COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.808   0.861  -2.882  1.00  0.00           C  
HETATM    2  C   UNL     1       0.873   1.094  -4.040  1.00  0.00           C  
HETATM    3  O   UNL     1       0.609   2.220  -4.387  1.00  0.00           O  
HETATM    4  C   UNL     1       1.142   4.450   0.951  1.00  0.00           C  
HETATM    5  C   UNL     1       0.608   4.103  -0.416  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.228   2.825  -0.327  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.141   2.066  -1.653  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.167   0.561  -1.381  1.00  0.00           C  
HETATM    9  C   UNL     1       1.140  -0.068  -1.866  1.00  0.00           C  
HETATM   10  C   UNL     1       2.077  -0.280  -0.675  1.00  0.00           C  
HETATM   11  C   UNL     1       2.891  -1.558  -0.887  1.00  0.00           C  
HETATM   12  C   UNL     1       4.285  -1.380  -0.280  1.00  0.00           C  
HETATM   13  C   UNL     1       4.540   0.086  -0.036  1.00  0.00           C  
HETATM   14  C   UNL     1       4.176   0.641   1.115  1.00  0.00           C  
HETATM   15  C   UNL     1       4.421   2.073   1.350  1.00  0.00           C  
HETATM   16  C   UNL     1       4.021   2.638   2.483  1.00  0.00           C  
HETATM   17  C   UNL     1       4.270   4.106   2.721  1.00  0.00           C  
HETATM   18  C   UNL     1       2.981   4.888   2.463  1.00  0.00           C  
HETATM   19  C   UNL     1       3.273   6.389   2.529  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.944   3.689  -3.062  1.00  0.00           C  
HETATM   21  C   UNL     1       3.020  -1.839  -2.385  1.00  0.00           C  
HETATM   22  O   UNL     1       0.378   4.636   1.868  1.00  0.00           O  
HETATM   23  O   UNL     1      -1.591   3.165  -0.062  1.00  0.00           O  
HETATM   24  O   UNL     1       2.466   4.552   1.148  1.00  0.00           O  
HETATM   25  O   UNL     1      -1.251   2.421  -2.479  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.387   0.011  -1.190  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.634  -0.491  -1.922  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.835  -0.411  -0.974  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.491  -1.162   0.317  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.179  -0.611   0.880  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.845  -1.333   2.187  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.464  -0.102  -2.650  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.530  -2.236  -2.294  1.00  0.00           C  
HETATM   34  O   UNL     1      -1.267  -0.029  -2.077  1.00  0.00           O  
HETATM   35  O   UNL     1      -3.875   0.325  -3.070  1.00  0.00           O  
HETATM   36  N   UNL     1      -6.008  -1.030  -1.606  1.00  0.00           N  
HETATM   37  O   UNL     1      -5.537  -0.978   1.273  1.00  0.00           O  
HETATM   38  O   UNL     1      -2.126  -0.818  -0.059  1.00  0.00           O  
HETATM   39  C   UNL     1      -5.968  -2.281   1.670  1.00  0.00           C  
HETATM   40  C   UNL     1      -6.736  -2.182   2.990  1.00  0.00           C  
HETATM   41  C   UNL     1      -7.938  -1.249   2.800  1.00  0.00           C  
HETATM   42  C   UNL     1      -8.758  -1.742   1.603  1.00  0.00           C  
HETATM   43  C   UNL     1      -7.837  -1.874   0.388  1.00  0.00           C  
HETATM   44  C   UNL     1      -8.653  -2.336  -0.821  1.00  0.00           C  
HETATM   45  C   UNL     1      -8.806  -1.267   4.060  1.00  0.00           C  
HETATM   46  O   UNL     1      -7.477   0.081   2.555  1.00  0.00           O  
HETATM   47  O   UNL     1      -9.798  -0.805   1.317  1.00  0.00           O  
HETATM   48  O   UNL     1      -6.814  -2.828   0.660  1.00  0.00           O  
HETATM   49  C   UNL     1       6.359  -2.355  -0.385  1.00  0.00           C  
HETATM   50  C   UNL     1       7.394  -3.033  -1.285  1.00  0.00           C  
HETATM   51  C   UNL     1       8.544  -3.557  -0.417  1.00  0.00           C  
HETATM   52  C   UNL     1       9.079  -2.403   0.438  1.00  0.00           C  
HETATM   53  C   UNL     1       7.916  -1.772   1.208  1.00  0.00           C  
HETATM   54  C   UNL     1       8.444  -0.639   2.089  1.00  0.00           C  
HETATM   55  C   UNL     1       9.470  -4.072   2.056  1.00  0.00           C  
HETATM   56  C   UNL     1      11.195  -3.431   0.584  1.00  0.00           C  
HETATM   57  O   UNL     1       5.268  -1.891  -1.182  1.00  0.00           O  
HETATM   58  N   UNL     1      10.078  -2.915   1.386  1.00  0.00           N  
HETATM   59  O   UNL     1       6.957  -1.250   0.290  1.00  0.00           O  
HETATM   60  H   UNL     1       2.040   1.813  -2.405  1.00  0.00           H  
HETATM   61  H   UNL     1       2.728   0.402  -3.244  1.00  0.00           H  
HETATM   62  H   UNL     1       0.438   0.253  -4.561  1.00  0.00           H  
HETATM   63  H   UNL     1       1.440   3.946  -1.102  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.014   4.920  -0.780  1.00  0.00           H  
HETATM   65  H   UNL     1       0.152   2.196   0.477  1.00  0.00           H  
HETATM   66  H   UNL     1       0.788   2.327  -2.160  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.279   0.386  -0.311  1.00  0.00           H  
HETATM   68  H   UNL     1       0.928  -1.028  -2.337  1.00  0.00           H  
HETATM   69  H   UNL     1       1.489  -0.371   0.238  1.00  0.00           H  
HETATM   70  H   UNL     1       2.753   0.571  -0.589  1.00  0.00           H  
HETATM   71  H   UNL     1       2.388  -2.394  -0.402  1.00  0.00           H  
HETATM   72  H   UNL     1       4.342  -1.921   0.665  1.00  0.00           H  
HETATM   73  H   UNL     1       5.017   0.685  -0.797  1.00  0.00           H  
HETATM   74  H   UNL     1       3.702   0.042   1.879  1.00  0.00           H  
HETATM   75  H   UNL     1       4.928   2.663   0.600  1.00  0.00           H  
HETATM   76  H   UNL     1       3.518   2.048   3.234  1.00  0.00           H  
HETATM   77  H   UNL     1       5.050   4.457   2.045  1.00  0.00           H  
HETATM   78  H   UNL     1       4.588   4.258   3.753  1.00  0.00           H  
HETATM   79  H   UNL     1       2.241   4.629   3.221  1.00  0.00           H  
HETATM   80  H   UNL     1       2.355   6.946   2.345  1.00  0.00           H  
HETATM   81  H   UNL     1       3.659   6.641   3.516  1.00  0.00           H  
HETATM   82  H   UNL     1       4.013   6.648   1.772  1.00  0.00           H  
HETATM   83  H   UNL     1       0.060   3.660  -3.487  1.00  0.00           H  
HETATM   84  H   UNL     1      -1.665   3.912  -3.849  1.00  0.00           H  
HETATM   85  H   UNL     1      -0.992   4.462  -2.295  1.00  0.00           H  
HETATM   86  H   UNL     1       3.660  -2.708  -2.538  1.00  0.00           H  
HETATM   87  H   UNL     1       2.033  -2.037  -2.804  1.00  0.00           H  
HETATM   88  H   UNL     1       3.458  -0.973  -2.881  1.00  0.00           H  
HETATM   89  H   UNL     1      -1.602   3.641   0.779  1.00  0.00           H  
HETATM   90  H   UNL     1      -2.550   1.036  -0.858  1.00  0.00           H  
HETATM   91  H   UNL     1      -3.484  -1.525  -2.234  1.00  0.00           H  
HETATM   92  H   UNL     1      -5.052   0.632  -0.744  1.00  0.00           H  
HETATM   93  H   UNL     1      -4.377  -2.225   0.101  1.00  0.00           H  
HETATM   94  H   UNL     1      -3.288   0.456   1.073  1.00  0.00           H  
HETATM   95  H   UNL     1      -1.857  -1.025   2.530  1.00  0.00           H  
HETATM   96  H   UNL     1      -3.588  -1.079   2.943  1.00  0.00           H  
HETATM   97  H   UNL     1      -2.851  -2.410   2.019  1.00  0.00           H  
HETATM   98  H   UNL     1      -7.436  -0.423  -3.023  1.00  0.00           H  
HETATM   99  H   UNL     1      -6.548   0.902  -2.233  1.00  0.00           H  
HETATM  100  H   UNL     1      -5.745  -0.095  -3.469  1.00  0.00           H  
HETATM  101  H   UNL     1      -4.952  -2.846  -1.599  1.00  0.00           H  
HETATM  102  H   UNL     1      -6.383  -2.810  -2.658  1.00  0.00           H  
HETATM  103  H   UNL     1      -4.900  -1.949  -3.136  1.00  0.00           H  
HETATM  104  H   UNL     1      -3.096   0.245  -3.638  1.00  0.00           H  
HETATM  105  H   UNL     1      -5.099  -2.925   1.804  1.00  0.00           H  
HETATM  106  H   UNL     1      -7.086  -3.172   3.283  1.00  0.00           H  
HETATM  107  H   UNL     1      -6.082  -1.781   3.764  1.00  0.00           H  
HETATM  108  H   UNL     1      -9.195  -2.713   1.836  1.00  0.00           H  
HETATM  109  H   UNL     1      -7.382  -0.907   0.171  1.00  0.00           H  
HETATM  110  H   UNL     1      -9.433  -1.604  -1.033  1.00  0.00           H  
HETATM  111  H   UNL     1      -7.997  -2.430  -1.687  1.00  0.00           H  
HETATM  112  H   UNL     1      -9.109  -3.301  -0.604  1.00  0.00           H  
HETATM  113  H   UNL     1      -8.216  -0.930   4.913  1.00  0.00           H  
HETATM  114  H   UNL     1      -9.659  -0.603   3.923  1.00  0.00           H  
HETATM  115  H   UNL     1      -9.161  -2.281   4.242  1.00  0.00           H  
HETATM  116  H   UNL     1      -6.958   0.344   3.327  1.00  0.00           H  
HETATM  117  H   UNL     1     -10.288  -1.153   0.560  1.00  0.00           H  
HETATM  118  H   UNL     1       5.992  -3.072   0.350  1.00  0.00           H  
HETATM  119  H   UNL     1       6.929  -3.865  -1.814  1.00  0.00           H  
HETATM  120  H   UNL     1       7.781  -2.312  -2.005  1.00  0.00           H  
HETATM  121  H   UNL     1       8.179  -4.354   0.232  1.00  0.00           H  
HETATM  122  H   UNL     1       9.340  -3.939  -1.056  1.00  0.00           H  
HETATM  123  H   UNL     1       9.538  -1.654  -0.207  1.00  0.00           H  
HETATM  124  H   UNL     1       7.444  -2.529   1.835  1.00  0.00           H  
HETATM  125  H   UNL     1       8.997   0.072   1.475  1.00  0.00           H  
HETATM  126  H   UNL     1       7.608  -0.131   2.569  1.00  0.00           H  
HETATM  127  H   UNL     1       9.105  -1.050   2.852  1.00  0.00           H  
HETATM  128  H   UNL     1      10.116  -4.402   2.869  1.00  0.00           H  
HETATM  129  H   UNL     1       8.497  -3.789   2.459  1.00  0.00           H  
HETATM  130  H   UNL     1       9.344  -4.883   1.339  1.00  0.00           H  
HETATM  131  H   UNL     1      11.643  -2.614   0.017  1.00  0.00           H  
HETATM  132  H   UNL     1      11.943  -3.870   1.243  1.00  0.00           H  
HETATM  133  H   UNL     1      10.827  -4.191  -0.105  1.00  0.00           H  
CONECT    1    2    9   60   61                                       
CONECT    2    1    3    3   62                                       
CONECT    3    2    2                                                 
CONECT    4    5   22   22   24                                       
CONECT    5    4    6   63   64                                       
CONECT    6    5    7   23   65                                       
CONECT    7    6    8   25   66                                       
CONECT    8    7    9   34   67                                       
CONECT    9    1    8   10   68                                       
CONECT   10    9   11   69   70                                       
CONECT   11   10   12   21   71                                       
CONECT   12   11   13   57   72                                       
CONECT   13   12   14   14   73                                       
CONECT   14   13   13   15   74                                       
CONECT   15   14   16   16   75                                       
CONECT   16   15   15   17   76                                       
CONECT   17   16   18   77   78                                       
CONECT   18   17   19   24   79                                       
CONECT   19   18   80   81   82                                       
CONECT   20   25   83   84   85                                       
CONECT   21   11   86   87   88                                       
CONECT   22    4    4                                                 
CONECT   23    6   89                                                 
CONECT   24    4   18                                                 
CONECT   25    7   20                                                 
CONECT   26   27   34   38   90                                       
CONECT   27   26   28   35   91                                       
CONECT   28   27   29   36   92                                       
CONECT   29   28   30   37   93                                       
CONECT   30   29   31   38   94                                       
CONECT   31   30   95   96   97                                       
CONECT   32   36   98   99  100                                       
CONECT   33   36  101  102  103                                       
CONECT   34    8   26                                                 
CONECT   35   27  104                                                 
CONECT   36   28   32   33                                            
CONECT   37   29   39                                                 
CONECT   38   26   30                                                 
CONECT   39   37   40   48  105                                       
CONECT   40   39   41  106  107                                       
CONECT   41   40   42   45   46                                       
CONECT   42   41   43   47  108                                       
CONECT   43   42   44   48  109                                       
CONECT   44   43  110  111  112                                       
CONECT   45   41  113  114  115                                       
CONECT   46   41  116                                                 
CONECT   47   42  117                                                 
CONECT   48   39   43                                                 
CONECT   49   50   57   59  118                                       
CONECT   50   49   51  119  120                                       
CONECT   51   50   52  121  122                                       
CONECT   52   51   53   58  123                                       
CONECT   53   52   54   59  124                                       
CONECT   54   53  125  126  127                                       
CONECT   55   58  128  129  130                                       
CONECT   56   58  131  132  133                                       
CONECT   57   12   49                                                 
CONECT   58   52   55   56                                            
CONECT   59   49   53                                                 
CONECT   60    1                                                      
CONECT   61    1                                                      
CONECT   62    2                                                      
CONECT   63    5                                                      
CONECT   64    5                                                      
CONECT   65    6                                                      
CONECT   66    7                                                      
CONECT   67    8                                                      
CONECT   68    9                                                      
CONECT   69   10                                                      
CONECT   70   10                                                      
CONECT   71   11                                                      
CONECT   72   12                                                      
CONECT   73   13                                                      
CONECT   74   14                                                      
CONECT   75   15                                                      
CONECT   76   16                                                      
CONECT   77   17                                                      
CONECT   78   17                                                      
CONECT   79   18                                                      
CONECT   80   19                                                      
CONECT   81   19                                                      
CONECT   82   19                                                      
CONECT   83   20                                                      
CONECT   84   20                                                      
CONECT   85   20                                                      
CONECT   86   21                                                      
CONECT   87   21                                                      
CONECT   88   21                                                      
CONECT   89   23                                                      
CONECT   90   26                                                      
CONECT   91   27                                                      
CONECT   92   28                                                      
CONECT   93   29                                                      
CONECT   94   30                                                      
CONECT   95   31                                                      
CONECT   96   31                                                      
CONECT   97   31                                                      
CONECT   98   32                                                      
CONECT   99   32                                                      
CONECT  100   32                                                      
CONECT  101   33                                                      
CONECT  102   33                                                      
CONECT  103   33                                                      
CONECT  104   35                                                      
CONECT  105   39                                                      
CONECT  106   40                                                      
CONECT  107   40                                                      
CONECT  108   42                                                      
CONECT  109   43                                                      
CONECT  110   44                                                      
CONECT  111   44                                                      
CONECT  112   44                                                      
CONECT  113   45                                                      
CONECT  114   45                                                      
CONECT  115   45                                                      
CONECT  116   46                                                      
CONECT  117   47                                                      
CONECT  118   49                                                      
CONECT  119   50                                                      
CONECT  120   50                                                      
CONECT  121   51                                                      
CONECT  122   51                                                      
CONECT  123   52                                                      
CONECT  124   53                                                      
CONECT  125   54                                                      
CONECT  126   54                                                      
CONECT  127   54                                                      
CONECT  128   55                                                      
CONECT  129   55                                                      
CONECT  130   55                                                      
CONECT  131   56                                                      
CONECT  132   56                                                      
CONECT  133   56                                                      
MASTER        0    0    0    0    0    0    0    0  133    0  133    0
END
