COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      40.550  30.553   9.411  1.00  0.00           N  
HETATM    2  S   UNL     1      41.957  30.529   6.287  1.00  0.00           S  
HETATM    3 RU   UNL     1      45.253  24.010   2.165  1.00  0.00          Ru  
HETATM    4  C   UNL     1      42.528  29.049   7.025  1.00  0.00           C  
HETATM    5  N   UNL     1      42.453  29.505   9.440  1.00  0.00           N  
HETATM    6  C   UNL     1      41.731  30.459   9.985  1.00  0.00           C  
HETATM    7  O   UNL     1      42.129  31.211  10.862  1.00  0.00           O  
HETATM    8  C   UNL     1      41.762  28.868   8.323  1.00  0.00           C  
HETATM    9  C   UNL     1      40.427  29.666   8.274  1.00  0.00           C  
HETATM   10  C   UNL     1      40.359  30.481   7.016  1.00  0.00           C  
HETATM   11  C   UNL     1      44.054  29.149   7.252  1.00  0.00           C  
HETATM   12  C   UNL     1      44.803  27.927   6.689  1.00  0.00           C  
HETATM   13  C   UNL     1      45.016  28.020   5.169  1.00  0.00           C  
HETATM   14  C   UNL     1      46.347  27.355   4.728  1.00  0.00           C  
HETATM   15  C   UNL     1      46.142  25.860   4.422  1.00  0.00           C  
HETATM   16  O   UNL     1      45.676  25.146   5.271  1.00  0.00           O  
HETATM   17  C   UNL     1      47.249  23.589   1.709  1.00  0.00           C  
HETATM   18  C   UNL     1      46.877  24.672   1.004  1.00  0.00           C  
HETATM   19  C   UNL     1      46.477  25.652   1.714  1.00  0.00           C  
HETATM   20  C   UNL     1      46.779  25.240   3.114  1.00  0.00           C  
HETATM   21  C   UNL     1      47.236  23.958   2.981  1.00  0.00           C  
HETATM   22  C   UNL     1      43.588  23.563   3.293  1.00  0.00           C  
HETATM   23  C   UNL     1      43.882  22.494   2.562  1.00  0.00           C  
HETATM   24  C   UNL     1      43.874  22.740   1.292  1.00  0.00           C  
HETATM   25  C   UNL     1      43.419  24.057   1.197  1.00  0.00           C  
HETATM   26  C   UNL     1      43.226  24.448   2.403  1.00  0.00           C  
HETATM   27  H   UNL     1      39.824  31.165   9.724  1.00  0.00           H  
HETATM   28  H   UNL     1      42.305  28.225   6.331  1.00  0.00           H  
HETATM   29  H   UNL     1      43.367  29.247   9.753  1.00  0.00           H  
HETATM   30  H   UNL     1      41.565  27.803   8.518  1.00  0.00           H  
HETATM   31  H   UNL     1      39.565  28.989   8.363  1.00  0.00           H  
HETATM   32  H   UNL     1      40.030  31.503   7.255  1.00  0.00           H  
HETATM   33  H   UNL     1      39.646  30.021   6.315  1.00  0.00           H  
HETATM   34  H   UNL     1      44.428  30.055   6.754  1.00  0.00           H  
HETATM   35  H   UNL     1      44.248  29.218   8.333  1.00  0.00           H  
HETATM   36  H   UNL     1      45.785  27.857   7.180  1.00  0.00           H  
HETATM   37  H   UNL     1      44.218  27.022   6.909  1.00  0.00           H  
HETATM   38  H   UNL     1      44.181  27.515   4.662  1.00  0.00           H  
HETATM   39  H   UNL     1      45.035  29.080   4.877  1.00  0.00           H  
HETATM   40  H   UNL     1      46.719  27.860   3.824  1.00  0.00           H  
HETATM   41  H   UNL     1      47.086  27.459   5.536  1.00  0.00           H  
HETATM   42  H   UNL     1      43.442  24.663   0.279  1.00  0.00           H  
CONECT    1    6    9   27                                            
CONECT    2    4   10                                                 
CONECT    3   17   18   19   20                                       
CONECT    3   21   22   23   24                                       
CONECT    3   25   26                                                 
CONECT    4    2    8   11   28                                       
CONECT    5    6    8   29                                            
CONECT    6    1    5    7    7                                       
CONECT    7    6    6                                                 
CONECT    8    4    5    9   30                                       
CONECT    9    1    8   10   31                                       
CONECT   10    2    9   32   33                                       
CONECT   11    4   12   34   35                                       
CONECT   12   11   13   36   37                                       
CONECT   13   12   14   38   39                                       
CONECT   14   13   15   40   41                                       
CONECT   15   14   16   16   20                                       
CONECT   16   15   15                                                 
CONECT   17   18   21   21    3                                       
CONECT   18   17   19   19    3                                       
CONECT   19   18   18   20    3                                       
CONECT   20   15   19   21    3                                       
CONECT   21   17   17   20    3                                       
CONECT   22   23   26   26    3                                       
CONECT   23   22   24   24    3                                       
CONECT   24   23   23   25    3                                       
CONECT   25   24   26    3   42                                       
CONECT   26   22   22   25    3                                       
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   25                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
