COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.483   4.116  -2.794  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.893   5.113   2.765  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.473   4.706   4.017  1.00  0.00           C  
HETATM    4  O   UNL     1       3.868  -0.194  -1.761  1.00  0.00           O  
HETATM    5  C   UNL     1       6.011   2.236  -1.875  1.00  0.00           C  
HETATM    6  C   UNL     1       5.136   2.145  -3.127  1.00  0.00           C  
HETATM    7  N   UNL     1       4.168   3.267  -3.108  1.00  0.00           N  
HETATM    8  C   UNL     1       1.866   4.041  -3.601  1.00  0.00           C  
HETATM    9  C   UNL     1       0.948   3.862  -2.391  1.00  0.00           C  
HETATM   10  N   UNL     1      -1.479   3.479  -2.156  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.174   2.500  -1.100  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.573   2.540  -0.397  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.887   3.743  -2.496  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.836   4.330   1.821  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.412   3.932   3.076  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.171  -1.150   1.815  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.420  -2.163   2.237  1.00  0.00           C  
HETATM   18  C   UNL     1       5.068  -0.051  -1.662  1.00  0.00           C  
HETATM   19  C   UNL     1       5.627   1.122  -0.899  1.00  0.00           C  
HETATM   20  C   UNL     1       2.925   2.969  -3.589  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.137   2.716   0.071  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.713   2.591  -1.911  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.941   4.130   0.625  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.074   4.925   1.667  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.233   4.115   4.173  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.817   1.715   1.156  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.231   0.295   2.313  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.539  -1.577   1.347  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.673  -2.556   1.814  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.052  -2.357   0.488  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.399  -2.777   0.027  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.291  -3.367   0.920  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.542  -3.756   0.486  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.911  -3.560  -0.833  1.00  0.00           C  
HETATM   35  C   UNL     1      -9.279  -3.986  -1.301  1.00  0.00           C  
HETATM   36  C   UNL     1     -10.263  -2.828  -1.121  1.00  0.00           C  
HETATM   37  C   UNL     1     -11.631  -3.254  -1.589  1.00  0.00           C  
HETATM   38  C   UNL     1      -7.029  -2.975  -1.724  1.00  0.00           C  
HETATM   39  C   UNL     1      -5.778  -2.578  -1.299  1.00  0.00           C  
HETATM   40  C   UNL     1      -3.162  -1.761  -0.404  1.00  0.00           C  
HETATM   41  C   UNL     1      -1.908  -1.381   0.028  1.00  0.00           C  
HETATM   42  C   UNL     1       1.112   0.700   2.865  1.00  0.00           C  
HETATM   43  C   UNL     1       6.623  -0.023   0.971  1.00  0.00           C  
HETATM   44  C   UNL     1       5.206  -0.331   1.380  1.00  0.00           C  
HETATM   45  C   UNL     1       5.215  -1.167   2.634  1.00  0.00           C  
HETATM   46  C   UNL     1       4.340  -0.882   3.666  1.00  0.00           C  
HETATM   47  C   UNL     1       3.374   0.267   3.544  1.00  0.00           C  
HETATM   48  C   UNL     1       4.354  -1.651   4.815  1.00  0.00           C  
HETATM   49  C   UNL     1       5.243  -2.704   4.933  1.00  0.00           C  
HETATM   50  C   UNL     1       6.118  -2.989   3.902  1.00  0.00           C  
HETATM   51  C   UNL     1       6.103  -2.220   2.752  1.00  0.00           C  
HETATM   52  C   UNL     1       5.361  -2.030  -3.053  1.00  0.00           C  
HETATM   53  C   UNL     1       6.498  -2.961  -3.478  1.00  0.00           C  
HETATM   54  C   UNL     1       8.195  -4.408  -2.599  1.00  0.00           C  
HETATM   55  C   UNL     1       8.625  -5.132  -1.322  1.00  0.00           C  
HETATM   56  N   UNL     1      -0.556   1.198   1.189  1.00  0.00           N  
HETATM   57  N   UNL     1       6.844   0.705  -0.163  1.00  0.00           N  
HETATM   58  N   UNL     1       2.060  -0.253   3.099  1.00  0.00           N  
HETATM   59  N   UNL     1       5.902  -0.942  -2.234  1.00  0.00           N  
HETATM   60  N   UNL     1       7.573  -6.072  -0.913  1.00  0.00           N  
HETATM   61  O   UNL     1     -12.660  -2.394  -1.524  1.00  0.00           O  
HETATM   62  O   UNL     1     -11.801  -4.369  -2.022  1.00  0.00           O  
HETATM   63  O   UNL     1       1.349   1.866   3.099  1.00  0.00           O  
HETATM   64  O   UNL     1      -2.652   1.383   1.970  1.00  0.00           O  
HETATM   65  O   UNL     1      -0.733   4.898  -3.688  1.00  0.00           O  
HETATM   66  O   UNL     1       2.676   1.856  -4.001  1.00  0.00           O  
HETATM   67  O   UNL     1       7.555  -0.416   1.640  1.00  0.00           O  
HETATM   68  O   UNL     1       7.050  -3.598  -2.324  1.00  0.00           O  
HETATM   69  H   UNL     1      -5.861   5.575   2.644  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.114   4.849   4.875  1.00  0.00           H  
HETATM   71  H   UNL     1       7.058   2.127  -2.156  1.00  0.00           H  
HETATM   72  H   UNL     1       5.862   3.204  -1.398  1.00  0.00           H  
HETATM   73  H   UNL     1       5.761   2.215  -4.016  1.00  0.00           H  
HETATM   74  H   UNL     1       4.597   1.197  -3.128  1.00  0.00           H  
HETATM   75  H   UNL     1       4.400   4.149  -2.778  1.00  0.00           H  
HETATM   76  H   UNL     1       1.280   3.963  -4.517  1.00  0.00           H  
HETATM   77  H   UNL     1       2.340   5.022  -3.555  1.00  0.00           H  
HETATM   78  H   UNL     1       1.235   4.565  -1.610  1.00  0.00           H  
HETATM   79  H   UNL     1       1.042   2.844  -2.013  1.00  0.00           H  
HETATM   80  H   UNL     1      -1.297   1.490  -1.492  1.00  0.00           H  
HETATM   81  H   UNL     1      -0.148   2.639  -0.760  1.00  0.00           H  
HETATM   82  H   UNL     1      -3.943   1.578  -0.042  1.00  0.00           H  
HETATM   83  H   UNL     1      -4.184   3.332   0.038  1.00  0.00           H  
HETATM   84  H   UNL     1      -3.204   4.689  -2.056  1.00  0.00           H  
HETATM   85  H   UNL     1      -3.009   3.775  -3.578  1.00  0.00           H  
HETATM   86  H   UNL     1      -1.445   3.467   3.197  1.00  0.00           H  
HETATM   87  H   UNL     1       0.535  -1.220   0.987  1.00  0.00           H  
HETATM   88  H   UNL     1       0.154  -1.801   2.626  1.00  0.00           H  
HETATM   89  H   UNL     1      -2.125  -2.318   3.265  1.00  0.00           H  
HETATM   90  H   UNL     1       4.881   1.492  -0.195  1.00  0.00           H  
HETATM   91  H   UNL     1      -3.366   1.649  -2.335  1.00  0.00           H  
HETATM   92  H   UNL     1      -4.762   2.735  -2.169  1.00  0.00           H  
HETATM   93  H   UNL     1      -2.194   4.860  -0.144  1.00  0.00           H  
HETATM   94  H   UNL     1      -0.901   4.263   0.924  1.00  0.00           H  
HETATM   95  H   UNL     1      -4.402   5.244   0.688  1.00  0.00           H  
HETATM   96  H   UNL     1      -2.902   3.805   5.153  1.00  0.00           H  
HETATM   97  H   UNL     1      -0.991   0.386   3.089  1.00  0.00           H  
HETATM   98  H   UNL     1      -4.359  -3.018   2.509  1.00  0.00           H  
HETATM   99  H   UNL     1      -6.004  -3.521   1.949  1.00  0.00           H  
HETATM  100  H   UNL     1      -8.234  -4.213   1.177  1.00  0.00           H  
HETATM  101  H   UNL     1      -9.233  -4.262  -2.354  1.00  0.00           H  
HETATM  102  H   UNL     1      -9.613  -4.842  -0.715  1.00  0.00           H  
HETATM  103  H   UNL     1     -10.309  -2.551  -0.067  1.00  0.00           H  
HETATM  104  H   UNL     1      -9.928  -1.972  -1.707  1.00  0.00           H  
HETATM  105  H   UNL     1      -7.322  -2.825  -2.752  1.00  0.00           H  
HETATM  106  H   UNL     1      -5.091  -2.117  -1.995  1.00  0.00           H  
HETATM  107  H   UNL     1      -3.451  -1.604  -1.432  1.00  0.00           H  
HETATM  108  H   UNL     1      -1.216  -0.923  -0.663  1.00  0.00           H  
HETATM  109  H   UNL     1       4.672   0.600   1.569  1.00  0.00           H  
HETATM  110  H   UNL     1       4.708  -0.880   0.581  1.00  0.00           H  
HETATM  111  H   UNL     1       3.264   0.755   4.513  1.00  0.00           H  
HETATM  112  H   UNL     1       3.750   0.984   2.814  1.00  0.00           H  
HETATM  113  H   UNL     1       3.671  -1.430   5.622  1.00  0.00           H  
HETATM  114  H   UNL     1       5.254  -3.303   5.831  1.00  0.00           H  
HETATM  115  H   UNL     1       6.812  -3.811   3.993  1.00  0.00           H  
HETATM  116  H   UNL     1       6.786  -2.442   1.946  1.00  0.00           H  
HETATM  117  H   UNL     1       4.881  -1.614  -3.938  1.00  0.00           H  
HETATM  118  H   UNL     1       4.629  -2.592  -2.473  1.00  0.00           H  
HETATM  119  H   UNL     1       6.112  -3.718  -4.161  1.00  0.00           H  
HETATM  120  H   UNL     1       7.274  -2.382  -3.980  1.00  0.00           H  
HETATM  121  H   UNL     1       9.011  -3.777  -2.951  1.00  0.00           H  
HETATM  122  H   UNL     1       7.945  -5.142  -3.366  1.00  0.00           H  
HETATM  123  H   UNL     1       9.549  -5.681  -1.509  1.00  0.00           H  
HETATM  124  H   UNL     1       8.790  -4.403  -0.529  1.00  0.00           H  
HETATM  125  H   UNL     1       0.099   1.413   0.506  1.00  0.00           H  
HETATM  126  H   UNL     1       7.736   0.933  -0.467  1.00  0.00           H  
HETATM  127  H   UNL     1       1.887  -1.200   2.982  1.00  0.00           H  
HETATM  128  H   UNL     1       6.859  -0.863  -2.103  1.00  0.00           H  
HETATM  129  H   UNL     1       7.356  -6.719  -1.656  1.00  0.00           H  
HETATM  130  H   UNL     1       7.833  -6.563  -0.071  1.00  0.00           H  
HETATM  131  H   UNL     1     -13.518  -2.713  -1.836  1.00  0.00           H  
CONECT    1    9   65   65   10                                       
CONECT    2   24   24    3   69                                       
CONECT    3   25   25    2   70                                       
CONECT    4   18   18                                                 
CONECT    5   19    6   71   72                                       
CONECT    6    5    7   73   74                                       
CONECT    7    6   20   75                                            
CONECT    8   20    9   76   77                                       
CONECT    9    8    1   78   79                                       
CONECT   10    1   13   11                                            
CONECT   11   10   21   80   81                                       
CONECT   12   22   21   82   83                                       
CONECT   13   10   22   84   85                                       
CONECT   14   23   15   15   24                                       
CONECT   15   14   14   25   86                                       
CONECT   16   27   28   87   88                                       
CONECT   17   28   29   29   89                                       
CONECT   18   59    4    4   19                                       
CONECT   19   18    5   57   90                                       
CONECT   20    7    8   66   66                                       
CONECT   21   11   26   12   23                                       
CONECT   22   13   12   91   92                                       
CONECT   23   21   14   93   94                                       
CONECT   24   14    2    2   95                                       
CONECT   25   15    3    3   96                                       
CONECT   26   64   64   21   56                                       
CONECT   27   42   56   16   97                                       
CONECT   28   16   41   41   17                                       
CONECT   29   17   17   30   98                                       
CONECT   30   40   40   29   31                                       
CONECT   31   30   39   39   32                                       
CONECT   32   31   33   33   99                                       
CONECT   33   32   32   34  100                                       
CONECT   34   38   38   33   35                                       
CONECT   35   34   36  101  102                                       
CONECT   36   35   37  103  104                                       
CONECT   37   36   62   62   61                                       
CONECT   38   39   34   34  105                                       
CONECT   39   31   31   38  106                                       
CONECT   40   41   30   30  107                                       
CONECT   41   28   28   40  108                                       
CONECT   42   58   63   63   27                                       
CONECT   43   57   67   67   44                                       
CONECT   44   43   45  109  110                                       
CONECT   45   44   51   51   46                                       
CONECT   46   45   47   48   48                                       
CONECT   47   46   58  111  112                                       
CONECT   48   46   46   49  113                                       
CONECT   49   50   50   48  114                                       
CONECT   50   51   49   49  115                                       
CONECT   51   45   45   50  116                                       
CONECT   52   53   59  117  118                                       
CONECT   53   68   52  119  120                                       
CONECT   54   55   68  121  122                                       
CONECT   55   54   60  123  124                                       
CONECT   56   26   27  125                                            
CONECT   57   19   43  126                                            
CONECT   58   47   42  127                                            
CONECT   59   52   18  128                                            
CONECT   60   55  129  130                                            
CONECT   61   37  131                                                 
CONECT   62   37   37                                                 
CONECT   63   42   42                                                 
CONECT   64   26   26                                                 
CONECT   65    1    1                                                 
CONECT   66   20   20                                                 
CONECT   67   43   43                                                 
CONECT   68   54   53                                                 
CONECT   69    2                                                      
CONECT   70    3                                                      
CONECT   71    5                                                      
CONECT   72    5                                                      
CONECT   73    6                                                      
CONECT   74    6                                                      
CONECT   75    7                                                      
CONECT   76    8                                                      
CONECT   77    8                                                      
CONECT   78    9                                                      
CONECT   79    9                                                      
CONECT   80   11                                                      
CONECT   81   11                                                      
CONECT   82   12                                                      
CONECT   83   12                                                      
CONECT   84   13                                                      
CONECT   85   13                                                      
CONECT   86   15                                                      
CONECT   87   16                                                      
CONECT   88   16                                                      
CONECT   89   17                                                      
CONECT   90   19                                                      
CONECT   91   22                                                      
CONECT   92   22                                                      
CONECT   93   23                                                      
CONECT   94   23                                                      
CONECT   95   24                                                      
CONECT   96   25                                                      
CONECT   97   27                                                      
CONECT   98   29                                                      
CONECT   99   32                                                      
CONECT  100   33                                                      
CONECT  101   35                                                      
CONECT  102   35                                                      
CONECT  103   36                                                      
CONECT  104   36                                                      
CONECT  105   38                                                      
CONECT  106   39                                                      
CONECT  107   40                                                      
CONECT  108   41                                                      
CONECT  109   44                                                      
CONECT  110   44                                                      
CONECT  111   47                                                      
CONECT  112   47                                                      
CONECT  113   48                                                      
CONECT  114   49                                                      
CONECT  115   50                                                      
CONECT  116   51                                                      
CONECT  117   52                                                      
CONECT  118   52                                                      
CONECT  119   53                                                      
CONECT  120   53                                                      
CONECT  121   54                                                      
CONECT  122   54                                                      
CONECT  123   55                                                      
CONECT  124   55                                                      
CONECT  125   56                                                      
CONECT  126   57                                                      
CONECT  127   58                                                      
CONECT  128   59                                                      
CONECT  129   60                                                      
CONECT  130   60                                                      
CONECT  131   61                                                      
MASTER        0    0    0    0    0    0    0    0  131    0  131    0
END
