COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.952  -0.313   0.701  1.00  0.00           C  
HETATM    2  C   UNL     1       5.144  -0.861  -1.487  1.00  0.00           C  
HETATM    3  C   UNL     1       6.313  -1.630   0.902  1.00  0.00           C  
HETATM    4  C   UNL     1       5.503  -2.181  -1.293  1.00  0.00           C  
HETATM    5  C   UNL     1       5.368   0.072  -0.492  1.00  0.00           C  
HETATM    6  C   UNL     1       6.089  -2.570  -0.096  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.451  -0.238   0.199  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.416  -1.664  -0.965  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.675  -4.807   1.131  1.00  0.00           C  
HETATM   10  C   UNL     1       6.348  -4.457   1.329  1.00  0.00           C  
HETATM   11  C   UNL     1       2.552   1.082  -1.183  1.00  0.00           C  
HETATM   12  C   UNL     1       5.278   2.671  -2.792  1.00  0.00           C  
HETATM   13  C   UNL     1       6.034   2.240  -1.555  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.254   2.210  -0.385  1.00  0.00           C  
HETATM   15  C   UNL     1       0.051   3.047   3.499  1.00  0.00           C  
HETATM   16  C   UNL     1       4.032   2.277  -2.692  1.00  0.00           C  
HETATM   17  C   UNL     1       4.974   1.510  -0.707  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.159   1.065   0.002  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.195  -1.496   0.587  1.00  0.00           C  
HETATM   20  C   UNL     1       0.138  -0.798  -2.070  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.909   1.471  -2.178  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.189  -2.573   0.984  1.00  0.00           C  
HETATM   23  C   UNL     1       0.850   3.830   2.453  1.00  0.00           C  
HETATM   24  C   UNL     1       0.239   0.646  -1.585  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.896   1.805  -1.067  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.043   4.094   1.237  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.470   1.753   2.869  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.013  -3.219  -0.103  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.560   2.760   0.694  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.543  -3.319  -0.185  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.320   2.036  -1.571  1.00  0.00           C  
HETATM   32  C   UNL     1       6.839  -5.862   1.569  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.371   0.935  -0.919  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.081  -1.175   1.801  1.00  0.00           C  
HETATM   35  C   UNL     1       1.532  -1.305  -2.446  1.00  0.00           C  
HETATM   36  C   UNL     1      -0.322   2.773  -2.749  1.00  0.00           C  
HETATM   37  C   UNL     1      -1.321   0.994   3.890  1.00  0.00           C  
HETATM   38  C   UNL     1      -4.015  -2.843  -1.558  1.00  0.00           C  
HETATM   39  C   UNL     1      -3.753   0.942  -2.533  1.00  0.00           C  
HETATM   40  C   UNL     1       0.100  -4.554  -0.035  1.00  0.00           C  
HETATM   41  C   UNL     1       0.156   5.851   3.591  1.00  0.00           C  
HETATM   42  C   UNL     1       2.338   4.900   4.036  1.00  0.00           C  
HETATM   43  C   UNL     1      -4.603   3.603  -2.883  1.00  0.00           C  
HETATM   44  C   UNL     1      -1.416  -4.623  -0.237  1.00  0.00           C  
HETATM   45  N   UNL     1      -4.840  -3.639   1.764  1.00  0.00           N  
HETATM   46  N   UNL     1       3.753   1.590  -1.523  1.00  0.00           N  
HETATM   47  N   UNL     1       6.455  -3.906   0.104  1.00  0.00           N  
HETATM   48  N   UNL     1       1.291   5.108   3.027  1.00  0.00           N  
HETATM   49  O   UNL     1      -3.247  -0.309   0.087  1.00  0.00           O  
HETATM   50  O   UNL     1       0.122  -1.706   0.109  1.00  0.00           O  
HETATM   51  O   UNL     1      -5.152  -5.851   1.521  1.00  0.00           O  
HETATM   52  O   UNL     1       5.857  -3.824   2.239  1.00  0.00           O  
HETATM   53  O   UNL     1       2.416   0.502  -0.124  1.00  0.00           O  
HETATM   54  O   UNL     1      -1.526  -2.389  -1.189  1.00  0.00           O  
HETATM   55  O   UNL     1      -3.948  -4.712   0.016  1.00  0.00           O  
HETATM   56  O   UNL     1      -1.268   2.069   1.726  1.00  0.00           O  
HETATM   57  O   UNL     1       0.715   4.760   0.225  1.00  0.00           O  
HETATM   58  O   UNL     1       1.503   1.218  -2.016  1.00  0.00           O  
HETATM   59  O   UNL     1      -1.439   3.002  -0.407  1.00  0.00           O  
HETATM   60  O   UNL     1      -3.338   3.289  -2.297  1.00  0.00           O  
HETATM   61  H   UNL     1       6.121   0.417   1.479  1.00  0.00           H  
HETATM   62  H   UNL     1       4.688  -0.558  -2.418  1.00  0.00           H  
HETATM   63  H   UNL     1       6.769  -1.930   1.834  1.00  0.00           H  
HETATM   64  H   UNL     1       5.327  -2.909  -2.071  1.00  0.00           H  
HETATM   65  H   UNL     1       5.697   3.220  -3.622  1.00  0.00           H  
HETATM   66  H   UNL     1       6.845   1.561  -1.820  1.00  0.00           H  
HETATM   67  H   UNL     1       6.420   3.108  -1.021  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.872   3.115  -0.554  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.635   2.456   0.500  1.00  0.00           H  
HETATM   70  H   UNL     1       0.695   2.806   4.345  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.790   3.650   3.841  1.00  0.00           H  
HETATM   72  H   UNL     1       3.290   2.471  -3.453  1.00  0.00           H  
HETATM   73  H   UNL     1       4.836   2.015   0.249  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.585   1.338   1.004  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.838  -1.827  -0.217  1.00  0.00           H  
HETATM   76  H   UNL     1      -0.516  -0.859  -2.936  1.00  0.00           H  
HETATM   77  H   UNL     1      -1.358   0.914  -2.984  1.00  0.00           H  
HETATM   78  H   UNL     1      -3.409  -2.106   1.609  1.00  0.00           H  
HETATM   79  H   UNL     1       1.719   3.247   2.148  1.00  0.00           H  
HETATM   80  H   UNL     1       0.177   0.669  -0.499  1.00  0.00           H  
HETATM   81  H   UNL     1      -1.891   1.002  -0.328  1.00  0.00           H  
HETATM   82  H   UNL     1      -0.886   4.719   1.533  1.00  0.00           H  
HETATM   83  H   UNL     1       0.372   1.132   2.564  1.00  0.00           H  
HETATM   84  H   UNL     1      -1.724  -2.788   0.852  1.00  0.00           H  
HETATM   85  H   UNL     1       0.281   2.152   0.360  1.00  0.00           H  
HETATM   86  H   UNL     1       6.670  -6.134   2.611  1.00  0.00           H  
HETATM   87  H   UNL     1       6.297  -6.551   0.921  1.00  0.00           H  
HETATM   88  H   UNL     1       7.905  -5.917   1.347  1.00  0.00           H  
HETATM   89  H   UNL     1      -6.040   0.640  -1.915  1.00  0.00           H  
HETATM   90  H   UNL     1      -7.049   0.180  -0.523  1.00  0.00           H  
HETATM   91  H   UNL     1      -6.887   1.893  -0.977  1.00  0.00           H  
HETATM   92  H   UNL     1      -6.788  -0.389   1.537  1.00  0.00           H  
HETATM   93  H   UNL     1      -6.628  -2.070   2.099  1.00  0.00           H  
HETATM   94  H   UNL     1      -5.457  -0.839   2.629  1.00  0.00           H  
HETATM   95  H   UNL     1       1.463  -2.338  -2.786  1.00  0.00           H  
HETATM   96  H   UNL     1       1.941  -0.685  -3.244  1.00  0.00           H  
HETATM   97  H   UNL     1       2.184  -1.252  -1.574  1.00  0.00           H  
HETATM   98  H   UNL     1       0.407   2.534  -3.523  1.00  0.00           H  
HETATM   99  H   UNL     1      -1.123   3.376  -3.177  1.00  0.00           H  
HETATM  100  H   UNL     1       0.166   3.332  -1.950  1.00  0.00           H  
HETATM  101  H   UNL     1      -2.163   1.615   4.194  1.00  0.00           H  
HETATM  102  H   UNL     1      -1.692   0.073   3.441  1.00  0.00           H  
HETATM  103  H   UNL     1      -0.713   0.754   4.762  1.00  0.00           H  
HETATM  104  H   UNL     1      -3.776  -1.786  -1.678  1.00  0.00           H  
HETATM  105  H   UNL     1      -3.512  -3.420  -2.335  1.00  0.00           H  
HETATM  106  H   UNL     1      -5.092  -2.983  -1.641  1.00  0.00           H  
HETATM  107  H   UNL     1      -4.754   1.160  -2.904  1.00  0.00           H  
HETATM  108  H   UNL     1      -3.057   0.898  -3.371  1.00  0.00           H  
HETATM  109  H   UNL     1      -3.758  -0.016  -2.014  1.00  0.00           H  
HETATM  110  H   UNL     1       0.316  -4.160   0.958  1.00  0.00           H  
HETATM  111  H   UNL     1       0.525  -5.554  -0.130  1.00  0.00           H  
HETATM  112  H   UNL     1       0.537  -3.900  -0.789  1.00  0.00           H  
HETATM  113  H   UNL     1       0.511   6.793   4.009  1.00  0.00           H  
HETATM  114  H   UNL     1      -0.572   6.053   2.806  1.00  0.00           H  
HETATM  115  H   UNL     1      -0.312   5.258   4.377  1.00  0.00           H  
HETATM  116  H   UNL     1       1.949   4.271   4.838  1.00  0.00           H  
HETATM  117  H   UNL     1       3.195   4.411   3.574  1.00  0.00           H  
HETATM  118  H   UNL     1       2.645   5.862   4.445  1.00  0.00           H  
HETATM  119  H   UNL     1      -4.510   4.503  -3.490  1.00  0.00           H  
HETATM  120  H   UNL     1      -4.929   2.773  -3.510  1.00  0.00           H  
HETATM  121  H   UNL     1      -5.337   3.772  -2.094  1.00  0.00           H  
HETATM  122  H   UNL     1      -1.853  -5.278   0.517  1.00  0.00           H  
HETATM  123  H   UNL     1      -1.632  -5.017  -1.230  1.00  0.00           H  
HETATM  124  H   UNL     1      -5.294  -3.532   2.610  1.00  0.00           H  
HETATM  125  H   UNL     1       6.785  -4.435  -0.639  1.00  0.00           H  
HETATM  126  H   UNL     1       0.211   4.960  -0.576  1.00  0.00           H  
CONECT    1    3    3    5   61                                       
CONECT    2    5    5    4   62                                       
CONECT    3    1    1    6   63                                       
CONECT    4    6    6    2   64                                       
CONECT    5    1   17    2    2                                       
CONECT    6    3   47    4    4                                       
CONECT    7   18   49   49   19                                       
CONECT    8   20   54   50   50                                       
CONECT    9   45   55   51   51                                       
CONECT   10   47   32   52   52                                       
CONECT   11   53   53   46   58                                       
CONECT   12   13   16   16   65                                       
CONECT   13   17   12   66   67                                       
CONECT   14   18   31   68   69                                       
CONECT   15   27   23   70   71                                       
CONECT   16   12   12   46   72                                       
CONECT   17   13    5   46   73                                       
CONECT   18   33   14    7   74                                       
CONECT   19    7   34   22   75                                       
CONECT   20   24    8   35   76                                       
CONECT   21   25   36   24   77                                       
CONECT   22   19   45   30   78                                       
CONECT   23   15   48   26   79                                       
CONECT   24   21   58   20   80                                       
CONECT   25   59   31   21   81                                       
CONECT   26   23   29   57   82                                       
CONECT   27   37   15   56   83                                       
CONECT   28   30   54   44   84                                       
CONECT   29   56   26   59   85                                       
CONECT   30   22   38   55   28                                       
CONECT   31   39   14   25   60                                       
CONECT   32   10   86   87   88                                       
CONECT   33   18   89   90   91                                       
CONECT   34   19   92   93   94                                       
CONECT   35   20   95   96   97                                       
CONECT   36   21   98   99  100                                       
CONECT   37   27  101  102  103                                       
CONECT   38   30  104  105  106                                       
CONECT   39   31  107  108  109                                       
CONECT   40   44  110  111  112                                       
CONECT   41   48  113  114  115                                       
CONECT   42   48  116  117  118                                       
CONECT   43   60  119  120  121                                       
CONECT   44   28   40  122  123                                       
CONECT   45   22    9  124                                            
CONECT   46   17   11   16                                            
CONECT   47    6   10  125                                            
CONECT   48   41   42   23                                            
CONECT   49    7    7                                                 
CONECT   50    8    8                                                 
CONECT   51    9    9                                                 
CONECT   52   10   10                                                 
CONECT   53   11   11                                                 
CONECT   54    8   28                                                 
CONECT   55   30    9                                                 
CONECT   56   27   29                                                 
CONECT   57   26  126                                                 
CONECT   58   11   24                                                 
CONECT   59   29   25                                                 
CONECT   60   31   43                                                 
CONECT   61    1                                                      
CONECT   62    2                                                      
CONECT   63    3                                                      
CONECT   64    4                                                      
CONECT   65   12                                                      
CONECT   66   13                                                      
CONECT   67   13                                                      
CONECT   68   14                                                      
CONECT   69   14                                                      
CONECT   70   15                                                      
CONECT   71   15                                                      
CONECT   72   16                                                      
CONECT   73   17                                                      
CONECT   74   18                                                      
CONECT   75   19                                                      
CONECT   76   20                                                      
CONECT   77   21                                                      
CONECT   78   22                                                      
CONECT   79   23                                                      
CONECT   80   24                                                      
CONECT   81   25                                                      
CONECT   82   26                                                      
CONECT   83   27                                                      
CONECT   84   28                                                      
CONECT   85   29                                                      
CONECT   86   32                                                      
CONECT   87   32                                                      
CONECT   88   32                                                      
CONECT   89   33                                                      
CONECT   90   33                                                      
CONECT   91   33                                                      
CONECT   92   34                                                      
CONECT   93   34                                                      
CONECT   94   34                                                      
CONECT   95   35                                                      
CONECT   96   35                                                      
CONECT   97   35                                                      
CONECT   98   36                                                      
CONECT   99   36                                                      
CONECT  100   36                                                      
CONECT  101   37                                                      
CONECT  102   37                                                      
CONECT  103   37                                                      
CONECT  104   38                                                      
CONECT  105   38                                                      
CONECT  106   38                                                      
CONECT  107   39                                                      
CONECT  108   39                                                      
CONECT  109   39                                                      
CONECT  110   40                                                      
CONECT  111   40                                                      
CONECT  112   40                                                      
CONECT  113   41                                                      
CONECT  114   41                                                      
CONECT  115   41                                                      
CONECT  116   42                                                      
CONECT  117   42                                                      
CONECT  118   42                                                      
CONECT  119   43                                                      
CONECT  120   43                                                      
CONECT  121   43                                                      
CONECT  122   44                                                      
CONECT  123   44                                                      
CONECT  124   45                                                      
CONECT  125   47                                                      
CONECT  126   57                                                      
MASTER        0    0    0    0    0    0    0    0  126    0  126    0
END
