COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -3.406   5.488  -1.445  1.00  0.00           S  
HETATM    2  P   UNL     1      12.005  -6.003  -1.712  1.00  0.00           P  
HETATM    3  P   UNL     1       9.967   0.191  -1.342  1.00  0.00           P  
HETATM    4  P   UNL     1       9.307   2.976  -0.573  1.00  0.00           P  
HETATM    5  O   UNL     1       8.206  -3.517   0.298  1.00  0.00           O  
HETATM    6  O   UNL     1      10.997  -5.524  -0.551  1.00  0.00           O  
HETATM    7  O   UNL     1       9.176  -6.913   0.562  1.00  0.00           O  
HETATM    8  O   UNL     1       9.747  -1.197  -0.557  1.00  0.00           O  
HETATM    9  O   UNL     1      12.238  -4.886  -2.655  1.00  0.00           O  
HETATM   10  O   UNL     1      13.405  -6.452  -1.056  1.00  0.00           O  
HETATM   11  O   UNL     1      11.360  -7.247  -2.503  1.00  0.00           O  
HETATM   12  O   UNL     1       9.666   1.422  -0.350  1.00  0.00           O  
HETATM   13  O   UNL     1       9.049   0.254  -2.500  1.00  0.00           O  
HETATM   14  O   UNL     1      11.490   0.278  -1.859  1.00  0.00           O  
HETATM   15  O   UNL     1       8.738   3.597   0.799  1.00  0.00           O  
HETATM   16  O   UNL     1       8.297   7.554   2.220  1.00  0.00           O  
HETATM   17  O   UNL     1       8.280   3.098  -1.632  1.00  0.00           O  
HETATM   18  O   UNL     1      10.632   3.775  -1.015  1.00  0.00           O  
HETATM   19  O   UNL     1       6.391   7.494   0.418  1.00  0.00           O  
HETATM   20  O   UNL     1      -4.468   3.918   0.254  1.00  0.00           O  
HETATM   21  O   UNL     1       1.693   6.865  -0.863  1.00  0.00           O  
HETATM   22  N   UNL     1       6.486  -5.066   0.890  1.00  0.00           N  
HETATM   23  N   UNL     1       4.358  -4.899   0.433  1.00  0.00           N  
HETATM   24  N   UNL     1       6.217  -6.803   2.660  1.00  0.00           N  
HETATM   25  N   UNL     1       4.036  -7.466   3.040  1.00  0.00           N  
HETATM   26  N   UNL     1       2.204  -6.565   1.860  1.00  0.00           N  
HETATM   27  N   UNL     1       4.942   6.282   1.581  1.00  0.00           N  
HETATM   28  N   UNL     1       0.270   5.580   0.253  1.00  0.00           N  
HETATM   29  C   UNL     1       9.709  -4.968  -0.820  1.00  0.00           C  
HETATM   30  C   UNL     1       8.604  -5.810  -0.145  1.00  0.00           C  
HETATM   31  C   UNL     1       9.573  -3.576  -0.164  1.00  0.00           C  
HETATM   32  C   UNL     1       7.931  -4.828   0.840  1.00  0.00           C  
HETATM   33  C   UNL     1       9.835  -2.474  -1.192  1.00  0.00           C  
HETATM   34  C   UNL     1       5.837  -5.947   1.717  1.00  0.00           C  
HETATM   35  C   UNL     1       5.540  -4.448   0.128  1.00  0.00           C  
HETATM   36  C   UNL     1       4.470  -5.831   1.411  1.00  0.00           C  
HETATM   37  C   UNL     1       3.561  -6.636   2.118  1.00  0.00           C  
HETATM   38  C   UNL     1       7.777   5.196   2.335  1.00  0.00           C  
HETATM   39  C   UNL     1       5.329  -7.534   3.299  1.00  0.00           C  
HETATM   40  C   UNL     1     -17.620  -0.058  -0.648  1.00  0.00           C  
HETATM   41  C   UNL     1     -16.239  -0.037   0.010  1.00  0.00           C  
HETATM   42  C   UNL     1     -18.557  -0.956   0.162  1.00  0.00           C  
HETATM   43  C   UNL     1     -15.302   0.862  -0.799  1.00  0.00           C  
HETATM   44  C   UNL     1     -19.938  -0.977  -0.496  1.00  0.00           C  
HETATM   45  C   UNL     1     -13.921   0.882  -0.141  1.00  0.00           C  
HETATM   46  C   UNL     1       8.233   4.930   0.899  1.00  0.00           C  
HETATM   47  C   UNL     1     -20.875  -1.876   0.313  1.00  0.00           C  
HETATM   48  C   UNL     1     -12.984   1.781  -0.950  1.00  0.00           C  
HETATM   49  C   UNL     1       7.235   6.624   2.442  1.00  0.00           C  
HETATM   50  C   UNL     1     -22.257  -1.897  -0.345  1.00  0.00           C  
HETATM   51  C   UNL     1     -11.603   1.802  -0.292  1.00  0.00           C  
HETATM   52  C   UNL     1     -23.194  -2.795   0.464  1.00  0.00           C  
HETATM   53  C   UNL     1     -10.665   2.701  -1.102  1.00  0.00           C  
HETATM   54  C   UNL     1       6.675   4.204   2.713  1.00  0.00           C  
HETATM   55  C   UNL     1       8.963   5.028   3.287  1.00  0.00           C  
HETATM   56  C   UNL     1     -24.575  -2.816  -0.194  1.00  0.00           C  
HETATM   57  C   UNL     1      -9.284   2.721  -0.444  1.00  0.00           C  
HETATM   58  C   UNL     1     -25.512  -3.715   0.616  1.00  0.00           C  
HETATM   59  C   UNL     1      -8.347   3.620  -1.253  1.00  0.00           C  
HETATM   60  C   UNL     1       6.160   6.832   1.407  1.00  0.00           C  
HETATM   61  C   UNL     1     -26.893  -3.735  -0.042  1.00  0.00           C  
HETATM   62  C   UNL     1      -6.966   3.641  -0.595  1.00  0.00           C  
HETATM   63  C   UNL     1     -27.830  -4.634   0.767  1.00  0.00           C  
HETATM   64  C   UNL     1      -6.029   4.539  -1.404  1.00  0.00           C  
HETATM   65  C   UNL     1       3.865   6.574   0.632  1.00  0.00           C  
HETATM   66  C   UNL     1     -29.211  -4.655   0.109  1.00  0.00           C  
HETATM   67  C   UNL     1       2.596   5.830   1.056  1.00  0.00           C  
HETATM   68  C   UNL     1      -4.669   4.560  -0.756  1.00  0.00           C  
HETATM   69  C   UNL     1       1.488   6.130   0.079  1.00  0.00           C  
HETATM   70  C   UNL     1      -2.075   5.128  -0.273  1.00  0.00           C  
HETATM   71  C   UNL     1      -0.807   5.872  -0.697  1.00  0.00           C  
HETATM   72  H   UNL     1       8.526  -7.476   1.005  1.00  0.00           H  
HETATM   73  H   UNL     1      14.062  -6.753  -1.698  1.00  0.00           H  
HETATM   74  H   UNL     1      11.180  -8.017  -1.946  1.00  0.00           H  
HETATM   75  H   UNL     1      12.148   0.243  -1.152  1.00  0.00           H  
HETATM   76  H   UNL     1       8.717   7.472   1.352  1.00  0.00           H  
HETATM   77  H   UNL     1      11.349   3.738  -0.367  1.00  0.00           H  
HETATM   78  H   UNL     1       1.586  -7.125   2.355  1.00  0.00           H  
HETATM   79  H   UNL     1       1.870  -5.954   1.184  1.00  0.00           H  
HETATM   80  H   UNL     1       0.106   4.992   1.007  1.00  0.00           H  
HETATM   81  H   UNL     1       9.538  -4.904  -1.894  1.00  0.00           H  
HETATM   82  H   UNL     1       7.886  -6.163  -0.886  1.00  0.00           H  
HETATM   83  H   UNL     1      10.262  -3.483   0.676  1.00  0.00           H  
HETATM   84  H   UNL     1       8.366  -4.927   1.834  1.00  0.00           H  
HETATM   85  H   UNL     1       9.093  -2.536  -1.988  1.00  0.00           H  
HETATM   86  H   UNL     1       5.741  -3.694  -0.619  1.00  0.00           H  
HETATM   87  H   UNL     1       5.671  -8.221   4.060  1.00  0.00           H  
HETATM   88  H   UNL     1     -18.024   0.954  -0.678  1.00  0.00           H  
HETATM   89  H   UNL     1     -17.533  -0.444  -1.663  1.00  0.00           H  
HETATM   90  H   UNL     1     -16.326   0.350   1.026  1.00  0.00           H  
HETATM   91  H   UNL     1     -15.836  -1.049   0.040  1.00  0.00           H  
HETATM   92  H   UNL     1     -18.154  -1.969   0.192  1.00  0.00           H  
HETATM   93  H   UNL     1     -18.644  -0.570   1.177  1.00  0.00           H  
HETATM   94  H   UNL     1     -15.215   0.475  -1.814  1.00  0.00           H  
HETATM   95  H   UNL     1     -15.705   1.874  -0.829  1.00  0.00           H  
HETATM   96  H   UNL     1     -20.342   0.035  -0.526  1.00  0.00           H  
HETATM   97  H   UNL     1     -19.851  -1.364  -1.512  1.00  0.00           H  
HETATM   98  H   UNL     1     -14.008   1.269   0.874  1.00  0.00           H  
HETATM   99  H   UNL     1     -13.517  -0.130  -0.111  1.00  0.00           H  
HETATM  100  H   UNL     1       9.017   5.637   0.631  1.00  0.00           H  
HETATM  101  H   UNL     1       7.388   5.050   0.221  1.00  0.00           H  
HETATM  102  H   UNL     1     -20.472  -2.888   0.343  1.00  0.00           H  
HETATM  103  H   UNL     1     -20.963  -1.489   1.328  1.00  0.00           H  
HETATM  104  H   UNL     1     -12.897   1.394  -1.966  1.00  0.00           H  
HETATM  105  H   UNL     1     -13.387   2.793  -0.980  1.00  0.00           H  
HETATM  106  H   UNL     1       6.818   6.780   3.437  1.00  0.00           H  
HETATM  107  H   UNL     1     -22.660  -0.884  -0.375  1.00  0.00           H  
HETATM  108  H   UNL     1     -22.170  -2.283  -1.360  1.00  0.00           H  
HETATM  109  H   UNL     1     -11.690   2.188   0.723  1.00  0.00           H  
HETATM  110  H   UNL     1     -11.199   0.790  -0.262  1.00  0.00           H  
HETATM  111  H   UNL     1     -22.790  -3.807   0.494  1.00  0.00           H  
HETATM  112  H   UNL     1     -23.281  -2.409   1.480  1.00  0.00           H  
HETATM  113  H   UNL     1     -10.578   2.314  -2.117  1.00  0.00           H  
HETATM  114  H   UNL     1     -11.069   3.713  -1.132  1.00  0.00           H  
HETATM  115  H   UNL     1       7.088   3.195   2.738  1.00  0.00           H  
HETATM  116  H   UNL     1       6.278   4.458   3.695  1.00  0.00           H  
HETATM  117  H   UNL     1       5.875   4.251   1.974  1.00  0.00           H  
HETATM  118  H   UNL     1       9.783   5.668   2.962  1.00  0.00           H  
HETATM  119  H   UNL     1       8.661   5.308   4.296  1.00  0.00           H  
HETATM  120  H   UNL     1       9.289   3.988   3.280  1.00  0.00           H  
HETATM  121  H   UNL     1     -24.978  -1.804  -0.224  1.00  0.00           H  
HETATM  122  H   UNL     1     -24.488  -3.203  -1.209  1.00  0.00           H  
HETATM  123  H   UNL     1      -9.371   3.108   0.572  1.00  0.00           H  
HETATM  124  H   UNL     1      -8.881   1.709  -0.414  1.00  0.00           H  
HETATM  125  H   UNL     1     -25.109  -4.727   0.646  1.00  0.00           H  
HETATM  126  H   UNL     1     -25.599  -3.328   1.631  1.00  0.00           H  
HETATM  127  H   UNL     1      -8.260   3.233  -2.268  1.00  0.00           H  
HETATM  128  H   UNL     1      -8.751   4.632  -1.283  1.00  0.00           H  
HETATM  129  H   UNL     1     -27.296  -2.723  -0.072  1.00  0.00           H  
HETATM  130  H   UNL     1     -26.806  -4.122  -1.058  1.00  0.00           H  
HETATM  131  H   UNL     1      -7.053   4.027   0.420  1.00  0.00           H  
HETATM  132  H   UNL     1      -6.563   2.628  -0.565  1.00  0.00           H  
HETATM  133  H   UNL     1     -27.427  -5.646   0.797  1.00  0.00           H  
HETATM  134  H   UNL     1     -27.917  -4.247   1.783  1.00  0.00           H  
HETATM  135  H   UNL     1      -5.942   4.153  -2.420  1.00  0.00           H  
HETATM  136  H   UNL     1      -6.432   5.551  -1.434  1.00  0.00           H  
HETATM  137  H   UNL     1       3.671   7.646   0.620  1.00  0.00           H  
HETATM  138  H   UNL     1     -29.615  -3.643   0.079  1.00  0.00           H  
HETATM  139  H   UNL     1     -29.124  -5.042  -0.906  1.00  0.00           H  
HETATM  140  H   UNL     1     -29.879  -5.295   0.686  1.00  0.00           H  
HETATM  141  H   UNL     1       2.791   4.758   1.067  1.00  0.00           H  
HETATM  142  H   UNL     1       2.300   6.157   2.053  1.00  0.00           H  
HETATM  143  H   UNL     1      -2.372   5.454   0.724  1.00  0.00           H  
HETATM  144  H   UNL     1      -1.881   4.056  -0.261  1.00  0.00           H  
HETATM  145  H   UNL     1      -1.001   6.944  -0.708  1.00  0.00           H  
HETATM  146  H   UNL     1      -0.511   5.545  -1.693  1.00  0.00           H  
HETATM  147  H   UNL     1      10.832  -2.601  -1.615  1.00  0.00           H  
HETATM  148  H   UNL     1       4.778   5.694   2.335  1.00  0.00           H  
HETATM  149  H   UNL     1       4.161   6.247  -0.365  1.00  0.00           H  
CONECT    1   68   70                                                 
CONECT    2    6    9    9   10                                       
CONECT    2   11                                                      
CONECT    3    8   12   13   13                                       
CONECT    3   14                                                      
CONECT    4   12   15   17   17                                       
CONECT    4   18                                                      
CONECT    5   31   32                                                 
CONECT    6    2   29                                                 
CONECT    7   30   72                                                 
CONECT    8    3   33                                                 
CONECT    9    2    2                                                 
CONECT   10    2   73                                                 
CONECT   11    2   74                                                 
CONECT   12    3    4                                                 
CONECT   13    3    3                                                 
CONECT   14    3   75                                                 
CONECT   15    4   46                                                 
CONECT   16   49   76                                                 
CONECT   17    4    4                                                 
CONECT   18    4   77                                                 
CONECT   19   60   60                                                 
CONECT   20   68   68                                                 
CONECT   21   69   69                                                 
CONECT   22   32   34   35                                            
CONECT   23   35   35   36                                            
CONECT   24   34   34   39                                            
CONECT   25   37   39   39                                            
CONECT   26   37   78   79                                            
CONECT   27   60   65  148                                            
CONECT   28   69   71   80                                            
CONECT   29    6   30   31   81                                       
CONECT   30    7   29   32   82                                       
CONECT   31    5   29   33   83                                       
CONECT   32    5   22   30   84                                       
CONECT   33   31   85    8  147                                       
CONECT   34   22   24   24   36                                       
CONECT   35   22   23   23   86                                       
CONECT   36   23   34   37   37                                       
CONECT   37   25   26   36   36                                       
CONECT   38   46   49   54   55                                       
CONECT   39   24   25   25   87                                       
CONECT   40   41   42   88   89                                       
CONECT   41   40   43   90   91                                       
CONECT   42   40   44   92   93                                       
CONECT   43   41   45   94   95                                       
CONECT   44   42   47   96   97                                       
CONECT   45   43   48   98   99                                       
CONECT   46   15   38  100  101                                       
CONECT   47   44   50  102  103                                       
CONECT   48   45   51  104  105                                       
CONECT   49   16   38   60  106                                       
CONECT   50   47   52  107  108                                       
CONECT   51   48   53  109  110                                       
CONECT   52   50   56  111  112                                       
CONECT   53   51   57  113  114                                       
CONECT   54   38  115  116  117                                       
CONECT   55   38  118  119  120                                       
CONECT   56   52   58  121  122                                       
CONECT   57   53   59  123  124                                       
CONECT   58   56   61  125  126                                       
CONECT   59   57   62  127  128                                       
CONECT   60   19   19   27   49                                       
CONECT   61   58   63  129  130                                       
CONECT   62   59   64  131  132                                       
CONECT   63   61   66  133  134                                       
CONECT   64   62   68  135  136                                       
CONECT   65   27   67  137  149                                       
CONECT   66   63  138  139  140                                       
CONECT   67   65   69  141  142                                       
CONECT   68    1   20   20   64                                       
CONECT   69   21   21   28   67                                       
CONECT   70    1   71  143  144                                       
CONECT   71   28   70  145  146                                       
CONECT   72    7                                                      
CONECT   73   10                                                      
CONECT   74   11                                                      
CONECT   75   14                                                      
CONECT   76   16                                                      
CONECT   77   18                                                      
CONECT   78   26                                                      
CONECT   79   26                                                      
CONECT   80   28                                                      
CONECT   81   29                                                      
CONECT   82   30                                                      
CONECT   83   31                                                      
CONECT   84   32                                                      
CONECT   85   33                                                      
CONECT   86   35                                                      
CONECT   87   39                                                      
CONECT   88   40                                                      
CONECT   89   40                                                      
CONECT   90   41                                                      
CONECT   91   41                                                      
CONECT   92   42                                                      
CONECT   93   42                                                      
CONECT   94   43                                                      
CONECT   95   43                                                      
CONECT   96   44                                                      
CONECT   97   44                                                      
CONECT   98   45                                                      
CONECT   99   45                                                      
CONECT  100   46                                                      
CONECT  101   46                                                      
CONECT  102   47                                                      
CONECT  103   47                                                      
CONECT  104   48                                                      
CONECT  105   48                                                      
CONECT  106   49                                                      
CONECT  107   50                                                      
CONECT  108   50                                                      
CONECT  109   51                                                      
CONECT  110   51                                                      
CONECT  111   52                                                      
CONECT  112   52                                                      
CONECT  113   53                                                      
CONECT  114   53                                                      
CONECT  115   54                                                      
CONECT  116   54                                                      
CONECT  117   54                                                      
CONECT  118   55                                                      
CONECT  119   55                                                      
CONECT  120   55                                                      
CONECT  121   56                                                      
CONECT  122   56                                                      
CONECT  123   57                                                      
CONECT  124   57                                                      
CONECT  125   58                                                      
CONECT  126   58                                                      
CONECT  127   59                                                      
CONECT  128   59                                                      
CONECT  129   61                                                      
CONECT  130   61                                                      
CONECT  131   62                                                      
CONECT  132   62                                                      
CONECT  133   63                                                      
CONECT  134   63                                                      
CONECT  135   64                                                      
CONECT  136   64                                                      
CONECT  137   65                                                      
CONECT  138   66                                                      
CONECT  139   66                                                      
CONECT  140   66                                                      
CONECT  141   67                                                      
CONECT  142   67                                                      
CONECT  143   70                                                      
CONECT  144   70                                                      
CONECT  145   71                                                      
CONECT  146   71                                                      
CONECT  147   33                                                      
CONECT  148   27                                                      
CONECT  149   65                                                      
MASTER        0    0    0    0    0    0    0    0  149    0  149    0
END
