125  H   UNL     1      -7.116   5.345   0.576  1.00  0.00           H  
HETATM  126  H   UNL     1      -7.978   4.310  -1.506  1.00  0.00           H  
HETATM  127  H   UNL     1      -8.753   3.027  -0.547  1.00  0.00           H  
HETATM  128  H   UNL     1     -10.121   4.729   0.627  1.00  0.00           H  
HETATM  129  H   UNL     1      -9.346   6.013  -0.332  1.00  0.00           H  
HETATM  130  H   UNL     1     -10.207   4.978  -2.414  1.00  0.00           H  
HETATM  131  H   UNL     1     -10.983   3.695  -1.455  1.00  0.00           H  
HETATM  132  H   UNL     1     -12.351   5.397  -0.281  1.00  0.00           H  
HETATM  133  H   UNL     1     -11.575   6.681  -1.240  1.00  0.00           H  
HETATM  134  H   UNL     1     -12.437   5.646  -3.322  1.00  0.00           H  
HETATM  135  H   UNL     1     -13.212   4.363  -2.363  1.00  0.00           H  
HETATM  136  H   UNL     1     -14.580   6.065  -1.189  1.00  0.00           H  
HETATM  137  H   UNL     1     -13.805   7.349  -2.148  1.00  0.00           H  
HETATM  138  H   UNL     1     -14.667   6.314  -4.230  1.00  0.00           H  
HETATM  139  H   UNL     1     -15.442   5.031  -3.271  1.00  0.00           H  
HETATM  140  H   UNL     1     -16.810   6.733  -2.097  1.00  0.00           H  
HETATM  141  H   UNL     1     -16.035   8.017  -3.056  1.00  0.00           H  
HETATM  142  H   UNL     1     -16.896   6.982  -5.138  1.00  0.00           H  
HETATM  143  H   UNL     1     -17.672   5.699  -4.180  1.00  0.00           H  
HETATM  144  H   UNL     1     -18.227   7.383  -4.026  1.00  0.00           H  
CONECT    1    4    2    2   31                                       
CONECT    1    3                                                      
CONECT    2    1    1                                                 
CONECT    3    1   64                                                 
CONECT    4   24    1                                                 
CONECT    5    6   65   66   67                                       
CONECT    6    7    5   68   69                                       
CONECT    7    8    6   70   71                                       
CONECT    8    9    7   72   73                                       
CONECT    9   10    8   74   75                                       
CONECT   10    9   11   76   77                                       
CONECT   11   12   10   78   79                                       
CONECT   12   13   11   80   81                                       
CONECT   13   14   12   82   83                                       
CONECT   14   15   13   84   85                                       
CONECT   15   16   14   86   87                                       
CONECT   16   17   15   88   89                                       
CONECT   17   18   16   90   91                                       
CONECT   18   19   17   92   93                                       
CONECT   19   20   18   94   95                                       
CONECT   20   21   21   22   19                                       
CONECT   21   20   20                                                 
CONECT   22   20   23                                                 
CONECT   23   45   22   24   96                                       
CONECT   24   23    4   97   98                                       
CONECT   25   26   31   30   99                                       
CONECT   26   27   32   25  100                                       
CONECT   27   33   26   28  101                                       
CONECT   28   27   34   29  102                                       
CONECT   29   28   30   35  103                                       
CONECT   30   25   29   36  104                                       
CONECT   31   25    1                                                 
CONECT   32   26  105                                                 
CONECT   33   27  106                                                 
CONECT   34   37   28                                                 
CONECT   35   29   41                                                 
CONECT   36   30  107                                                 
CONECT   37   38   38   39   34                                       
CONECT   37   40                                                      
CONECT   38   37   37                                                 
CONECT   39   37  108                                                 
CONECT   40   37  109                                                 
CONECT   41   35   44   44   43                                       
CONECT   41   42                                                      
CONECT   42   41  110                                                 
CONECT   43   41  111                                                 
CONECT   44   41   41                                                 
CONECT   45   46   23  112  113                                       
CONECT   46   47   45                                                 
CONECT   47   49   46   48   48                                       
CONECT   48   47   47                                                 
CONECT   49   50   47  114  115                                       
CONECT   50   49   51  116  117                                       
CONECT   51   50   52  118  119                                       
CONECT   52   51   53  120  121                                       
CONECT   53   52   54  122  123                                       
CONECT   54   53   55  124  125                                       
CONECT   55   54   56  126  127                                       
CONECT   56   55   57  128  129                                       
CONECT   57   56   58  130  131                                       
CONECT   58   57   59  132  133                                       
CONECT   59   58   60  134  135                                       
CONECT   60   59   61  136  137                                       
CONECT   61   60   62  138  139                                       
CONECT   62   61   63  140  141                                       
CONECT   63   62  142  143  144                                       
CONECT   64    3                                                      
CONECT   65    5                                                      
CONECT   66    5                                                      
CONECT   67    5                                                      
CONECT   68    6                                                      
CONECT   69    6                                                      
CONECT   70    7                                                      
CONECT   71    7                                                      
CONECT   72    8                                                      
CONECT   73    8                                                      
CONECT   74    9                                                      
CONECT   75    9                                                      
CONECT   76   10                                                      
CONECT   77   10                                                      
CONECT   78   11                                                      
CONECT   79   11                                                      
CONECT   80   12                                                      
CONECT   81   12                                                      
CONECT   82   13                                                      
CONECT   83   13                                                      
CONECT   84   14                                                      
CONECT   85   14                                                      
CONECT   86   15                                                      
CONECT   87   15                                                      
CONECT   88   16                                                      
CONECT   89   16                                                      
CONECT   90   17                                                      
CONECT   91   17                                                      
CONECT   92   18                                                      
CONECT   93   18                                                      
CONECT   94   19                                                      
CONECT   95   19                                                      
CONECT   96   23                                                      
CONECT   97   24                                                      
CONECT   98   24                                                      
CONECT   99   25                                                      
CONECT  100   26                                                      
CONECT  101   27                                                      
CONECT  102   28                                                      
CONECT  103   29                                                      
CONECT  104   30                                                      
CONECT  105   32                                                      
CONECT  106   33                                                      
CONECT  107   36                                                      
CONECT  108   39                                                      
CONECT  109   40                                                      
CONECT  110   42                                                      
CONECT  111   43                                                      
CONECT  112   45                                                      
CONECT  113   45                                                      
CONECT  114   49                                                      
CONECT  115   49                                                      
CONECT  116   50                                                      
CONECT  117   50                                                      
CONECT  118   51                                                      
CONECT  119   51                                                      
CONECT  120   52                                                      
CONECT  121   52                                                      
CONECT  122   53                                                      
CONECT  123   53                                                      
CONECT  124   54                                                      
CONECT  125   54                                                      
CONECT  126   55                                                      
CONECT  127   55                                                      
CONECT  128   56                                                      
CONECT  129   56                                                      
CONECT  130   57                                                      
CONECT  131   57                                                      
CONECT  132   58                                                      
CONECT  133   58                                                      
CONECT  134   59                                                      
CONECT  135   59                                                      
CONECT  136   60                                                      
CONECT  137   60                                                      
CONECT  138   61                                                      
CONECT  139   61                                                      
CONECT  140   62                                                      
CONECT  141   62                                                      
CONECT  142   63                                                      
CONECT  143   63                                                      
CONECT  144   63                                                      
MASTER        0    0    0    0    0    0    0    0  144    0  144    0
END
