COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.351   0.355  -1.574  1.00  0.00           C  
HETATM    2  C   UNL     1       6.286   0.152  -0.528  1.00  0.00           C  
HETATM    3  O   UNL     1       6.318   0.792   0.502  1.00  0.00           O  
HETATM    4  C   UNL     1       8.345   1.413  -1.092  1.00  0.00           C  
HETATM    5  C   UNL     1       9.426   1.619  -2.155  1.00  0.00           C  
HETATM    6  C   UNL     1      10.420   2.678  -1.673  1.00  0.00           C  
HETATM    7  C   UNL     1      11.502   2.883  -2.736  1.00  0.00           C  
HETATM    8  N   UNL     1       5.297  -0.739  -0.736  1.00  0.00           N  
HETATM    9  C   UNL     1       4.261  -0.936   0.281  1.00  0.00           C  
HETATM   10  C   UNL     1       3.674  -2.316   0.140  1.00  0.00           C  
HETATM   11  O   UNL     1       4.080  -3.063  -0.726  1.00  0.00           O  
HETATM   12  C   UNL     1       3.159   0.109   0.096  1.00  0.00           C  
HETATM   13  C   UNL     1       3.728   1.504   0.362  1.00  0.00           C  
HETATM   14  C   UNL     1       2.643   2.533   0.179  1.00  0.00           C  
HETATM   15  O   UNL     1       1.524   2.185  -0.133  1.00  0.00           O  
HETATM   16  N   UNL     1       2.915   3.840   0.363  1.00  0.00           N  
HETATM   17  N   UNL     1       2.697  -2.722   0.975  1.00  0.00           N  
HETATM   18  C   UNL     1       2.127  -4.060   0.837  1.00  0.00           C  
HETATM   19  C   UNL     1       1.025  -4.052  -0.201  1.00  0.00           C  
HETATM   20  O   UNL     1       0.074  -4.794  -0.053  1.00  0.00           O  
HETATM   21  C   UNL     1       1.549  -4.531   2.169  1.00  0.00           C  
HETATM   22  O   UNL     1       0.479  -3.703   2.641  1.00  0.00           O  
HETATM   23  C   UNL     1       2.664  -4.676   3.201  1.00  0.00           C  
HETATM   24  N   UNL     1       1.134  -3.204  -1.255  1.00  0.00           N  
HETATM   25  C   UNL     1       0.106  -3.177  -2.233  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.555  -4.253  -2.648  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.093  -5.627  -2.236  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.225  -1.841  -2.764  1.00  0.00           C  
HETATM   29  O   UNL     1       0.507  -0.912  -2.468  1.00  0.00           O  
HETATM   30  N   UNL     1      -1.301  -1.597  -3.542  1.00  0.00           N  
HETATM   31  C   UNL     1      -1.715  -0.179  -3.584  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.228   0.160  -2.208  1.00  0.00           C  
HETATM   33  O   UNL     1      -1.597  -0.257  -1.261  1.00  0.00           O  
HETATM   34  C   UNL     1      -2.826   0.014  -4.607  1.00  0.00           C  
HETATM   35  C   UNL     1      -3.436   1.404  -4.412  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.134   1.472  -3.058  1.00  0.00           C  
HETATM   37  O   UNL     1      -5.388   0.790  -3.141  1.00  0.00           O  
HETATM   38  N   UNL     1      -3.331   0.877  -2.000  1.00  0.00           N  
HETATM   39  C   UNL     1      -3.784   1.063  -0.614  1.00  0.00           C  
HETATM   40  C   UNL     1      -2.658   1.553   0.245  1.00  0.00           C  
HETATM   41  O   UNL     1      -1.604   1.868  -0.291  1.00  0.00           O  
HETATM   42  C   UNL     1      -4.315  -0.278  -0.098  1.00  0.00           C  
HETATM   43  C   UNL     1      -5.540  -0.669  -0.884  1.00  0.00           C  
HETATM   44  C   UNL     1      -5.412  -1.424  -2.034  1.00  0.00           C  
HETATM   45  C   UNL     1      -6.793  -0.275  -0.451  1.00  0.00           C  
HETATM   46  C   UNL     1      -6.536  -1.782  -2.755  1.00  0.00           C  
HETATM   47  C   UNL     1      -7.917  -0.633  -1.172  1.00  0.00           C  
HETATM   48  C   UNL     1      -7.788  -1.385  -2.325  1.00  0.00           C  
HETATM   49  N   UNL     1      -2.754   1.711   1.591  1.00  0.00           N  
HETATM   50  C   UNL     1      -1.467   1.776   2.323  1.00  0.00           C  
HETATM   51  C   UNL     1      -1.310   0.550   3.181  1.00  0.00           C  
HETATM   52  O   UNL     1      -1.690   0.569   4.332  1.00  0.00           O  
HETATM   53  C   UNL     1      -1.448   3.023   3.207  1.00  0.00           C  
HETATM   54  C   UNL     1      -1.477   4.255   2.339  1.00  0.00           C  
HETATM   55  C   UNL     1      -2.688   4.814   1.974  1.00  0.00           C  
HETATM   56  C   UNL     1      -0.293   4.828   1.914  1.00  0.00           C  
HETATM   57  C   UNL     1      -2.717   5.943   1.179  1.00  0.00           C  
HETATM   58  C   UNL     1      -0.317   5.957   1.119  1.00  0.00           C  
HETATM   59  O   UNL     1      -1.556   7.627  -0.036  1.00  0.00           O  
HETATM   60  C   UNL     1      -1.530   6.516   0.747  1.00  0.00           C  
HETATM   61  C   UNL     1      -4.027   1.858   2.303  1.00  0.00           C  
HETATM   62  N   UNL     1      -0.734  -0.576   2.664  1.00  0.00           N  
HETATM   63  C   UNL     1      -0.577  -1.701   3.612  1.00  0.00           C  
HETATM   64  C   UNL     1       0.630  -2.519   3.217  1.00  0.00           C  
HETATM   65  O   UNL     1       1.712  -2.038   3.457  1.00  0.00           O  
HETATM   66  C   UNL     1      -1.818  -2.594   3.563  1.00  0.00           C  
HETATM   67  C   UNL     1      -1.649  -3.755   4.545  1.00  0.00           C  
HETATM   68  C   UNL     1      -3.052  -1.776   3.947  1.00  0.00           C  
HETATM   69  H   UNL     1       7.876  -0.585  -1.745  1.00  0.00           H  
HETATM   70  H   UNL     1       6.889   0.687  -2.504  1.00  0.00           H  
HETATM   71  H   UNL     1       7.820   2.353  -0.922  1.00  0.00           H  
HETATM   72  H   UNL     1       8.807   1.081  -0.163  1.00  0.00           H  
HETATM   73  H   UNL     1       9.951   0.679  -2.326  1.00  0.00           H  
HETATM   74  H   UNL     1       8.964   1.951  -3.085  1.00  0.00           H  
HETATM   75  H   UNL     1       9.896   3.618  -1.502  1.00  0.00           H  
HETATM   76  H   UNL     1      10.882   2.345  -0.743  1.00  0.00           H  
HETATM   77  H   UNL     1      12.026   1.943  -2.906  1.00  0.00           H  
HETATM   78  H   UNL     1      11.039   3.215  -3.665  1.00  0.00           H  
HETATM   79  H   UNL     1      12.210   3.637  -2.392  1.00  0.00           H  
HETATM   80  H   UNL     1       5.271  -1.251  -1.560  1.00  0.00           H  
HETATM   81  H   UNL     1       4.701  -0.828   1.273  1.00  0.00           H  
HETATM   82  H   UNL     1       2.780   0.060  -0.925  1.00  0.00           H  
HETATM   83  H   UNL     1       2.347  -0.092   0.794  1.00  0.00           H  
HETATM   84  H   UNL     1       4.107   1.553   1.383  1.00  0.00           H  
HETATM   85  H   UNL     1       4.541   1.704  -0.337  1.00  0.00           H  
HETATM   86  H   UNL     1       3.810   4.118   0.613  1.00  0.00           H  
HETATM   87  H   UNL     1       2.217   4.502   0.246  1.00  0.00           H  
HETATM   88  H   UNL     1       2.372  -2.125   1.667  1.00  0.00           H  
HETATM   89  H   UNL     1       2.907  -4.754   0.520  1.00  0.00           H  
HETATM   90  H   UNL     1       1.135  -5.546   1.997  1.00  0.00           H  
HETATM   91  H   UNL     1       3.155  -3.714   3.343  1.00  0.00           H  
HETATM   92  H   UNL     1       2.242  -5.013   4.148  1.00  0.00           H  
HETATM   93  H   UNL     1       3.393  -5.407   2.848  1.00  0.00           H  
HETATM   94  H   UNL     1       1.913  -2.615  -1.356  1.00  0.00           H  
HETATM   95  H   UNL     1      -1.424  -4.143  -3.280  1.00  0.00           H  
HETATM   96  H   UNL     1      -0.655  -5.952  -1.360  1.00  0.00           H  
HETATM   97  H   UNL     1      -0.259  -6.327  -3.055  1.00  0.00           H  
HETATM   98  H   UNL     1       0.969  -5.596  -1.994  1.00  0.00           H  
HETATM   99  H   UNL     1      -1.768  -2.285  -4.038  1.00  0.00           H  
HETATM  100  H   UNL     1      -0.863   0.437  -3.823  1.00  0.00           H  
HETATM  101  H   UNL     1      -2.414  -0.065  -5.613  1.00  0.00           H  
HETATM  102  H   UNL     1      -3.592  -0.746  -4.464  1.00  0.00           H  
HETATM  103  H   UNL     1      -2.648   2.158  -4.458  1.00  0.00           H  
HETATM  104  H   UNL     1      -4.161   1.594  -5.206  1.00  0.00           H  
HETATM  105  H   UNL     1      -4.322   2.521  -2.809  1.00  0.00           H  
HETATM  106  H   UNL     1      -5.994   1.160  -3.797  1.00  0.00           H  
HETATM  107  H   UNL     1      -4.594   1.793  -0.610  1.00  0.00           H  
HETATM  108  H   UNL     1      -3.548  -1.043  -0.218  1.00  0.00           H  
HETATM  109  H   UNL     1      -4.574  -0.185   0.956  1.00  0.00           H  
HETATM  110  H   UNL     1      -4.434  -1.735  -2.370  1.00  0.00           H  
HETATM  111  H   UNL     1      -6.893   0.311   0.450  1.00  0.00           H  
HETATM  112  H   UNL     1      -6.436  -2.372  -3.654  1.00  0.00           H  
HETATM  113  H   UNL     1      -8.896  -0.326  -0.834  1.00  0.00           H  
HETATM  114  H   UNL     1      -8.667  -1.664  -2.888  1.00  0.00           H  
HETATM  115  H   UNL     1      -0.643   1.824   1.609  1.00  0.00           H  
HETATM  116  H   UNL     1      -4.849   1.819   1.589  1.00  0.00           H  
HETATM  117  H   UNL     1      -4.134   1.049   3.026  1.00  0.00           H  
HETATM  118  H   UNL     1      -4.043   2.815   2.824  1.00  0.00           H  
HETATM  119  H   UNL     1      -2.321   3.019   3.860  1.00  0.00           H  
HETATM  120  H   UNL     1      -0.542   3.026   3.812  1.00  0.00           H  
HETATM  121  H   UNL     1      -3.612   4.367   2.311  1.00  0.00           H  
HETATM  122  H   UNL     1       0.652   4.392   2.204  1.00  0.00           H  
HETATM  123  H   UNL     1      -3.664   6.379   0.894  1.00  0.00           H  
HETATM  124  H   UNL     1       0.609   6.405   0.788  1.00  0.00           H  
HETATM  125  H   UNL     1      -1.547   8.458   0.460  1.00  0.00           H  
HETATM  126  H   UNL     1      -0.443  -0.634   1.735  1.00  0.00           H  
HETATM  127  H   UNL     1      -0.433  -1.320   4.619  1.00  0.00           H  
HETATM  128  H   UNL     1      -1.942  -2.987   2.554  1.00  0.00           H  
HETATM  129  H   UNL     1      -1.525  -3.362   5.554  1.00  0.00           H  
HETATM  130  H   UNL     1      -2.533  -4.392   4.510  1.00  0.00           H  
HETATM  131  H   UNL     1      -0.770  -4.338   4.272  1.00  0.00           H  
HETATM  132  H   UNL     1      -3.172  -0.949   3.247  1.00  0.00           H  
HETATM  133  H   UNL     1      -3.936  -2.413   3.912  1.00  0.00           H  
HETATM  134  H   UNL     1      -2.927  -1.382   4.956  1.00  0.00           H  
CONECT    1    2    4   69   70                                       
CONECT    2    1    3    3    8                                       
CONECT    3    2    2                                                 
CONECT    4    1    5   71   72                                       
CONECT    5    4    6   73   74                                       
CONECT    6    5    7   75   76                                       
CONECT    7    6   77   78   79                                       
CONECT    8    9   80    2                                            
CONECT    9    8   10   12   81                                       
CONECT   10    9   11   11   17                                       
CONECT   11   10   10                                                 
CONECT   12    9   13   82   83                                       
CONECT   13   12   14   84   85                                       
CONECT   14   13   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   86   87                                            
CONECT   17   18   88   10                                            
CONECT   18   17   19   21   89                                       
CONECT   19   18   20   20   24                                       
CONECT   20   19   19                                                 
CONECT   21   18   22   23   90                                       
CONECT   22   21   64                                                 
CONECT   23   21   91   92   93                                       
CONECT   24   25   94   19                                            
CONECT   25   24   26   26   28                                       
CONECT   26   25   25   27   95                                       
CONECT   27   26   96   97   98                                       
CONECT   28   25   29   29   30                                       
CONECT   29   28   28                                                 
CONECT   30   31   99   28                                            
CONECT   31   30   32   34  100                                       
CONECT   32   31   33   33   38                                       
CONECT   33   32   32                                                 
CONECT   34   31   35  101  102                                       
CONECT   35   34   36  103  104                                       
CONECT   36   35   37  105   38                                       
CONECT   37   36  106                                                 
CONECT   38   39   32   36                                            
CONECT   39   38   40   42  107                                       
CONECT   40   39   41   41   49                                       
CONECT   41   40   40                                                 
CONECT   42   39   43  108  109                                       
CONECT   43   42   44   44   45                                       
CONECT   44   43   43   46  110                                       
CONECT   45   43   47   47  111                                       
CONECT   46   44   48   48  112                                       
CONECT   47   45   45   48  113                                       
CONECT   48   46   46   47  114                                       
CONECT   49   50   61   40                                            
CONECT   50   49   51   53  115                                       
CONECT   51   50   52   52   62                                       
CONECT   52   51   51                                                 
CONECT   53   50   54  119  120                                       
CONECT   54   53   55   56   56                                       
CONECT   55   54   57   57  121                                       
CONECT   56   54   54   58  122                                       
CONECT   57   55   55   60  123                                       
CONECT   58   56   60   60  124                                       
CONECT   59   60  125                                                 
CONECT   60   57   58   58   59                                       
CONECT   61   49  116  117  118                                       
CONECT   62   63  126   51                                            
CONECT   63   62   64   66  127                                       
CONECT   64   63   65   65   22                                       
CONECT   65   64   64                                                 
CONECT   66   63   67   68  128                                       
CONECT   67   66  129  130  131                                       
CONECT   68   66  132  133  134                                       
CONECT   69    1                                                      
CONECT   70    1                                                      
CONECT   71    4                                                      
CONECT   72    4                                                      
CONECT   73    5                                                      
CONECT   74    5                                                      
CONECT   75    6                                                      
CONECT   76    6                                                      
CONECT   77    7                                                      
CONECT   78    7                                                      
CONECT   79    7                                                      
CONECT   80    8                                                      
CONECT   81    9                                                      
CONECT   82   12                                                      
CONECT   83   12                                                      
CONECT   84   13                                                      
CONECT   85   13                                                      
CONECT   86   16                                                      
CONECT   87   16                                                      
CONECT   88   17                                                      
CONECT   89   18                                                      
CONECT   90   21                                                      
CONECT   91   23                                                      
CONECT   92   23                                                      
CONECT   93   23                                                      
CONECT   94   24                                                      
CONECT   95   26                                                      
CONECT   96   27                                                      
CONECT   97   27                                                      
CONECT   98   27                                                      
CONECT   99   30                                                      
CONECT  100   31                                                      
CONECT  101   34                                                      
CONECT  102   34                                                      
CONECT  103   35                                                      
CONECT  104   35                                                      
CONECT  105   36                                                      
CONECT  106   37                                                      
CONECT  107   39                                                      
CONECT  108   42                                                      
CONECT  109   42                                                      
CONECT  110   44                                                      
CONECT  111   45                                                      
CONECT  112   46                                                      
CONECT  113   47                                                      
CONECT  114   48                                                      
CONECT  115   50                                                      
CONECT  116   61                                                      
CONECT  117   61                                                      
CONECT  118   61                                                      
CONECT  119   53                                                      
CONECT  120   53                                                      
CONECT  121   55                                                      
CONECT  122   56                                                      
CONECT  123   57                                                      
CONECT  124   58                                                      
CONECT  125   59                                                      
CONECT  126   62                                                      
CONECT  127   63                                                      
CONECT  128   66                                                      
CONECT  129   67                                                      
CONECT  130   67                                                      
CONECT  131   67                                                      
CONECT  132   68                                                      
CONECT  133   68                                                      
CONECT  134   68                                                      
MASTER        0    0    0    0    0    0    0    0  134    0  134    0
END
