COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1    -113.336  26.678   9.336  1.00  0.00           C  
HETATM    2  C   UNL     1    -112.205  26.344   8.513  1.00  0.00           C  
HETATM    3  C   UNL     1    -110.926  26.702   8.914  1.00  0.00           C  
HETATM    4  C   UNL     1    -110.689  27.402  10.154  1.00  0.00           C  
HETATM    5  C   UNL     1    -111.925  28.470  12.345  1.00  0.00           C  
HETATM    6  C   UNL     1    -113.109  28.792  12.948  1.00  0.00           C  
HETATM    7  C   UNL     1    -114.438  28.447  12.386  1.00  0.00           C  
HETATM    8  C   UNL     1    -114.333  27.633  11.273  1.00  0.00           C  
HETATM    9  C   UNL     1    -113.141  27.385  10.589  1.00  0.00           C  
HETATM   10  C   UNL     1    -111.838  27.746  11.012  1.00  0.00           C  
HETATM   11  C   UNL     1    -110.982  28.926  13.101  1.00  0.00           C  
HETATM   12  C   UNL     1    -111.337  29.756  14.088  1.00  0.00           C  
HETATM   13  C   UNL     1    -110.595  29.380  15.346  1.00  0.00           C  
HETATM   14  C   UNL     1    -115.686  28.497  13.242  1.00  0.00           C  
HETATM   15  C   UNL     1    -112.722  26.396   6.051  1.00  0.00           C  
HETATM   16  C   UNL     1    -112.905  25.702   4.724  1.00  0.00           C  
HETATM   17  C   UNL     1    -113.481  26.488   3.548  1.00  0.00           C  
HETATM   18  C   UNL     1    -112.559  27.409   2.745  1.00  0.00           C  
HETATM   19  C   UNL     1    -111.217  27.860   3.323  1.00  0.00           C  
HETATM   20  C   UNL     1    -110.729  29.271   3.149  1.00  0.00           C  
HETATM   21  C   UNL     1    -110.972  30.062   4.423  1.00  0.00           C  
HETATM   22  C   UNL     1    -109.934  31.098   4.796  1.00  0.00           C  
HETATM   23  C   UNL     1    -110.470  31.936   5.952  1.00  0.00           C  
HETATM   24  C   UNL     1    -109.753  31.756   7.265  1.00  0.00           C  
HETATM   25  C   UNL     1    -110.242  32.849   8.192  1.00  0.00           C  
HETATM   26  C   UNL     1    -110.687  32.260   9.510  1.00  0.00           C  
HETATM   27  C   UNL     1    -110.845  33.312  10.587  1.00  0.00           C  
HETATM   28  C   UNL     1    -111.209  32.851  11.999  1.00  0.00           C  
HETATM   29  C   UNL     1    -110.910  31.528  12.378  1.00  0.00           C  
HETATM   30  C   UNL     1    -112.301  24.342   4.495  1.00  0.00           C  
HETATM   31  C   UNL     1    -109.305  29.156   2.721  1.00  0.00           C  
HETATM   32  C   UNL     1    -109.599  31.989   3.656  1.00  0.00           C  
HETATM   33  C   UNL     1    -108.265  31.818   7.122  1.00  0.00           C  
HETATM   34  C   UNL     1    -111.983  31.539   9.300  1.00  0.00           C  
HETATM   35  C   UNL     1    -109.233  34.967   7.706  1.00  0.00           C  
HETATM   36  C   UNL     1    -107.936  35.674   7.472  1.00  0.00           C  
HETATM   37  C   UNL     1    -110.855  35.691  11.165  1.00  0.00           C  
HETATM   38  N   UNL     1    -112.386  25.639   7.251  1.00  0.00           N  
HETATM   39  O   UNL     1    -109.892  26.346   8.065  1.00  0.00           O  
HETATM   40  C   UNL     1    -108.609  26.696   8.456  1.00  0.00           C  
HETATM   41  C   UNL     1    -108.363  27.377   9.656  1.00  0.00           C  
HETATM   42  N   UNL     1    -109.392  27.712  10.467  1.00  0.00           N  
HETATM   43  O   UNL     1    -114.461  26.366   8.980  1.00  0.00           O  
HETATM   44  O   UNL     1    -115.508  27.217  10.675  1.00  0.00           O  
HETATM   45  O   UNL     1    -112.791  29.585  14.325  1.00  0.00           O  
HETATM   46  O   UNL     1    -109.828  28.607  12.942  1.00  0.00           O  
HETATM   47  O   UNL     1    -111.031  31.107  13.743  1.00  0.00           O  
HETATM   48  O   UNL     1    -110.916  34.651  10.239  1.00  0.00           O  
HETATM   49  O   UNL     1    -109.241  33.768   8.389  1.00  0.00           O  
HETATM   50  O   UNL     1    -110.286  35.523   7.393  1.00  0.00           O  
HETATM   51  O   UNL     1    -111.778  31.598   6.158  1.00  0.00           O  
HETATM   52  O   UNL     1    -112.169  30.705   4.267  1.00  0.00           O  
HETATM   53  O   UNL     1    -112.849  27.607   6.120  1.00  0.00           O  
HETATM   54  C   UNL     1    -107.599  26.326   7.584  1.00  0.00           C  
HETATM   55  C   UNL     1    -106.283  26.640   7.903  1.00  0.00           C  
HETATM   56  C   UNL     1    -105.990  27.318   9.086  1.00  0.00           C  
HETATM   57  C   UNL     1    -107.006  27.688   9.962  1.00  0.00           C  
HETATM   58  O   UNL     1    -106.691  28.375  11.153  1.00  0.00           O  
HETATM   59  C   UNL     1    -105.354  28.729  11.494  1.00  0.00           C  
HETATM   60  C   UNL     1    -105.297  29.207  12.949  1.00  0.00           C  
HETATM   61  N   UNL     1    -105.674  28.102  13.872  1.00  0.00           N  
HETATM   62  C   UNL     1    -105.093  28.338  15.198  1.00  0.00           C  
HETATM   63  C   UNL     1    -105.276  27.165  16.133  1.00  0.00           C  
HETATM   64  C   UNL     1    -107.125  28.006  13.973  1.00  0.00           C  
HETATM   65  C   UNL     1    -107.530  26.613  13.562  1.00  0.00           C  
HETATM   66  H   UNL     1    -110.884  30.061  16.160  1.00  0.00           H  
HETATM   67  H   UNL     1    -110.847  28.346  15.625  1.00  0.00           H  
HETATM   68  H   UNL     1    -109.512  29.458  15.170  1.00  0.00           H  
HETATM   69  H   UNL     1    -115.725  27.607  13.887  1.00  0.00           H  
HETATM   70  H   UNL     1    -115.665  29.402  13.867  1.00  0.00           H  
HETATM   71  H   UNL     1    -116.574  28.519  12.594  1.00  0.00           H  
HETATM   72  H   UNL     1    -114.525  26.395   3.286  1.00  0.00           H  
HETATM   73  H   UNL     1    -112.859  27.743   1.763  1.00  0.00           H  
HETATM   74  H   UNL     1    -110.609  27.152   3.866  1.00  0.00           H  
HETATM   75  H   UNL     1    -111.303  29.741   2.337  1.00  0.00           H  
HETATM   76  H   UNL     1    -111.042  29.344   5.253  1.00  0.00           H  
HETATM   77  H   UNL     1    -109.022  30.581   5.130  1.00  0.00           H  
HETATM   78  H   UNL     1    -110.395  32.995   5.664  1.00  0.00           H  
HETATM   79  H   UNL     1    -110.031  30.781   7.691  1.00  0.00           H  
HETATM   80  H   UNL     1    -111.111  33.333   7.722  1.00  0.00           H  
HETATM   81  H   UNL     1    -109.930  31.534   9.841  1.00  0.00           H  
HETATM   82  H   UNL     1    -109.767  33.349  10.804  1.00  0.00           H  
HETATM   83  H   UNL     1    -111.686  33.527  12.693  1.00  0.00           H  
HETATM   84  H   UNL     1    -110.585  30.820  11.630  1.00  0.00           H  
HETATM   85  H   UNL     1    -111.942  23.934   5.451  1.00  0.00           H  
HETATM   86  H   UNL     1    -113.062  23.670   4.072  1.00  0.00           H  
HETATM   87  H   UNL     1    -111.458  24.429   3.794  1.00  0.00           H  
HETATM   88  H   UNL     1    -108.883  30.161   2.575  1.00  0.00           H  
HETATM   89  H   UNL     1    -108.731  28.627   3.496  1.00  0.00           H  
HETATM   90  H   UNL     1    -109.250  28.594   1.777  1.00  0.00           H  
HETATM   91  H   UNL     1    -108.843  32.723   3.973  1.00  0.00           H  
HETATM   92  H   UNL     1    -109.200  31.388   2.826  1.00  0.00           H  
HETATM   93  H   UNL     1    -110.506  32.516   3.324  1.00  0.00           H  
HETATM   94  H   UNL     1    -107.795  31.681   8.107  1.00  0.00           H  
HETATM   95  H   UNL     1    -107.929  31.022   6.442  1.00  0.00           H  
HETATM   96  H   UNL     1    -107.977  32.797   6.711  1.00  0.00           H  
HETATM   97  H   UNL     1    -112.320  31.104  10.253  1.00  0.00           H  
HETATM   98  H   UNL     1    -112.741  32.246   8.932  1.00  0.00           H  
HETATM   99  H   UNL     1    -111.841  30.737   8.561  1.00  0.00           H  
HETATM  100  H   UNL     1    -108.131  36.659   7.022  1.00  0.00           H  
HETATM  101  H   UNL     1    -107.412  35.806   8.430  1.00  0.00           H  
HETATM  102  H   UNL     1    -107.311  35.077   6.792  1.00  0.00           H  
HETATM  103  H   UNL     1    -110.933  36.655  10.640  1.00  0.00           H  
HETATM  104  H   UNL     1    -111.686  35.595  11.880  1.00  0.00           H  
HETATM  105  H   UNL     1    -109.898  35.644  11.706  1.00  0.00           H  
HETATM  106  H   UNL     1    -112.281  24.646   7.208  1.00  0.00           H  
HETATM  107  H   UNL     1    -115.309  26.782   9.854  1.00  0.00           H  
HETATM  108  H   UNL     1    -112.129  32.111   6.876  1.00  0.00           H  
HETATM  109  H   UNL     1    -112.359  31.214   5.046  1.00  0.00           H  
HETATM  110  H   UNL     1    -107.830  25.801   6.669  1.00  0.00           H  
HETATM  111  H   UNL     1    -105.485  26.358   7.233  1.00  0.00           H  
HETATM  112  H   UNL     1    -104.965  27.558   9.325  1.00  0.00           H  
HETATM  113  H   UNL     1    -104.702  27.852  11.372  1.00  0.00           H  
HETATM  114  H   UNL     1    -105.010  29.536  10.831  1.00  0.00           H  
HETATM  115  H   UNL     1    -104.275  29.541  13.181  1.00  0.00           H  
HETATM  116  H   UNL     1    -105.996  30.046  13.083  1.00  0.00           H  
HETATM  117  H   UNL     1    -104.016  28.530  15.081  1.00  0.00           H  
HETATM  118  H   UNL     1    -105.577  29.221  15.642  1.00  0.00           H  
HETATM  119  H   UNL     1    -104.823  27.398  17.108  1.00  0.00           H  
HETATM  120  H   UNL     1    -106.350  26.967  16.266  1.00  0.00           H  
HETATM  121  H   UNL     1    -104.789  26.276  15.705  1.00  0.00           H  
HETATM  122  H   UNL     1    -107.595  28.743  13.306  1.00  0.00           H  
HETATM  123  H   UNL     1    -107.440  28.196  15.010  1.00  0.00           H  
HETATM  124  H   UNL     1    -108.623  26.514  13.629  1.00  0.00           H  
HETATM  125  H   UNL     1    -107.208  26.428  12.526  1.00  0.00           H  
HETATM  126  H   UNL     1    -107.053  25.881  14.230  1.00  0.00           H  
CONECT    1    2   43   43    9                                       
CONECT    2   38    3    3    1                                       
CONECT    3   39    2    2    4                                       
CONECT    4    3   42   42   10                                       
CONECT    5   10    6    6   11                                       
CONECT    6    5    5    7   45                                       
CONECT    7    8    8    6   14                                       
CONECT    8    9   44    7    7                                       
CONECT    9    1   10   10    8                                       
CONECT   10    4    9    9    5                                       
CONECT   11    5   46   46   12                                       
CONECT   12   11   47   45   13                                       
CONECT   13   12   66   67   68                                       
CONECT   14    7   69   70   71                                       
CONECT   15   16   53   53   38                                       
CONECT   16   17   17   30   15                                       
CONECT   17   18   16   16   72                                       
CONECT   18   19   19   17   73                                       
CONECT   19   18   18   20   74                                       
CONECT   20   31   19   21   75                                       
CONECT   21   20   52   22   76                                       
CONECT   22   32   21   23   77                                       
CONECT   23   22   51   24   78                                       
CONECT   24   23   33   25   79                                       
CONECT   25   24   49   26   80                                       
CONECT   26   25   34   27   81                                       
CONECT   27   26   48   28   82                                       
CONECT   28   27   29   29   83                                       
CONECT   29   28   28   47   84                                       
CONECT   30   16   85   86   87                                       
CONECT   31   20   88   89   90                                       
CONECT   32   22   91   92   93                                       
CONECT   33   24   94   95   96                                       
CONECT   34   26   97   98   99                                       
CONECT   35   50   50   36   49                                       
CONECT   36   35  100  101  102                                       
CONECT   37   48  103  104  105                                       
CONECT   38   15    2  106                                            
CONECT   39   40    3                                                 
CONECT   40   54   39   41   41                                       
CONECT   41   40   40   57   42                                       
CONECT   42   41    4    4                                            
CONECT   43    1    1                                                 
CONECT   44    8  107                                                 
CONECT   45    6   12                                                 
CONECT   46   11   11                                                 
CONECT   47   29   12                                                 
CONECT   48   27   37                                                 
CONECT   49   35   25                                                 
CONECT   50   35   35                                                 
CONECT   51   23  108                                                 
CONECT   52   21  109                                                 
CONECT   53   15   15                                                 
CONECT   54   55   55   40  110                                       
CONECT   55   54   54   56  111                                       
CONECT   56   55   57   57  112                                       
CONECT   57   56   56   41   58                                       
CONECT   58   57   59                                                 
CONECT   59   58   60  113  114                                       
CONECT   60   59   61  115  116                                       
CONECT   61   60   64   62                                            
CONECT   62   61   63  117  118                                       
CONECT   63   62  119  120  121                                       
CONECT   64   65   61  122  123                                       
CONECT   65   64  124  125  126                                       
CONECT   66   13                                                      
CONECT   67   13                                                      
CONECT   68   13                                                      
CONECT   69   14                                                      
CONECT   70   14                                                      
CONECT   71   14                                                      
CONECT   72   17                                                      
CONECT   73   18                                                      
CONECT   74   19                                                      
CONECT   75   20                                                      
CONECT   76   21                                                      
CONECT   77   22                                                      
CONECT   78   23                                                      
CONECT   79   24                                                      
CONECT   80   25                                                      
CONECT   81   26                                                      
CONECT   82   27                                                      
CONECT   83   28                                                      
CONECT   84   29                                                      
CONECT   85   30                                                      
CONECT   86   30                                                      
CONECT   87   30                                                      
CONECT   88   31                                                      
CONECT   89   31                                                      
CONECT   90   31                                                      
CONECT   91   32                                                      
CONECT   92   32                                                      
CONECT   93   32                                                      
CONECT   94   33                                                      
CONECT   95   33                                                      
CONECT   96   33                                                      
CONECT   97   34                                                      
CONECT   98   34                                                      
CONECT   99   34                                                      
CONECT  100   36                                                      
CONECT  101   36                                                      
CONECT  102   36                                                      
CONECT  103   37                                                      
CONECT  104   37                                                      
CONECT  105   37                                                      
CONECT  106   38                                                      
CONECT  107   44                                                      
CONECT  108   51                                                      
CONECT  109   52                                                      
CONECT  110   54                                                      
CONECT  111   55                                                      
CONECT  112   56                                                      
CONECT  113   59                                                      
CONECT  114   59                                                      
CONECT  115   60                                                      
CONECT  116   60                                                      
CONECT  117   62                                                      
CONECT  118   62                                                      
CONECT  119   63                                                      
CONECT  120   63                                                      
CONECT  121   63                                                      
CONECT  122   64                                                      
CONECT  123   64                                                      
CONECT  124   65                                                      
CONECT  125   65                                                      
CONECT  126   65                                                      
MASTER        0    0    0    0    0    0    0    0  126    0  126    0
END
