COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      20.717  16.050  16.804  1.00  0.00           N  
HETATM    2  C   UNL     1      19.967  16.595  16.116  1.00  0.00           C  
HETATM    3  C   UNL     1      19.005  17.226  15.274  1.00  0.00           C  
HETATM    4  C   UNL     1      17.697  16.557  15.036  1.00  0.00           C  
HETATM    5  C   UNL     1      16.777  17.134  14.247  1.00  0.00           C  
HETATM    6  C   UNL     1      19.300  18.404  14.724  1.00  0.00           C  
HETATM    7  C   UNL     1      18.328  19.051  13.861  1.00  0.00           C  
HETATM    8  C   UNL     1      17.084  18.435  13.623  1.00  0.00           C  
HETATM    9  C   UNL     1      17.731  20.858  12.498  1.00  0.00           C  
HETATM   10  C   UNL     1      16.462  20.231  12.255  1.00  0.00           C  
HETATM   11  C   UNL     1      18.040  22.090  11.916  1.00  0.00           C  
HETATM   12  C   UNL     1      19.213  22.741  12.100  1.00  0.00           C  
HETATM   13  C   UNL     1      19.475  24.064  11.443  1.00  0.00           C  
HETATM   14  C   UNL     1      18.541  24.615  10.660  1.00  0.00           C  
HETATM   15  C   UNL     1      17.091  22.664  11.114  1.00  0.00           C  
HETATM   16  C   UNL     1      15.853  22.048  10.876  1.00  0.00           C  
HETATM   17  C   UNL     1      15.520  20.840  11.435  1.00  0.00           C  
HETATM   18  C   UNL     1      13.664  22.193   9.729  1.00  0.00           C  
HETATM   19  C   UNL     1      13.338  21.016  10.263  1.00  0.00           C  
HETATM   20  C   UNL     1      14.306  20.310  11.160  1.00  0.00           C  
HETATM   21  C   UNL     1      12.943  25.596   8.887  1.00  0.00           C  
HETATM   22  C   UNL     1      11.984  25.864   7.991  1.00  0.00           C  
HETATM   23  C   UNL     1      14.287  24.630   7.073  1.00  0.00           C  
HETATM   24  C   UNL     1      13.227  24.939   6.151  1.00  0.00           C  
HETATM   25  C   UNL     1      13.446  24.564   4.729  1.00  0.00           C  
HETATM   26  C   UNL     1      14.610  23.958   4.356  1.00  0.00           C  
HETATM   27  C   UNL     1      15.683  23.657   5.344  1.00  0.00           C  
HETATM   28  C   UNL     1      17.816  22.815   6.056  1.00  0.00           C  
HETATM   29  C   UNL     1      17.631  23.155   7.343  1.00  0.00           C  
HETATM   30  C   UNL     1      15.433  24.038   6.708  1.00  0.00           C  
HETATM   31  C   UNL     1      14.270  24.574  12.130  1.00  0.00           C  
HETATM   32  C   UNL     1      13.907  25.304  13.192  1.00  0.00           C  
HETATM   33  C   UNL     1      14.971  27.295  12.370  1.00  0.00           C  
HETATM   34  C   UNL     1      15.386  26.555  11.212  1.00  0.00           C  
HETATM   35  C   UNL     1      15.373  28.724  12.432  1.00  0.00           C  
HETATM   36  C   UNL     1      16.105  29.271  11.419  1.00  0.00           C  
HETATM   37  C   UNL     1      16.512  28.463  10.235  1.00  0.00           C  
HETATM   38  C   UNL     1      16.103  27.087  10.212  1.00  0.00           C  
HETATM   39  C   UNL     1      17.577  28.103   8.111  1.00  0.00           C  
HETATM   40  C   UNL     1      17.219  26.808   8.046  1.00  0.00           C  
HETATM   41  C   UNL     1      17.455  15.288  15.673  1.00  0.00           C  
HETATM   42  N   UNL     1      18.625  20.241  13.300  1.00  0.00           N  
HETATM   43  N   UNL     1      16.180  19.040  12.825  1.00  0.00           N  
HETATM   44  N   UNL     1      17.349  23.888  10.490  1.00  0.00           N  
HETATM   45  N   UNL     1      14.949  22.685  10.025  1.00  0.00           N  
HETATM   46  N   UNL     1      14.109  24.977   8.405  1.00  0.00           N  
HETATM   47  N   UNL     1      12.151  25.518   6.598  1.00  0.00           N  
HETATM   48  N   UNL     1      16.812  23.083   5.053  1.00  0.00           N  
HETATM   49  N   UNL     1      16.398  23.753   7.678  1.00  0.00           N  
HETATM   50  N   UNL     1      15.016  25.228  11.132  1.00  0.00           N  
HETATM   51  N   UNL     1      14.277  26.696  13.291  1.00  0.00           N  
HETATM   52  N   UNL     1      16.456  26.295   9.124  1.00  0.00           N  
HETATM   53  N   UNL     1      17.205  28.929   9.240  1.00  0.00           N  
HETATM   54  N   UNL     1      17.169  14.269  16.138  1.00  0.00           N  
HETATM   55 RU   UNL     1      15.728  24.433   9.447  1.00  0.00          Ru  
HETATM   56  H   UNL     1      15.826  16.653  14.072  1.00  0.00           H  
HETATM   57  H   UNL     1      20.253  18.873  14.919  1.00  0.00           H  
HETATM   58  H   UNL     1      19.972  22.301  12.730  1.00  0.00           H  
HETATM   59  H   UNL     1      20.416  24.570  11.602  1.00  0.00           H  
HETATM   60  H   UNL     1      18.695  25.571  10.182  1.00  0.00           H  
HETATM   61  H   UNL     1      12.977  22.741   9.101  1.00  0.00           H  
HETATM   62  H   UNL     1      12.377  20.572  10.049  1.00  0.00           H  
HETATM   63  H   UNL     1      14.031  19.361  11.595  1.00  0.00           H  
HETATM   64  H   UNL     1      12.826  25.844   9.932  1.00  0.00           H  
HETATM   65  H   UNL     1      11.073  26.346   8.314  1.00  0.00           H  
HETATM   66  H   UNL     1      12.684  24.771   3.992  1.00  0.00           H  
HETATM   67  H   UNL     1      14.757  23.690   3.320  1.00  0.00           H  
HETATM   68  H   UNL     1      18.736  22.330   5.765  1.00  0.00           H  
HETATM   69  H   UNL     1      18.393  22.978   8.088  1.00  0.00           H  
HETATM   70  H   UNL     1      14.003  23.531  12.043  1.00  0.00           H  
HETATM   71  H   UNL     1      13.331  24.847  13.983  1.00  0.00           H  
HETATM   72  H   UNL     1      15.086  29.330  13.279  1.00  0.00           H  
HETATM   73  H   UNL     1      16.395  30.310  11.476  1.00  0.00           H  
HETATM   74  H   UNL     1      18.153  28.535   7.306  1.00  0.00           H  
HETATM   75  H   UNL     1      17.501  26.187   7.209  1.00  0.00           H  
CONECT    1    2    2    2                                            
CONECT    2    3    1    1    1                                       
CONECT    3    6    6    4    2                                       
CONECT    4    5    5    3   41                                       
CONECT    5    8    4    4   56                                       
CONECT    6    7    3    3   57                                       
CONECT    7   42   42    8    6                                       
CONECT    8   43   43    7    5                                       
CONECT    9   11   11   10   42                                       
CONECT   10   17   17    9   43                                       
CONECT   11   15   12    9    9                                       
CONECT   12   13   13   11   58                                       
CONECT   13   14   12   12   59                                       
CONECT   14   44   44   13   60                                       
CONECT   15   44   16   16   11                                       
CONECT   16   45   15   15   17                                       
CONECT   17   16   20   10   10                                       
CONECT   18   45   45   19   61                                       
CONECT   19   18   20   20   62                                       
CONECT   20   19   19   17   63                                       
CONECT   21   22   22   46   64                                       
CONECT   22   47   21   21   65                                       
CONECT   23   24   30   46   46                                       
CONECT   24   25   47   47   23                                       
CONECT   25   26   26   24   66                                       
CONECT   26   25   25   27   67                                       
CONECT   27   26   48   48   30                                       
CONECT   28   48   29   29   68                                       
CONECT   29   28   28   49   69                                       
CONECT   30   27   23   49   49                                       
CONECT   31   50   32   32   70                                       
CONECT   32   31   31   51   71                                       
CONECT   33   34   35   51   51                                       
CONECT   34   38   50   50   33                                       
CONECT   35   36   36   33   72                                       
CONECT   36   37   35   35   73                                       
CONECT   37   53   53   38   36                                       
CONECT   38   52   52   37   34                                       
CONECT   39   40   40   53   74                                       
CONECT   40   39   39   52   75                                       
CONECT   41    4   54   54   54                                       
CONECT   42    9    7    7                                            
CONECT   43   10    8    8                                            
CONECT   44   55   14   14   15                                       
CONECT   45   55   18   18   16                                       
CONECT   46   23   23   21   55                                       
CONECT   47   24   24   22                                            
CONECT   48   27   27   28                                            
CONECT   49   30   30   29   55                                       
CONECT   50   55   34   34   31                                       
CONECT   51   33   33   32                                            
CONECT   52   40   55   38   38                                       
CONECT   53   39   37   37                                            
CONECT   54   41   41   41                                            
CONECT   55   49   46   52   45                                       
CONECT   55   44   50                                                 
CONECT   56    5                                                      
CONECT   57    6                                                      
CONECT   58   12                                                      
CONECT   59   13                                                      
CONECT   60   14                                                      
CONECT   61   18                                                      
CONECT   62   19                                                      
CONECT   63   20                                                      
CONECT   64   21                                                      
CONECT   65   22                                                      
CONECT   66   25                                                      
CONECT   67   26                                                      
CONECT   68   28                                                      
CONECT   69   29                                                      
CONECT   70   31                                                      
CONECT   71   32                                                      
CONECT   72   35                                                      
CONECT   73   36                                                      
CONECT   74   39                                                      
CONECT   75   40                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
