COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.084  -0.174  -0.869  1.00  0.00           N  
HETATM    2  C   UNL     1       5.219   0.794  -0.183  1.00  0.00           C  
HETATM    3  C   UNL     1       3.804   0.276  -0.162  1.00  0.00           C  
HETATM    4  O   UNL     1       3.588  -0.906  -0.325  1.00  0.00           O  
HETATM    5  C   UNL     1       5.711   0.990   1.253  1.00  0.00           C  
HETATM    6  C   UNL     1       0.285  -3.353  -0.328  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.459  -0.636   1.291  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.221   0.149   0.444  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.083  -0.617   1.205  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.224   0.989  -0.595  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.668  -2.190  -0.224  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.605   0.961  -0.499  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.454   0.193   0.255  1.00  0.00           C  
HETATM   14  C   UNL     1       1.475   0.650   0.057  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.165  -0.875  -0.060  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.982   0.217   0.160  1.00  0.00           C  
HETATM   17  N   UNL     1       1.137  -0.587  -0.107  1.00  0.00           N  
HETATM   18  N   UNL     1       2.778   1.127   0.038  1.00  0.00           N  
HETATM   19  O   UNL     1      -1.865  -2.380  -0.280  1.00  0.00           O  
HETATM   20  O   UNL     1      -5.359   1.730  -1.329  1.00  0.00           O  
HETATM   21  S   UNL     1       0.042   1.643   0.299  1.00  0.00           S  
HETATM   22  H   UNL     1       6.073  -1.067  -0.398  1.00  0.00           H  
HETATM   23  H   UNL     1       5.820  -0.273  -1.838  1.00  0.00           H  
HETATM   24  H   UNL     1       5.249   1.747  -0.710  1.00  0.00           H  
HETATM   25  H   UNL     1       6.735   1.364   1.238  1.00  0.00           H  
HETATM   26  H   UNL     1       5.069   1.708   1.762  1.00  0.00           H  
HETATM   27  H   UNL     1       5.681   0.037   1.781  1.00  0.00           H  
HETATM   28  H   UNL     1       1.311  -2.990  -0.257  1.00  0.00           H  
HETATM   29  H   UNL     1       0.092  -4.055   0.483  1.00  0.00           H  
HETATM   30  H   UNL     1       0.143  -3.855  -1.285  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.944  -1.262   2.026  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.298   0.130   0.516  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.491  -1.227   1.871  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.745   1.617  -1.331  1.00  0.00           H  
HETATM   35  H   UNL     1       2.950   2.072   0.169  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.550   2.612  -0.982  1.00  0.00           H  
CONECT    1    2   22   23                                            
CONECT    2    3    5    1   24                                       
CONECT    3    4    4   18    2                                       
CONECT    4    3    3                                                 
CONECT    5    2   25   26   27                                       
CONECT    6   11   28   29   30                                       
CONECT    7    8    9    9   31                                       
CONECT    8   12   12    7   32                                       
CONECT    9    7    7   13   33                                       
CONECT   10   12   13   13   34                                       
CONECT   11    6   15   19   19                                       
CONECT   12   20    8    8   10                                       
CONECT   13   10   10    9   16                                       
CONECT   14   21   17   17   18                                       
CONECT   15   16   16   11   17                                       
CONECT   16   13   15   15   21                                       
CONECT   17   15   14   14                                            
CONECT   18   14    3   35                                            
CONECT   19   11   11                                                 
CONECT   20   12   36                                                 
CONECT   21   16   14                                                 
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    5                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   18                                                      
CONECT   36   20                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
