COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      43.119  11.505  65.194  1.00  0.00           C  
HETATM    2  C   UNL     1      43.539  12.047  63.857  1.00  0.00           C  
HETATM    3  C   UNL     1      44.096  13.319  63.756  1.00  0.00           C  
HETATM    4  C   UNL     1      44.489  13.820  62.519  1.00  0.00           C  
HETATM    5  N   UNL     1      43.374  11.283  62.759  1.00  0.00           N1+
HETATM    6  C   UNL     1      43.763  11.761  61.512  1.00  0.00           C  
HETATM    7  C   UNL     1      44.319  13.032  61.391  1.00  0.00           C  
HETATM    8  C   UNL     1      43.586  10.956  60.387  1.00  0.00           C  
HETATM    9  C   UNL     1      43.974  11.445  59.145  1.00  0.00           C  
HETATM   10  C   UNL     1      44.529  12.711  59.023  1.00  0.00           C  
HETATM   11  C   UNL     1      44.704  13.506  60.148  1.00  0.00           C  
HETATM   12  N   UNL     1      43.035   9.713  60.512  1.00  0.00           N  
HETATM   13  C   UNL     1      42.867   8.934  59.411  1.00  0.00           C  
HETATM   14  C   UNL     1      42.270   7.556  59.513  1.00  0.00           C  
HETATM   15  C   UNL     1      43.244   9.398  58.160  1.00  0.00           C  
HETATM   16  C   UNL     1      43.802  10.660  58.022  1.00  0.00           C  
HETATM   17 PT   UNL     1      42.261   9.550  61.979  1.00  0.00          Pt  
HETATM   18  C   UNL     1      44.939   8.085  62.232  1.00  0.00           C  
HETATM   19  C   UNL     1      39.439  10.816  61.751  1.00  0.00           C  
HETATM   20  C   UNL     1      40.025  10.410  60.434  1.00  0.00           C  
HETATM   21  H   UNL     1      43.963  10.971  65.655  1.00  0.00           H  
HETATM   22  H   UNL     1      42.810  12.336  65.846  1.00  0.00           H  
HETATM   23  H   UNL     1      42.276  10.811  65.060  1.00  0.00           H  
HETATM   24  H   UNL     1      44.224  13.921  64.644  1.00  0.00           H  
HETATM   25  H   UNL     1      44.920  14.807  62.439  1.00  0.00           H  
HETATM   26  H   UNL     1      44.825  13.079  58.052  1.00  0.00           H  
HETATM   27  H   UNL     1      45.139  14.490  60.054  1.00  0.00           H  
HETATM   28  H   UNL     1      42.026   7.338  60.563  1.00  0.00           H  
HETATM   29  H   UNL     1      41.354   7.508  58.906  1.00  0.00           H  
HETATM   30  H   UNL     1      42.994   6.815  59.144  1.00  0.00           H  
HETATM   31  H   UNL     1      43.103   8.774  57.290  1.00  0.00           H  
HETATM   32  H   UNL     1      44.795  10.525  57.569  1.00  0.00           H  
HETATM   33  H   UNL     1      43.157  11.223  57.331  1.00  0.00           H  
HETATM   34  H   UNL     1      45.029   7.655  63.241  1.00  0.00           H  
HETATM   35  H   UNL     1      44.988   7.279  61.485  1.00  0.00           H  
HETATM   36  H   UNL     1      45.762   8.794  62.061  1.00  0.00           H  
HETATM   37  N   UNL     1       0.000   0.000   0.000  1.00  0.00           N  
HETATM   38  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
HETATM   39  H   UNL     1       0.000   0.000   0.000  1.00  0.00           H  
CONECT    1    2   21   22   23                                       
CONECT    2    5    5    3    1                                       
CONECT    3    4    4    2   24                                       
CONECT    4    7    3    3   25                                       
CONECT    5    6   17    2    2                                       
CONECT    6    8    8    7    5                                       
CONECT    7   11   11    6    4                                       
CONECT    8    9   12    6    6                                       
CONECT    9   16   10   10    8                                       
CONECT   10    9    9   11   26                                       
CONECT   11   10    7    7   27                                       
CONECT   12   13    8   17                                            
CONECT   13   15   15   14   12                                       
CONECT   14   13   28   29   30                                       
CONECT   15   16   13   13   31                                       
CONECT   16   15    9   32   33                                       
CONECT   17   12    5   20   19                                       
CONECT   17   18   37                                                 
CONECT   18   34   35   36   17                                       
CONECT   19   20   20   17                                            
CONECT   20   19   19   17                                            
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26   10                                                      
CONECT   27   11                                                      
CONECT   28   14                                                      
CONECT   29   14                                                      
CONECT   30   14                                                      
CONECT   31   15                                                      
CONECT   32   16                                                      
CONECT   33   16                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   18                                                      
CONECT   37   17   38   39                                            
CONECT   38   37                                                      
CONECT   39   37                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
