COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1     -19.719   7.774  -0.436  1.00  0.00           C  
HETATM    2  N   UNL     1     -18.400   7.821  -0.268  1.00  0.00           N  
HETATM    3  C   UNL     1     -20.076   6.488  -0.669  1.00  0.00           C  
HETATM    4  C   UNL     1     -17.905   6.607  -0.385  1.00  0.00           C  
HETATM    5  N   UNL     1     -18.936   5.746  -0.638  1.00  0.00           N  
HETATM    6  C   UNL     1     -18.833   4.298  -0.837  1.00  0.00           C  
HETATM    7  C   UNL     1     -16.483   6.239  -0.266  1.00  0.00           C  
HETATM    8  O   UNL     1     -16.142   5.079  -0.395  1.00  0.00           O  
HETATM    9  N   UNL     1     -15.560   7.189  -0.014  1.00  0.00           N  
HETATM   10  C   UNL     1     -14.203   6.838   0.100  1.00  0.00           C  
HETATM   11  C   UNL     1     -13.669   5.547  -0.031  1.00  0.00           C  
HETATM   12  C   UNL     1     -13.174   7.689   0.350  1.00  0.00           C  
HETATM   13  C   UNL     1     -12.306   5.652   0.153  1.00  0.00           C  
HETATM   14  N   UNL     1     -12.017   6.977   0.386  1.00  0.00           N  
HETATM   15  C   UNL     1     -10.682   7.529   0.629  1.00  0.00           C  
HETATM   16  C   UNL     1     -11.340   4.551   0.104  1.00  0.00           C  
HETATM   17  O   UNL     1     -10.148   4.782   0.192  1.00  0.00           O  
HETATM   18  N   UNL     1     -11.771   3.282  -0.038  1.00  0.00           N  
HETATM   19  C   UNL     1     -10.857   2.219   0.026  1.00  0.00           C  
HETATM   20  N   UNL     1     -11.153   0.925  -0.099  1.00  0.00           N  
HETATM   21  C   UNL     1      -9.514   2.332   0.220  1.00  0.00           C  
HETATM   22  C   UNL     1     -10.049   0.215   0.014  1.00  0.00           C  
HETATM   23  N   UNL     1      -9.003   1.070   0.215  1.00  0.00           N  
HETATM   24  C   UNL     1      -7.597   0.699   0.389  1.00  0.00           C  
HETATM   25  C   UNL     1      -9.958  -1.253  -0.067  1.00  0.00           C  
HETATM   26  O   UNL     1      -8.880  -1.803   0.053  1.00  0.00           O  
HETATM   27  N   UNL     1     -11.069  -1.987  -0.274  1.00  0.00           N  
HETATM   28  C   UNL     1     -10.982  -3.388  -0.351  1.00  0.00           C  
HETATM   29  C   UNL     1      -9.812  -4.152  -0.230  1.00  0.00           C  
HETATM   30  C   UNL     1     -12.018  -4.246  -0.549  1.00  0.00           C  
HETATM   31  C   UNL     1     -10.175  -5.475  -0.367  1.00  0.00           C  
HETATM   32  N   UNL     1     -11.537  -5.517  -0.563  1.00  0.00           N  
HETATM   33  C   UNL     1     -12.336  -6.730  -0.750  1.00  0.00           C  
HETATM   34  C   UNL     1      -9.273  -6.630  -0.312  1.00  0.00           C  
HETATM   35  O   UNL     1      -9.727  -7.759  -0.356  1.00  0.00           O  
HETATM   36  N   UNL     1      -7.943  -6.442  -0.211  1.00  0.00           N  
HETATM   37  C   UNL     1      -7.034  -7.590  -0.266  1.00  0.00           C  
HETATM   38  C   UNL     1      -5.590  -7.105  -0.129  1.00  0.00           C  
HETATM   39  C   UNL     1      -4.641  -8.304  -0.187  1.00  0.00           C  
HETATM   40  C   UNL     1      -3.218  -7.825  -0.052  1.00  0.00           C  
HETATM   41  O   UNL     1      -2.986  -6.642   0.077  1.00  0.00           O  
HETATM   42  N   UNL     1      -2.204  -8.713  -0.075  1.00  0.00           N  
HETATM   43  C   UNL     1      -0.876  -8.266   0.050  1.00  0.00           C  
HETATM   44  C   UNL     1      -0.462  -6.936   0.211  1.00  0.00           C  
HETATM   45  C   UNL     1       0.236  -9.047   0.044  1.00  0.00           C  
HETATM   46  C   UNL     1       0.914  -6.946   0.293  1.00  0.00           C  
HETATM   47  N   UNL     1       1.329  -8.253   0.188  1.00  0.00           N  
HETATM   48  C   UNL     1       2.720  -8.714   0.230  1.00  0.00           C  
HETATM   49  C   UNL     1       1.779  -5.774   0.465  1.00  0.00           C  
HETATM   50  O   UNL     1       2.990  -5.901   0.430  1.00  0.00           O  
HETATM   51  N   UNL     1       1.235  -4.557   0.661  1.00  0.00           N  
HETATM   52  C   UNL     1       2.059  -3.418   0.715  1.00  0.00           C  
HETATM   53  C   UNL     1       3.454  -3.400   0.582  1.00  0.00           C  
HETATM   54  C   UNL     1       1.644  -2.137   0.900  1.00  0.00           C  
HETATM   55  C   UNL     1       3.856  -2.086   0.697  1.00  0.00           C  
HETATM   56  N   UNL     1       2.730  -1.321   0.893  1.00  0.00           N  
HETATM   57  C   UNL     1       2.705   0.134   1.062  1.00  0.00           C  
HETATM   58  C   UNL     1       5.235  -1.593   0.622  1.00  0.00           C  
HETATM   59  O   UNL     1       5.474  -0.418   0.832  1.00  0.00           O  
HETATM   60  N   UNL     1       6.239  -2.441   0.321  1.00  0.00           N  
HETATM   61  C   UNL     1       7.544  -1.951   0.141  1.00  0.00           C  
HETATM   62  C   UNL     1       7.945  -0.611   0.244  1.00  0.00           C  
HETATM   63  C   UNL     1       8.645  -2.690  -0.159  1.00  0.00           C  
HETATM   64  C   UNL     1       9.301  -0.573  -0.006  1.00  0.00           C  
HETATM   65  N   UNL     1       9.717  -1.861  -0.252  1.00  0.00           N  
HETATM   66  C   UNL     1      11.089  -2.271  -0.559  1.00  0.00           C  
HETATM   67  C   UNL     1      10.148   0.625  -0.006  1.00  0.00           C  
HETATM   68  O   UNL     1      11.317   0.543  -0.334  1.00  0.00           O  
HETATM   69  N   UNL     1       9.631   1.816   0.356  1.00  0.00           N  
HETATM   70  C   UNL     1      10.467   2.942   0.461  1.00  0.00           C  
HETATM   71  C   UNL     1      11.848   2.973   0.221  1.00  0.00           C  
HETATM   72  C   UNL     1      10.079   4.198   0.809  1.00  0.00           C  
HETATM   73  C   UNL     1      12.269   4.268   0.438  1.00  0.00           C  
HETATM   74  N   UNL     1      11.168   5.010   0.799  1.00  0.00           N  
HETATM   75  C   UNL     1      11.170   6.440   1.118  1.00  0.00           C  
HETATM   76  C   UNL     1      13.642   4.765   0.305  1.00  0.00           C  
HETATM   77  O   UNL     1      13.875   5.952   0.436  1.00  0.00           O  
HETATM   78  N   UNL     1      14.646   3.907   0.037  1.00  0.00           N  
HETATM   79  C   UNL     1      16.031   4.385   0.012  1.00  0.00           C  
HETATM   80  C   UNL     1      16.967   3.219  -0.313  1.00  0.00           C  
HETATM   81  C   UNL     1      18.392   3.711  -0.339  1.00  0.00           C  
HETATM   82  O   UNL     1      18.634   4.878  -0.118  1.00  0.00           O  
HETATM   83  N   UNL     1      19.396   2.853  -0.607  1.00  0.00           N  
HETATM   84  C   UNL     1      20.781   3.331  -0.631  1.00  0.00           C  
HETATM   85  C   UNL     1      21.717   2.165  -0.957  1.00  0.00           C  
HETATM   86  C   UNL     1      23.163   2.664  -0.983  1.00  0.00           C  
HETATM   87  N   UNL     1      24.061   1.545  -1.295  1.00  0.00           N  
HETATM   88  C   UNL     1      25.425   2.023  -1.562  1.00  0.00           C  
HETATM   89  C   UNL     1      24.055   0.548  -0.217  1.00  0.00           C  
HETATM   90  H   UNL     1     -21.076   6.120  -0.844  1.00  0.00           H  
HETATM   91  H   UNL     1     -18.684   4.087  -1.895  1.00  0.00           H  
HETATM   92  H   UNL     1     -17.988   3.912  -0.266  1.00  0.00           H  
HETATM   93  H   UNL     1     -19.751   3.819  -0.496  1.00  0.00           H  
HETATM   94  H   UNL     1     -20.392   8.618  -0.391  1.00  0.00           H  
HETATM   95  H   UNL     1     -15.832   8.114   0.088  1.00  0.00           H  
HETATM   96  H   UNL     1     -14.221   4.642  -0.236  1.00  0.00           H  
HETATM   97  H   UNL     1     -13.260   8.755   0.496  1.00  0.00           H  
HETATM   98  H   UNL     1      -9.949   6.983   0.036  1.00  0.00           H  
HETATM   99  H   UNL     1     -10.667   8.582   0.347  1.00  0.00           H  
HETATM  100  H   UNL     1     -10.436   7.433   1.687  1.00  0.00           H  
HETATM  101  H   UNL     1     -12.713   3.103  -0.185  1.00  0.00           H  
HETATM  102  H   UNL     1      -8.959   3.249   0.353  1.00  0.00           H  
HETATM  103  H   UNL     1      -7.390   0.545   1.448  1.00  0.00           H  
HETATM  104  H   UNL     1      -7.393  -0.221  -0.158  1.00  0.00           H  
HETATM  105  H   UNL     1      -6.961   1.497   0.007  1.00  0.00           H  
HETATM  106  H   UNL     1     -11.929  -1.549  -0.369  1.00  0.00           H  
HETATM  107  H   UNL     1      -8.814  -3.775  -0.063  1.00  0.00           H  
HETATM  108  H   UNL     1     -13.053  -3.964  -0.674  1.00  0.00           H  
HETATM  109  H   UNL     1     -12.317  -7.019  -1.801  1.00  0.00           H  
HETATM  110  H   UNL     1     -11.920  -7.536  -0.145  1.00  0.00           H  
HETATM  111  H   UNL     1     -13.364  -6.539  -0.444  1.00  0.00           H  
HETATM  112  H   UNL     1      -7.586  -5.547  -0.102  1.00  0.00           H  
HETATM  113  H   UNL     1      -7.266  -8.276   0.549  1.00  0.00           H  
HETATM  114  H   UNL     1      -7.156  -8.105  -1.219  1.00  0.00           H  
HETATM  115  H   UNL     1      -5.358  -6.419  -0.944  1.00  0.00           H  
HETATM  116  H   UNL     1      -5.468  -6.590   0.824  1.00  0.00           H  
HETATM  117  H   UNL     1      -4.872  -8.989   0.628  1.00  0.00           H  
HETATM  118  H   UNL     1      -4.763  -8.818  -1.140  1.00  0.00           H  
HETATM  119  H   UNL     1      -2.390  -9.659  -0.178  1.00  0.00           H  
HETATM  120  H   UNL     1      -1.102  -6.067   0.261  1.00  0.00           H  
HETATM  121  H   UNL     1       0.249 -10.122  -0.059  1.00  0.00           H  
HETATM  122  H   UNL     1       3.156  -8.642  -0.766  1.00  0.00           H  
HETATM  123  H   UNL     1       3.288  -8.091   0.921  1.00  0.00           H  
HETATM  124  H   UNL     1       2.749  -9.750   0.566  1.00  0.00           H  
HETATM  125  H   UNL     1       0.274  -4.466   0.764  1.00  0.00           H  
HETATM  126  H   UNL     1       4.094  -4.255   0.420  1.00  0.00           H  
HETATM  127  H   UNL     1       0.620  -1.820   1.032  1.00  0.00           H  
HETATM  128  H   UNL     1       2.885   0.382   2.108  1.00  0.00           H  
HETATM  129  H   UNL     1       3.481   0.585   0.443  1.00  0.00           H  
HETATM  130  H   UNL     1       1.731   0.519   0.760  1.00  0.00           H  
HETATM  131  H   UNL     1       6.060  -3.391   0.229  1.00  0.00           H  
HETATM  132  H   UNL     1       7.312   0.233   0.475  1.00  0.00           H  
HETATM  133  H   UNL     1       8.663  -3.761  -0.299  1.00  0.00           H  
HETATM  134  H   UNL     1      11.218  -2.326  -1.640  1.00  0.00           H  
HETATM  135  H   UNL     1      11.787  -1.543  -0.147  1.00  0.00           H  
HETATM  136  H   UNL     1      11.283  -3.250  -0.120  1.00  0.00           H  
HETATM  137  H   UNL     1       8.682   1.896   0.543  1.00  0.00           H  
HETATM  138  H   UNL     1      12.465   2.138  -0.078  1.00  0.00           H  
HETATM  139  H   UNL     1       9.071   4.500   1.052  1.00  0.00           H  
HETATM  140  H   UNL     1      11.434   6.578   2.166  1.00  0.00           H  
HETATM  141  H   UNL     1      11.898   6.951   0.489  1.00  0.00           H  
HETATM  142  H   UNL     1      10.178   6.854   0.936  1.00  0.00           H  
HETATM  143  H   UNL     1      14.453   2.973  -0.140  1.00  0.00           H  
HETATM  144  H   UNL     1      16.135   5.158  -0.749  1.00  0.00           H  
HETATM  145  H   UNL     1      16.290   4.797   0.987  1.00  0.00           H  
HETATM  146  H   UNL     1      16.863   2.446   0.448  1.00  0.00           H  
HETATM  147  H   UNL     1      16.708   2.806  -1.288  1.00  0.00           H  
HETATM  148  H   UNL     1      20.885   4.104  -1.392  1.00  0.00           H  
HETATM  149  H   UNL     1      21.612   1.392  -0.196  1.00  0.00           H  
HETATM  150  H   UNL     1      21.457   1.753  -1.932  1.00  0.00           H  
HETATM  151  H   UNL     1      23.267   3.438  -1.744  1.00  0.00           H  
HETATM  152  H   UNL     1      23.422   3.077  -0.007  1.00  0.00           H  
HETATM  153  H   UNL     1      25.806   2.543  -0.683  1.00  0.00           H  
HETATM  154  H   UNL     1      26.069   1.175  -1.791  1.00  0.00           H  
HETATM  155  H   UNL     1      25.410   2.708  -2.410  1.00  0.00           H  
HETATM  156  H   UNL     1      23.045   0.159  -0.087  1.00  0.00           H  
HETATM  157  H   UNL     1      24.729  -0.270  -0.474  1.00  0.00           H  
HETATM  158  H   UNL     1      24.387   1.013   0.711  1.00  0.00           H  
HETATM  159  H   UNL     1      19.202   1.919  -0.783  1.00  0.00           H  
HETATM  160  H   UNL     1      21.040   3.743   0.344  1.00  0.00           H  
CONECT    1    3    3    2   94                                       
CONECT    2    1    4    4                                            
CONECT    3    1    1    5   90                                       
CONECT    4    2    2    5    7                                       
CONECT    5    3    4    6                                            
CONECT    6    5   91   92   93                                       
CONECT    7    4    9    8    8                                       
CONECT    8    7    7                                                 
CONECT    9    7   10   95                                            
CONECT   10    9   12   12   11                                       
CONECT   11   10   13   13   96                                       
CONECT   12   10   10   14   97                                       
CONECT   13   11   11   16   14                                       
CONECT   14   12   13   15                                            
CONECT   15   14  100   98   99                                       
CONECT   16   13   18   17   17                                       
CONECT   17   16   16                                                 
CONECT   18   16   19  101                                            
CONECT   19   18   20   21   21                                       
CONECT   20   19   22   22                                            
CONECT   21   19   19   23  102                                       
CONECT   22   20   20   25   23                                       
CONECT   23   21   22   24                                            
CONECT   24   23  103  104  105                                       
CONECT   25   22   27   26   26                                       
CONECT   26   25   25                                                 
CONECT   27   25   28  106                                            
CONECT   28   27   29   30   30                                       
CONECT   29   28   31   31  107                                       
CONECT   30   28   28   32  108                                       
CONECT   31   29   29   34   32                                       
CONECT   32   30   31   33                                            
CONECT   33   32  109  110  111                                       
CONECT   34   31   36   35   35                                       
CONECT   35   34   34                                                 
CONECT   36   34   37  112                                            
CONECT   37   36   38  113  114                                       
CONECT   38   37   39  115  116                                       
CONECT   39   38   40  117  118                                       
CONECT   40   39   42   41   41                                       
CONECT   41   40   40                                                 
CONECT   42   40   43  119                                            
CONECT   43   42   45   45   44                                       
CONECT   44   43   46   46  120                                       
CONECT   45   43   43   47  121                                       
CONECT   46   44   44   47   49                                       
CONECT   47   45   46   48                                            
CONECT   48   47  122  123  124                                       
CONECT   49   46   51   50   50                                       
CONECT   50   49   49                                                 
CONECT   51   49   52  125                                            
CONECT   52   51   53   54   54                                       
CONECT   53   52   55   55  126                                       
CONECT   54   52   52   56  127                                       
CONECT   55   53   53   56   58                                       
CONECT   56   54   55   57                                            
CONECT   57   56  128  129  130                                       
CONECT   58   55   60   59   59                                       
CONECT   59   58   58                                                 
CONECT   60   58   61  131                                            
CONECT   61   60   62   63   63                                       
CONECT   62   61   64   64  132                                       
CONECT   63   61   61   65  133                                       
CONECT   64   62   62   67   65                                       
CONECT   65   63   64   66                                            
CONECT   66   65  134  135  136                                       
CONECT   67   64   68   68   69                                       
CONECT   68   67   67                                                 
CONECT   69   67   70  137                                            
CONECT   70   69   71   72   72                                       
CONECT   71   70   73   73  138                                       
CONECT   72   70   70   74  139                                       
CONECT   73   71   71   74   76                                       
CONECT   74   72   73   75                                            
CONECT   75   74  140  141  142                                       
CONECT   76   73   78   77   77                                       
CONECT   77   76   76                                                 
CONECT   78   76   79  143                                            
CONECT   79   78   80  145  144                                       
CONECT   80   79   81  146  147                                       
CONECT   81   80   83   82   82                                       
CONECT   82   81   81                                                 
CONECT   83   81   84  159                                            
CONECT   84   83   85  148  160                                       
CONECT   85   84   86  149  150                                       
CONECT   86   85   87  151  152                                       
CONECT   87   86   88   89                                            
CONECT   88   87  153  154  155                                       
CONECT   89   87  156  157  158                                       
CONECT   90    3                                                      
CONECT   91    6                                                      
CONECT   92    6                                                      
CONECT   93    6                                                      
CONECT   94    1                                                      
CONECT   95    9                                                      
CONECT   96   11                                                      
CONECT   97   12                                                      
CONECT   98   15                                                      
CONECT   99   15                                                      
CONECT  100   15                                                      
CONECT  101   18                                                      
CONECT  102   21                                                      
CONECT  103   24                                                      
CONECT  104   24                                                      
CONECT  105   24                                                      
CONECT  106   27                                                      
CONECT  107   29                                                      
CONECT  108   30                                                      
CONECT  109   33                                                      
CONECT  110   33                                                      
CONECT  111   33                                                      
CONECT  112   36                                                      
CONECT  113   37                                                      
CONECT  114   37                                                      
CONECT  115   38                                                      
CONECT  116   38                                                      
CONECT  117   39                                                      
CONECT  118   39                                                      
CONECT  119   42                                                      
CONECT  120   44                                                      
CONECT  121   45                                                      
CONECT  122   48                                                      
CONECT  123   48                                                      
CONECT  124   48                                                      
CONECT  125   51                                                      
CONECT  126   53                                                      
CONECT  127   54                                                      
CONECT  128   57                                                      
CONECT  129   57                                                      
CONECT  130   57                                                      
CONECT  131   60                                                      
CONECT  132   62                                                      
CONECT  133   63                                                      
CONECT  134   66                                                      
CONECT  135   66                                                      
CONECT  136   66                                                      
CONECT  137   69                                                      
CONECT  138   71                                                      
CONECT  139   72                                                      
CONECT  140   75                                                      
CONECT  141   75                                                      
CONECT  142   75                                                      
CONECT  143   78                                                      
CONECT  144   79                                                      
CONECT  145   79                                                      
CONECT  146   80                                                      
CONECT  147   80                                                      
CONECT  148   84                                                      
CONECT  149   85                                                      
CONECT  150   85                                                      
CONECT  151   86                                                      
CONECT  152   86                                                      
CONECT  153   88                                                      
CONECT  154   88                                                      
CONECT  155   88                                                      
CONECT  156   89                                                      
CONECT  157   89                                                      
CONECT  158   89                                                      
CONECT  159   83                                                      
CONECT  160   84                                                      
MASTER        0    0    0    0    0    0    0    0  160    0  160    0
END
