COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.829   0.202   3.927  1.00  0.00           N1+
HETATM    2  P   UNL     1       0.236   4.225   2.444  1.00  0.00           P  
HETATM    3  C   UNL     1       1.414   5.119   0.218  1.00  0.00           C  
HETATM    4  C   UNL     1       1.554   4.749  -1.260  1.00  0.00           C  
HETATM    5  O   UNL     1       2.275   3.494  -1.378  1.00  0.00           O  
HETATM    6  C   UNL     1       0.164   4.599  -1.882  1.00  0.00           C  
HETATM    7  O   UNL     1      -0.608   3.639  -1.116  1.00  0.00           O  
HETATM    8  C   UNL     1      -0.965   2.629   4.219  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.733   1.307   4.270  1.00  0.00           C  
HETATM   10  C   UNL     1       0.350   0.244   4.801  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.528  -1.077   4.110  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.405   0.332   2.526  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.860   3.391  -1.533  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.295   3.958  -2.507  1.00  0.00           O  
HETATM   15  C   UNL     1      -2.722   2.405  -0.787  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.090   2.309  -1.465  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.965   1.309  -0.708  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.334   1.213  -1.386  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.209   0.212  -0.629  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.577   0.116  -1.307  1.00  0.00           C  
HETATM   21  C   UNL     1      -9.452  -0.885  -0.549  1.00  0.00           C  
HETATM   22  C   UNL     1     -10.821  -0.981  -1.227  1.00  0.00           C  
HETATM   23  O   UNL     1       1.540   4.305   3.268  1.00  0.00           O  
HETATM   24  C   UNL     1     -11.696  -1.982  -0.470  1.00  0.00           C  
HETATM   25  C   UNL     1     -13.064  -2.078  -1.148  1.00  0.00           C  
HETATM   26  C   UNL     1     -13.939  -3.078  -0.391  1.00  0.00           C  
HETATM   27  C   UNL     1     -15.308  -3.174  -1.069  1.00  0.00           C  
HETATM   28  C   UNL     1     -16.183  -4.175  -0.311  1.00  0.00           C  
HETATM   29  C   UNL     1     -17.551  -4.271  -0.989  1.00  0.00           C  
HETATM   30  C   UNL     1     -18.426  -5.272  -0.232  1.00  0.00           C  
HETATM   31  C   UNL     1     -19.795  -5.368  -0.910  1.00  0.00           C  
HETATM   32  C   UNL     1     -20.670  -6.369  -0.153  1.00  0.00           C  
HETATM   33  O   UNL     1      -0.622   5.481   2.715  1.00  0.00           O1-
HETATM   34  C   UNL     1       3.612   3.567  -1.480  1.00  0.00           C  
HETATM   35  O   UNL     1       4.161   4.643  -1.470  1.00  0.00           O  
HETATM   36  C   UNL     1       4.427   2.306  -1.606  1.00  0.00           C  
HETATM   37  C   UNL     1       5.911   2.666  -1.705  1.00  0.00           C  
HETATM   38  C   UNL     1       6.739   1.385  -1.833  1.00  0.00           C  
HETATM   39  C   UNL     1       8.223   1.745  -1.932  1.00  0.00           C  
HETATM   40  C   UNL     1       9.051   0.465  -2.060  1.00  0.00           C  
HETATM   41  C   UNL     1      10.534   0.825  -2.159  1.00  0.00           C  
HETATM   42  C   UNL     1      11.362  -0.455  -2.286  1.00  0.00           C  
HETATM   43  C   UNL     1      12.824  -0.101  -2.384  1.00  0.00           C  
HETATM   44  O   UNL     1       0.596   4.150   0.876  1.00  0.00           O  
HETATM   45  C   UNL     1      13.689  -0.659  -1.574  1.00  0.00           C  
HETATM   46  C   UNL     1      13.254  -1.779  -0.664  1.00  0.00           C  
HETATM   47  C   UNL     1      14.170  -2.987  -0.869  1.00  0.00           C  
HETATM   48  C   UNL     1      13.728  -4.124   0.056  1.00  0.00           C  
HETATM   49  C   UNL     1      14.644  -5.333  -0.150  1.00  0.00           C  
HETATM   50  C   UNL     1      14.203  -6.469   0.775  1.00  0.00           C  
HETATM   51  C   UNL     1      15.118  -7.678   0.570  1.00  0.00           C  
HETATM   52  C   UNL     1      14.677  -8.814   1.494  1.00  0.00           C  
HETATM   53  C   UNL     1      15.592 -10.023   1.289  1.00  0.00           C  
HETATM   54  O   UNL     1      -0.589   2.910   2.869  1.00  0.00           O  
HETATM   55  H   UNL     1       2.399   5.139   0.683  1.00  0.00           H  
HETATM   56  H   UNL     1       0.952   6.103   0.304  1.00  0.00           H  
HETATM   57  H   UNL     1       2.103   5.534  -1.781  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.343   5.564  -1.874  1.00  0.00           H  
HETATM   59  H   UNL     1       0.262   4.250  -2.910  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.599   3.433   4.594  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.070   2.554   4.837  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.557   1.338   3.556  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.128   1.156   5.274  1.00  0.00           H  
HETATM   64  H   UNL     1       0.036   0.147   5.840  1.00  0.00           H  
HETATM   65  H   UNL     1       1.021  -0.576   4.547  1.00  0.00           H  
HETATM   66  H   UNL     1       0.869   1.193   4.666  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.404  -1.109   3.461  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.858  -1.898   3.855  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.843  -1.174   5.149  1.00  0.00           H  
HETATM   70  H   UNL     1       0.272   1.181   2.429  1.00  0.00           H  
HETATM   71  H   UNL     1       0.106  -0.578   2.215  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.280   0.491   1.895  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.243   1.426  -0.794  1.00  0.00           H  
HETATM   74  H   UNL     1      -2.849   2.740   0.242  1.00  0.00           H  
HETATM   75  H   UNL     1      -4.569   3.289  -1.458  1.00  0.00           H  
HETATM   76  H   UNL     1      -3.963   1.974  -2.495  1.00  0.00           H  
HETATM   77  H   UNL     1      -4.487   0.329  -0.715  1.00  0.00           H  
HETATM   78  H   UNL     1      -5.093   1.643   0.321  1.00  0.00           H  
HETATM   79  H   UNL     1      -6.812   2.192  -1.379  1.00  0.00           H  
HETATM   80  H   UNL     1      -6.206   0.878  -2.415  1.00  0.00           H  
HETATM   81  H   UNL     1      -6.730  -0.767  -0.636  1.00  0.00           H  
HETATM   82  H   UNL     1      -7.336   0.547   0.401  1.00  0.00           H  
HETATM   83  H   UNL     1      -9.056   1.095  -1.300  1.00  0.00           H  
HETATM   84  H   UNL     1      -8.450  -0.219  -2.336  1.00  0.00           H  
HETATM   85  H   UNL     1      -8.974  -1.864  -0.556  1.00  0.00           H  
HETATM   86  H   UNL     1      -9.580  -0.550   0.480  1.00  0.00           H  
HETATM   87  H   UNL     1     -11.299  -0.002  -1.220  1.00  0.00           H  
HETATM   88  H   UNL     1     -10.693  -1.316  -2.257  1.00  0.00           H  
HETATM   89  H   UNL     1     -11.217  -2.961  -0.477  1.00  0.00           H  
HETATM   90  H   UNL     1     -11.823  -1.647   0.559  1.00  0.00           H  
HETATM   91  H   UNL     1     -13.543  -1.098  -1.141  1.00  0.00           H  
HETATM   92  H   UNL     1     -12.937  -2.412  -2.178  1.00  0.00           H  
HETATM   93  H   UNL     1     -13.461  -4.058  -0.398  1.00  0.00           H  
HETATM   94  H   UNL     1     -14.067  -2.743   0.639  1.00  0.00           H  
HETATM   95  H   UNL     1     -15.786  -2.195  -1.062  1.00  0.00           H  
HETATM   96  H   UNL     1     -15.180  -3.509  -2.098  1.00  0.00           H  
HETATM   97  H   UNL     1     -15.704  -5.154  -0.318  1.00  0.00           H  
HETATM   98  H   UNL     1     -16.310  -3.840   0.718  1.00  0.00           H  
HETATM   99  H   UNL     1     -18.030  -3.292  -0.982  1.00  0.00           H  
HETATM  100  H   UNL     1     -17.424  -4.606  -2.019  1.00  0.00           H  
HETATM  101  H   UNL     1     -17.948  -6.251  -0.239  1.00  0.00           H  
HETATM  102  H   UNL     1     -18.554  -4.937   0.797  1.00  0.00           H  
HETATM  103  H   UNL     1     -20.273  -4.389  -0.903  1.00  0.00           H  
HETATM  104  H   UNL     1     -19.667  -5.703  -1.939  1.00  0.00           H  
HETATM  105  H   UNL     1     -20.797  -6.034   0.877  1.00  0.00           H  
HETATM  106  H   UNL     1     -21.645  -6.437  -0.636  1.00  0.00           H  
HETATM  107  H   UNL     1     -20.191  -7.348  -0.160  1.00  0.00           H  
HETATM  108  H   UNL     1       4.263   1.678  -0.730  1.00  0.00           H  
HETATM  109  H   UNL     1       4.124   1.765  -2.502  1.00  0.00           H  
HETATM  110  H   UNL     1       6.075   3.293  -2.581  1.00  0.00           H  
HETATM  111  H   UNL     1       6.214   3.207  -0.808  1.00  0.00           H  
HETATM  112  H   UNL     1       6.575   0.758  -0.957  1.00  0.00           H  
HETATM  113  H   UNL     1       6.436   0.845  -2.729  1.00  0.00           H  
HETATM  114  H   UNL     1       8.387   2.373  -2.807  1.00  0.00           H  
HETATM  115  H   UNL     1       8.526   2.286  -1.035  1.00  0.00           H  
HETATM  116  H   UNL     1       8.887  -0.162  -1.184  1.00  0.00           H  
HETATM  117  H   UNL     1       8.747  -0.075  -2.956  1.00  0.00           H  
HETATM  118  H   UNL     1      10.698   1.453  -3.034  1.00  0.00           H  
HETATM  119  H   UNL     1      10.838   1.366  -1.262  1.00  0.00           H  
HETATM  120  H   UNL     1      11.198  -1.083  -1.411  1.00  0.00           H  
HETATM  121  H   UNL     1      11.059  -0.996  -3.183  1.00  0.00           H  
HETATM  122  H   UNL     1      13.158   0.614  -3.121  1.00  0.00           H  
HETATM  123  H   UNL     1      14.713  -0.318  -1.559  1.00  0.00           H  
HETATM  124  H   UNL     1      13.316  -1.448   0.373  1.00  0.00           H  
HETATM  125  H   UNL     1      12.226  -2.058  -0.896  1.00  0.00           H  
HETATM  126  H   UNL     1      14.108  -3.318  -1.906  1.00  0.00           H  
HETATM  127  H   UNL     1      15.197  -2.708  -0.637  1.00  0.00           H  
HETATM  128  H   UNL     1      13.790  -3.793   1.092  1.00  0.00           H  
HETATM  129  H   UNL     1      12.701  -4.403  -0.176  1.00  0.00           H  
HETATM  130  H   UNL     1      14.582  -5.663  -1.187  1.00  0.00           H  
HETATM  131  H   UNL     1      15.672  -5.054   0.082  1.00  0.00           H  
HETATM  132  H   UNL     1      14.264  -6.139   1.812  1.00  0.00           H  
HETATM  133  H   UNL     1      13.175  -6.748   0.543  1.00  0.00           H  
HETATM  134  H   UNL     1      15.056  -8.008  -0.467  1.00  0.00           H  
HETATM  135  H   UNL     1      16.146  -7.399   0.802  1.00  0.00           H  
HETATM  136  H   UNL     1      14.738  -8.484   2.531  1.00  0.00           H  
HETATM  137  H   UNL     1      13.649  -9.093   1.262  1.00  0.00           H  
HETATM  138  H   UNL     1      16.620  -9.744   1.521  1.00  0.00           H  
HETATM  139  H   UNL     1      15.278 -10.833   1.947  1.00  0.00           H  
HETATM  140  H   UNL     1      15.530 -10.354   0.252  1.00  0.00           H  
CONECT    1    9   10   11   12                                       
CONECT    2   23   23   33   44                                       
CONECT    2   54                                                      
CONECT    3    4   44   55   56                                       
CONECT    4    3    5    6   57                                       
CONECT    5    4   34                                                 
CONECT    6    4    7   58   59                                       
CONECT    7    6   13                                                 
CONECT    8    9   54   60   61                                       
CONECT    9    1    8   62   63                                       
CONECT   10    1   64   65   66                                       
CONECT   11    1   67   68   69                                       
CONECT   12    1   70   71   72                                       
CONECT   13    7   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   73   74                                       
CONECT   16   15   17   75   76                                       
CONECT   17   16   18   77   78                                       
CONECT   18   17   19   79   80                                       
CONECT   19   18   20   81   82                                       
CONECT   20   19   21   83   84                                       
CONECT   21   20   22   85   86                                       
CONECT   22   21   24   87   88                                       
CONECT   23    2    2                                                 
CONECT   24   22   25   89   90                                       
CONECT   25   24   26   91   92                                       
CONECT   26   25   27   93   94                                       
CONECT   27   26   28   95   96                                       
CONECT   28   27   29   97   98                                       
CONECT   29   28   30   99  100                                       
CONECT   30   29   31  101  102                                       
CONECT   31   30   32  103  104                                       
CONECT   32   31  105  106  107                                       
CONECT   33    2                                                      
CONECT   34    5   35   35   36                                       
CONECT   35   34   34                                                 
CONECT   36   34   37  108  109                                       
CONECT   37   36   38  110  111                                       
CONECT   38   37   39  112  113                                       
CONECT   39   38   40  114  115                                       
CONECT   40   39   41  116  117                                       
CONECT   41   40   42  118  119                                       
CONECT   42   41   43  120  121                                       
CONECT   43   42   45   45  122                                       
CONECT   44    2    3                                                 
CONECT   45   43   43   46  123                                       
CONECT   46   45   47  124  125                                       
CONECT   47   46   48  126  127                                       
CONECT   48   47   49  128  129                                       
CONECT   49   48   50  130  131                                       
CONECT   50   49   51  132  133                                       
CONECT   51   50   52  134  135                                       
CONECT   52   51   53  136  137                                       
CONECT   53   52  138  139  140                                       
CONECT   54    2    8                                                 
CONECT   55    3                                                      
CONECT   56    3                                                      
CONECT   57    4                                                      
CONECT   58    6                                                      
CONECT   59    6                                                      
CONECT   60    8                                                      
CONECT   61    8                                                      
CONECT   62    9                                                      
CONECT   63    9                                                      
CONECT   64   10                                                      
CONECT   65   10                                                      
CONECT   66   10                                                      
CONECT   67   11                                                      
CONECT   68   11                                                      
CONECT   69   11                                                      
CONECT   70   12                                                      
CONECT   71   12                                                      
CONECT   72   12                                                      
CONECT   73   15                                                      
CONECT   74   15                                                      
CONECT   75   16                                                      
CONECT   76   16                                                      
CONECT   77   17                                                      
CONECT   78   17                                                      
CONECT   79   18                                                      
CONECT   80   18                                                      
CONECT   81   19                                                      
CONECT   82   19                                                      
CONECT   83   20                                                      
CONECT   84   20                                                      
CONECT   85   21                                                      
CONECT   86   21                                                      
CONECT   87   22                                                      
CONECT   88   22                                                      
CONECT   89   24                                                      
CONECT   90   24                                                      
CONECT   91   25                                                      
CONECT   92   25                                                      
CONECT   93   26                                                      
CONECT   94   26                                                      
CONECT   95   27                                                      
CONECT   96   27                                                      
CONECT   97   28                                                      
CONECT   98   28                                                      
CONECT   99   29                                                      
CONECT  100   29                                                      
CONECT  101   30                                                      
CONECT  102   30                                                      
CONECT  103   31                                                      
CONECT  104   31                                                      
CONECT  105   32                                                      
CONECT  106   32                                                      
CONECT  107   32                                                      
CONECT  108   36                                                      
CONECT  109   36                                                      
CONECT  110   37                                                      
CONECT  111   37                                                      
CONECT  112   38                                                      
CONECT  113   38                                                      
CONECT  114   39                                                      
CONECT  115   39                                                      
CONECT  116   40                                                      
CONECT  117   40                                                      
CONECT  118   41                                                      
CONECT  119   41                                                      
CONECT  120   42                                                      
CONECT  121   42                                                      
CONECT  122   43                                                      
CONECT  123   45                                                      
CONECT  124   46                                                      
CONECT  125   46                                                      
CONECT  126   47                                                      
CONECT  127   47                                                      
CONECT  128   48                                                      
CONECT  129   48                                                      
CONECT  130   49                                                      
CONECT  131   49                                                      
CONECT  132   50                                                      
CONECT  133   50                                                      
CONECT  134   51                                                      
CONECT  135   51                                                      
CONECT  136   52                                                      
CONECT  137   52                                                      
CONECT  138   53                                                      
CONECT  139   53                                                      
CONECT  140   53                                                      
MASTER        0    0    0    0    0    0    0    0  140    0  140    0
END
