COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      75.940  30.738   5.551  1.00  0.00           N  
HETATM    2  N   UNL     1      77.885  31.820   7.192  1.00  0.00           N  
HETATM    3  C   UNL     1      75.289  33.178   8.972  1.00  0.00           C  
HETATM    4  C   UNL     1      76.280  27.451   7.488  1.00  0.00           C  
HETATM    5  C   UNL     1      74.935  27.638   8.207  1.00  0.00           C  
HETATM    6  C   UNL     1      73.408  29.615   9.349  1.00  0.00           C  
HETATM    7  C   UNL     1      73.516  27.885  12.513  1.00  0.00           C  
HETATM    8 RU   UNL     1      76.129  30.704   7.656  1.00  0.00          Ru  
HETATM    9  S   UNL     1      74.318  29.319   7.854  1.00  0.00           S  
HETATM   10  S   UNL     1      76.573  30.847   9.902  1.00  0.00           S  
HETATM   11  S   UNL     1      77.416  28.833   7.584  1.00  0.00           S  
HETATM   12  F   UNL     1      80.785  33.513   8.297  1.00  0.00           F  
HETATM   13  S   UNL     1      75.534  34.078  10.237  1.00  0.00           S  
HETATM   14  O   UNL     1      81.077  33.988   3.158  1.00  0.00           O  
HETATM   15  O   UNL     1      77.758  32.115   0.630  1.00  0.00           O  
HETATM   16  O   UNL     1      73.530  29.539   0.694  1.00  0.00           O  
HETATM   17  N   UNL     1      75.099  32.405   7.894  1.00  0.00           N  
HETATM   18  N   UNL     1      73.205  29.234  11.848  1.00  0.00           N  
HETATM   19  N   UNL     1      79.550  33.150   1.623  1.00  0.00           N  
HETATM   20  C   UNL     1      80.044  33.197   6.063  1.00  0.00           C  
HETATM   21  C   UNL     1      79.093  32.665   5.220  1.00  0.00           C  
HETATM   22  C   UNL     1      79.057  32.723   3.819  1.00  0.00           C  
HETATM   23  C   UNL     1      80.023  33.361   2.897  1.00  0.00           C  
HETATM   24  C   UNL     1      78.370  32.433   1.639  1.00  0.00           C  
HETATM   25  C   UNL     1      78.078  32.176   3.040  1.00  0.00           C  
HETATM   26  C   UNL     1      77.001  31.483   3.658  1.00  0.00           C  
HETATM   27  C   UNL     1      75.851  30.809   3.222  1.00  0.00           C  
HETATM   28  C   UNL     1      75.341  30.563   2.030  1.00  0.00           C  
HETATM   29  C   UNL     1      74.170  29.861   1.883  1.00  0.00           C  
HETATM   30  C   UNL     1      73.526  29.409   2.990  1.00  0.00           C  
HETATM   31  C   UNL     1      74.048  29.651   4.325  1.00  0.00           C  
HETATM   32  C   UNL     1      75.218  30.358   4.440  1.00  0.00           C  
HETATM   33  C   UNL     1      77.016  31.414   5.034  1.00  0.00           C  
HETATM   34  C   UNL     1      78.021  31.978   5.833  1.00  0.00           C  
HETATM   35  C   UNL     1      74.132  29.556  10.681  1.00  0.00           C  
HETATM   36  C   UNL     1      75.133  30.683  10.968  1.00  0.00           C  
HETATM   37  C   UNL     1      77.570  29.300  10.324  1.00  0.00           C  
HETATM   38  C   UNL     1      78.167  28.688   9.237  1.00  0.00           C  
HETATM   39  C   UNL     1      74.280  29.890  -0.547  1.00  0.00           C  
HETATM   40  C   UNL     1      78.853  32.356   7.995  1.00  0.00           C  
HETATM   41  C   UNL     1      79.872  33.007   7.457  1.00  0.00           C  
HETATM   42  H   UNL     1      74.903  34.049   8.422  1.00  0.00           H  
HETATM   43  H   UNL     1      74.459  32.672   9.487  1.00  0.00           H  
HETATM   44  H   UNL     1      76.071  27.260   6.425  1.00  0.00           H  
HETATM   45  H   UNL     1      76.778  26.574   7.927  1.00  0.00           H  
HETATM   46  H   UNL     1      74.212  26.893   7.842  1.00  0.00           H  
HETATM   47  H   UNL     1      75.073  27.514   9.291  1.00  0.00           H  
HETATM   48  H   UNL     1      72.971  30.621   9.265  1.00  0.00           H  
HETATM   49  H   UNL     1      72.602  28.867   9.388  1.00  0.00           H  
HETATM   50  H   UNL     1      72.815  27.714  13.343  1.00  0.00           H  
HETATM   51  H   UNL     1      73.411  27.078  11.773  1.00  0.00           H  
HETATM   52  H   UNL     1      74.546  27.896  12.900  1.00  0.00           H  
HETATM   53  H   UNL     1      74.360  34.603  10.427  1.00  0.00           H  
HETATM   54  H   UNL     1      73.296  29.955  12.535  1.00  0.00           H  
HETATM   55  H   UNL     1      80.002  33.474   0.792  1.00  0.00           H  
HETATM   56  H   UNL     1      80.892  33.741   5.674  1.00  0.00           H  
HETATM   57  H   UNL     1      75.856  30.922   1.151  1.00  0.00           H  
HETATM   58  H   UNL     1      72.605  28.857   2.876  1.00  0.00           H  
HETATM   59  H   UNL     1      73.531  29.285   5.200  1.00  0.00           H  
HETATM   60  H   UNL     1      74.766  28.661  10.596  1.00  0.00           H  
HETATM   61  H   UNL     1      75.504  30.535  11.993  1.00  0.00           H  
HETATM   62  H   UNL     1      74.578  31.631  10.912  1.00  0.00           H  
HETATM   63  H   UNL     1      76.893  28.574  10.798  1.00  0.00           H  
HETATM   64  H   UNL     1      78.360  29.584  11.035  1.00  0.00           H  
HETATM   65  H   UNL     1      78.222  27.614   9.468  1.00  0.00           H  
HETATM   66  H   UNL     1      79.185  29.099   9.161  1.00  0.00           H  
HETATM   67  H   UNL     1      73.691  29.596  -1.428  1.00  0.00           H  
HETATM   68  H   UNL     1      74.460  30.975  -0.572  1.00  0.00           H  
HETATM   69  H   UNL     1      75.243  29.358  -0.556  1.00  0.00           H  
HETATM   70  H   UNL     1      78.786  32.248   9.068  1.00  0.00           H  
CONECT    1   32   33    8                                            
CONECT    2   34    8   40   40                                       
CONECT    3   17   13   42   43                                       
CONECT    4   11    5   44   45                                       
CONECT    5    4    9   46   47                                       
CONECT    6    9   35   48   49                                       
CONECT    7   18   50   51   52                                       
CONECT    8    1    2   11    9                                       
CONECT    8   17   10                                                 
CONECT    9    8    5    6                                            
CONECT   10    8   37   36                                            
CONECT   11    4    8   38                                            
CONECT   12   41                                                      
CONECT   13    3   53                                                 
CONECT   14   23   23                                                 
CONECT   15   24   24                                                 
CONECT   16   39   29                                                 
CONECT   17    8    3                                                 
CONECT   18   35    7   54                                            
CONECT   19   24   23   55                                            
CONECT   20   21   41   41   56                                       
CONECT   21   22   22   34   20                                       
CONECT   22   23   25   21   21                                       
CONECT   23   19   14   14   22                                       
CONECT   24   15   15   19   25                                       
CONECT   25   24   26   26   22                                       
CONECT   26   25   25   27   33                                       
CONECT   27   28   26   32   32                                       
CONECT   28   29   29   27   57                                       
CONECT   29   16   28   28   30                                       
CONECT   30   29   31   31   58                                       
CONECT   31   30   30   32   59                                       
CONECT   32   27   27   31    1                                       
CONECT   33   26    1   34   34                                       
CONECT   34   33   33   21    2                                       
CONECT   35    6   36   18   60                                       
CONECT   36   10   35   61   62                                       
CONECT   37   38   10   63   64                                       
CONECT   38   11   37   65   66                                       
CONECT   39   16   67   68   69                                       
CONECT   40    2    2   41   70                                       
CONECT   41   20   20   40   12                                       
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    5                                                      
CONECT   48    6                                                      
CONECT   49    6                                                      
CONECT   50    7                                                      
CONECT   51    7                                                      
CONECT   52    7                                                      
CONECT   53   13                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   28                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
CONECT   60   35                                                      
CONECT   61   36                                                      
CONECT   62   36                                                      
CONECT   63   37                                                      
CONECT   64   37                                                      
CONECT   65   38                                                      
CONECT   66   38                                                      
CONECT   67   39                                                      
CONECT   68   39                                                      
CONECT   69   39                                                      
CONECT   70   40                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
