COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.651   4.439   3.474  1.00  0.00           C  
HETATM    2  O   UNL     1      -3.924   3.701   0.711  1.00  0.00           O  
HETATM    3  C   UNL     1      -1.439   4.096   2.209  1.00  0.00           C  
HETATM    4  O   UNL     1       1.819   0.401  -1.290  1.00  0.00           O  
HETATM    5  C   UNL     1      -2.473   5.190   1.939  1.00  0.00           C  
HETATM    6  O   UNL     1       4.440   2.033   1.586  1.00  0.00           O  
HETATM    7  C   UNL     1      -3.506   5.205   3.068  1.00  0.00           C  
HETATM    8  O   UNL     1       5.888  -0.124   0.389  1.00  0.00           O  
HETATM    9  C   UNL     1      -3.175   4.912   0.609  1.00  0.00           C  
HETATM   10  O   UNL     1       8.653  -2.644   2.339  1.00  0.00           O  
HETATM   11  C   UNL     1      -4.613   3.331  -0.484  1.00  0.00           C  
HETATM   12  O   UNL     1       9.708  -2.266  -0.292  1.00  0.00           O  
HETATM   13  C   UNL     1      -5.608   4.427  -0.862  1.00  0.00           C  
HETATM   14  O   UNL     1       7.980   0.908   0.315  1.00  0.00           O  
HETATM   15  C   UNL     1      -4.872   5.761  -1.013  1.00  0.00           C  
HETATM   16  O   UNL     1       3.784   1.031  -2.380  1.00  0.00           O  
HETATM   17  C   UNL     1      -4.113   6.075   0.275  1.00  0.00           C  
HETATM   18  O   UNL     1      -3.999  -6.033  -0.121  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.294   7.354   0.086  1.00  0.00           C  
HETATM   20  O   UNL     1      -6.296  -4.982  -1.000  1.00  0.00           O  
HETATM   21  C   UNL     1      -5.383   2.029  -0.249  1.00  0.00           C  
HETATM   22  O   UNL     1      -3.383  -1.341   0.973  1.00  0.00           O  
HETATM   23  C   UNL     1      -4.407   0.880   0.018  1.00  0.00           C  
HETATM   24  O   UNL     1      -5.153  -0.365   0.098  1.00  0.00           O  
HETATM   25  C   UNL     1      -3.407   0.781  -1.130  1.00  0.00           C  
HETATM   26  O   UNL     1      -3.769  -3.570   2.245  1.00  0.00           O  
HETATM   27  C   UNL     1      -2.702   2.125  -1.320  1.00  0.00           C  
HETATM   28  O   UNL     1      -3.677   3.147  -1.544  1.00  0.00           O  
HETATM   29  C   UNL     1      -1.788   2.048  -2.544  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.467   1.428  -2.181  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.090   0.305  -2.741  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.996  -0.387  -3.728  1.00  0.00           C  
HETATM   33  C   UNL     1       1.246  -0.303  -2.394  1.00  0.00           C  
HETATM   34  C   UNL     1       2.640   1.508  -1.668  1.00  0.00           C  
HETATM   35  C   UNL     1       3.097   2.257  -0.414  1.00  0.00           C  
HETATM   36  C   UNL     1       3.948   1.320   0.449  1.00  0.00           C  
HETATM   37  C   UNL     1       3.577   1.978   2.724  1.00  0.00           C  
HETATM   38  C   UNL     1       5.127   0.808  -0.384  1.00  0.00           C  
HETATM   39  C   UNL     1       6.920   0.477   1.172  1.00  0.00           C  
HETATM   40  C   UNL     1       7.461  -0.545   2.175  1.00  0.00           C  
HETATM   41  C   UNL     1       8.081  -1.719   1.412  1.00  0.00           C  
HETATM   42  C   UNL     1       7.750  -3.660   2.779  1.00  0.00           C  
HETATM   43  C   UNL     1       9.173  -1.188   0.478  1.00  0.00           C  
HETATM   44  C   UNL     1       8.566  -0.141  -0.460  1.00  0.00           C  
HETATM   45  C   UNL     1       9.663   0.439  -1.355  1.00  0.00           C  
HETATM   46  C   UNL     1       4.592   0.114  -1.639  1.00  0.00           C  
HETATM   47  C   UNL     1       5.765  -0.348  -2.506  1.00  0.00           C  
HETATM   48  C   UNL     1       1.042  -1.774  -2.015  1.00  0.00           C  
HETATM   49  C   UNL     1       2.290  -2.300  -1.304  1.00  0.00           C  
HETATM   50  C   UNL     1      -0.142  -1.869  -1.093  1.00  0.00           C  
HETATM   51  C   UNL     1      -0.856  -2.985  -0.973  1.00  0.00           C  
HETATM   52  C   UNL     1      -2.013  -2.941  -0.067  1.00  0.00           C  
HETATM   53  C   UNL     1      -2.895  -3.924   0.027  1.00  0.00           C  
HETATM   54  C   UNL     1      -2.926  -5.262  -0.657  1.00  0.00           C  
HETATM   55  C   UNL     1      -4.752  -5.273   0.825  1.00  0.00           C  
HETATM   56  C   UNL     1      -6.217  -5.221   0.407  1.00  0.00           C  
HETATM   57  C   UNL     1      -6.949  -4.123   1.138  1.00  0.00           C  
HETATM   58  C   UNL     1      -6.404  -2.915   1.118  1.00  0.00           C  
HETATM   59  C   UNL     1      -5.099  -2.820   0.359  1.00  0.00           C  
HETATM   60  C   UNL     1      -4.488  -1.456   0.497  1.00  0.00           C  
HETATM   61  C   UNL     1      -4.136  -3.879   0.902  1.00  0.00           C  
HETATM   62  C   UNL     1      -8.245  -4.388   1.860  1.00  0.00           C  
HETATM   63  H   UNL     1      -0.142   5.394   3.338  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.334   4.509   4.320  1.00  0.00           H  
HETATM   65  H   UNL     1       0.086   3.659   3.666  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.755   4.026   1.363  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.947   3.141   2.345  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.974   6.158   1.891  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.243   5.985   2.876  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.005   4.237   3.115  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.006   5.403   4.016  1.00  0.00           H  
HETATM   72  H   UNL     1      -2.430   4.812  -0.181  1.00  0.00           H  
HETATM   73  H   UNL     1      10.406  -2.001  -0.907  1.00  0.00           H  
HETATM   74  H   UNL     1      -6.091   4.170  -1.805  1.00  0.00           H  
HETATM   75  H   UNL     1      -6.364   4.516  -0.081  1.00  0.00           H  
HETATM   76  H   UNL     1      -4.168   5.695  -1.843  1.00  0.00           H  
HETATM   77  H   UNL     1      -5.594   6.554  -1.212  1.00  0.00           H  
HETATM   78  H   UNL     1      -4.823   6.215   1.091  1.00  0.00           H  
HETATM   79  H   UNL     1      -3.962   8.181  -0.152  1.00  0.00           H  
HETATM   80  H   UNL     1      -2.753   7.577   1.006  1.00  0.00           H  
HETATM   81  H   UNL     1      -2.584   7.213  -0.728  1.00  0.00           H  
HETATM   82  H   UNL     1      -7.200  -4.936  -1.341  1.00  0.00           H  
HETATM   83  H   UNL     1      -6.043   2.149   0.610  1.00  0.00           H  
HETATM   84  H   UNL     1      -5.980   1.798  -1.132  1.00  0.00           H  
HETATM   85  H   UNL     1      -3.886   1.051   0.956  1.00  0.00           H  
HETATM   86  H   UNL     1      -2.667   0.013  -0.902  1.00  0.00           H  
HETATM   87  H   UNL     1      -3.932   0.516  -2.048  1.00  0.00           H  
HETATM   88  H   UNL     1      -3.342  -2.708   2.347  1.00  0.00           H  
HETATM   89  H   UNL     1      -2.120   2.361  -0.433  1.00  0.00           H  
HETATM   90  H   UNL     1      -2.268   1.445  -3.315  1.00  0.00           H  
HETATM   91  H   UNL     1      -1.618   3.054  -2.930  1.00  0.00           H  
HETATM   92  H   UNL     1       0.178   1.904  -1.455  1.00  0.00           H  
HETATM   93  H   UNL     1      -1.143   0.254  -4.597  1.00  0.00           H  
HETATM   94  H   UNL     1      -0.541  -1.327  -4.042  1.00  0.00           H  
HETATM   95  H   UNL     1      -1.958  -0.588  -3.258  1.00  0.00           H  
HETATM   96  H   UNL     1       1.912  -0.235  -3.254  1.00  0.00           H  
HETATM   97  H   UNL     1       2.069   2.182  -2.307  1.00  0.00           H  
HETATM   98  H   UNL     1       3.689   3.124  -0.703  1.00  0.00           H  
HETATM   99  H   UNL     1       2.225   2.583   0.154  1.00  0.00           H  
HETATM  100  H   UNL     1       3.341   0.478   0.781  1.00  0.00           H  
HETATM  101  H   UNL     1       4.021   2.543   3.544  1.00  0.00           H  
HETATM  102  H   UNL     1       2.609   2.410   2.467  1.00  0.00           H  
HETATM  103  H   UNL     1       3.442   0.940   3.029  1.00  0.00           H  
HETATM  104  H   UNL     1       5.761   1.646  -0.671  1.00  0.00           H  
HETATM  105  H   UNL     1       6.516   1.335   1.709  1.00  0.00           H  
HETATM  106  H   UNL     1       8.221  -0.075   2.800  1.00  0.00           H  
HETATM  107  H   UNL     1       6.646  -0.907   2.801  1.00  0.00           H  
HETATM  108  H   UNL     1       7.310  -2.221   0.826  1.00  0.00           H  
HETATM  109  H   UNL     1       6.895  -3.197   3.272  1.00  0.00           H  
HETATM  110  H   UNL     1       7.406  -4.237   1.921  1.00  0.00           H  
HETATM  111  H   UNL     1       8.260  -4.321   3.480  1.00  0.00           H  
HETATM  112  H   UNL     1       9.967  -0.732   1.069  1.00  0.00           H  
HETATM  113  H   UNL     1       7.800  -0.607  -1.079  1.00  0.00           H  
HETATM  114  H   UNL     1      10.402   0.950  -0.739  1.00  0.00           H  
HETATM  115  H   UNL     1      10.145  -0.368  -1.907  1.00  0.00           H  
HETATM  116  H   UNL     1       9.222   1.146  -2.057  1.00  0.00           H  
HETATM  117  H   UNL     1       3.991  -0.748  -1.350  1.00  0.00           H  
HETATM  118  H   UNL     1       6.427   0.496  -2.701  1.00  0.00           H  
HETATM  119  H   UNL     1       6.316  -1.130  -1.984  1.00  0.00           H  
HETATM  120  H   UNL     1       5.386  -0.739  -3.451  1.00  0.00           H  
HETATM  121  H   UNL     1       0.857  -2.362  -2.914  1.00  0.00           H  
HETATM  122  H   UNL     1       2.468  -1.715  -0.402  1.00  0.00           H  
HETATM  123  H   UNL     1       2.142  -3.346  -1.036  1.00  0.00           H  
HETATM  124  H   UNL     1       3.150  -2.214  -1.969  1.00  0.00           H  
HETATM  125  H   UNL     1      -0.428  -1.003  -0.503  1.00  0.00           H  
HETATM  126  H   UNL     1      -0.598  -3.879  -1.499  1.00  0.00           H  
HETATM  127  H   UNL     1      -2.145  -2.059   0.563  1.00  0.00           H  
HETATM  128  H   UNL     1      -1.983  -5.781  -0.487  1.00  0.00           H  
HETATM  129  H   UNL     1      -3.076  -5.122  -1.727  1.00  0.00           H  
HETATM  130  H   UNL     1      -4.683  -5.750   1.805  1.00  0.00           H  
HETATM  131  H   UNL     1      -6.688  -6.178   0.634  1.00  0.00           H  
HETATM  132  H   UNL     1      -6.856  -2.065   1.606  1.00  0.00           H  
HETATM  133  H   UNL     1      -5.280  -3.033  -0.699  1.00  0.00           H  
HETATM  134  H   UNL     1      -8.035  -4.674   2.891  1.00  0.00           H  
HETATM  135  H   UNL     1      -8.857  -3.487   1.851  1.00  0.00           H  
HETATM  136  H   UNL     1      -8.781  -5.196   1.361  1.00  0.00           H  
CONECT    1    3   63   64   65                                       
CONECT    2   11    9                                                 
CONECT    3    1    5   66   67                                       
CONECT    4   33   34                                                 
CONECT    5    3    9    7   68                                       
CONECT    6   36   37                                                 
CONECT    7    5   69   70   71                                       
CONECT    8   38   39                                                 
CONECT    9    2    5   17   72                                       
CONECT   10   41   42                                                 
CONECT   11    2   28   13   21                                       
CONECT   12   43   73                                                 
CONECT   13   11   15   74   75                                       
CONECT   14   39   44                                                 
CONECT   15   13   17   76   77                                       
CONECT   16   34   46                                                 
CONECT   17    9   15   19   78                                       
CONECT   18   54   55                                                 
CONECT   19   17   79   80   81                                       
CONECT   20   56   82                                                 
CONECT   21   11   23   83   84                                       
CONECT   22   60   60                                                 
CONECT   23   21   25   24   85                                       
CONECT   24   23   60                                                 
CONECT   25   23   27   86   87                                       
CONECT   26   61   88                                                 
CONECT   27   25   29   28   89                                       
CONECT   28   11   27                                                 
CONECT   29   27   30   90   91                                       
CONECT   30   29   31   31   92                                       
CONECT   31   30   30   32   33                                       
CONECT   32   31   93   94   95                                       
CONECT   33    4   31   48   96                                       
CONECT   34    4   16   35   97                                       
CONECT   35   34   36   98   99                                       
CONECT   36    6   35   38  100                                       
CONECT   37    6  101  102  103                                       
CONECT   38    8   36   46  104                                       
CONECT   39    8   14   40  105                                       
CONECT   40   39   41  106  107                                       
CONECT   41   10   40   43  108                                       
CONECT   42   10  109  110  111                                       
CONECT   43   12   41   44  112                                       
CONECT   44   14   43   45  113                                       
CONECT   45   44  114  115  116                                       
CONECT   46   16   38   47  117                                       
CONECT   47   46  118  119  120                                       
CONECT   48   33   49   50  121                                       
CONECT   49   48  122  123  124                                       
CONECT   50   48   51   51  125                                       
CONECT   51   50   50   52  126                                       
CONECT   52   51   53   53  127                                       
CONECT   53   52   52   54   61                                       
CONECT   54   18   53  128  129                                       
CONECT   55   18   61   56  130                                       
CONECT   56   20   55   57  131                                       
CONECT   57   56   58   58   62                                       
CONECT   58   57   57   59  132                                       
CONECT   59   58   60   61  133                                       
CONECT   60   22   22   24   59                                       
CONECT   61   26   53   55   59                                       
CONECT   62   57  134  135  136                                       
CONECT   63    1                                                      
CONECT   64    1                                                      
CONECT   65    1                                                      
CONECT   66    3                                                      
CONECT   67    3                                                      
CONECT   68    5                                                      
CONECT   69    7                                                      
CONECT   70    7                                                      
CONECT   71    7                                                      
CONECT   72    9                                                      
CONECT   73   12                                                      
CONECT   74   13                                                      
CONECT   75   13                                                      
CONECT   76   15                                                      
CONECT   77   15                                                      
CONECT   78   17                                                      
CONECT   79   19                                                      
CONECT   80   19                                                      
CONECT   81   19                                                      
CONECT   82   20                                                      
CONECT   83   21                                                      
CONECT   84   21                                                      
CONECT   85   23                                                      
CONECT   86   25                                                      
CONECT   87   25                                                      
CONECT   88   26                                                      
CONECT   89   27                                                      
CONECT   90   29                                                      
CONECT   91   29                                                      
CONECT   92   30                                                      
CONECT   93   32                                                      
CONECT   94   32                                                      
CONECT   95   32                                                      
CONECT   96   33                                                      
CONECT   97   34                                                      
CONECT   98   35                                                      
CONECT   99   35                                                      
CONECT  100   36                                                      
CONECT  101   37                                                      
CONECT  102   37                                                      
CONECT  103   37                                                      
CONECT  104   38                                                      
CONECT  105   39                                                      
CONECT  106   40                                                      
CONECT  107   40                                                      
CONECT  108   41                                                      
CONECT  109   42                                                      
CONECT  110   42                                                      
CONECT  111   42                                                      
CONECT  112   43                                                      
CONECT  113   44                                                      
CONECT  114   45                                                      
CONECT  115   45                                                      
CONECT  116   45                                                      
CONECT  117   46                                                      
CONECT  118   47                                                      
CONECT  119   47                                                      
CONECT  120   47                                                      
CONECT  121   48                                                      
CONECT  122   49                                                      
CONECT  123   49                                                      
CONECT  124   49                                                      
CONECT  125   50                                                      
CONECT  126   51                                                      
CONECT  127   52                                                      
CONECT  128   54                                                      
CONECT  129   54                                                      
CONECT  130   55                                                      
CONECT  131   56                                                      
CONECT  132   58                                                      
CONECT  133   59                                                      
CONECT  134   62                                                      
CONECT  135   62                                                      
CONECT  136   62                                                      
MASTER        0    0    0    0    0    0    0    0  136    0  136    0
END
