COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.483   2.979  -0.129  1.00  0.00           O  
HETATM    2  C   UNL     1       1.278   1.567  -0.217  1.00  0.00           C  
HETATM    3  C   UNL     1       2.633   0.870  -0.241  1.00  0.00           C  
HETATM    4  O   UNL     1       3.354   1.258  -1.411  1.00  0.00           O  
HETATM    5  C   UNL     1       0.424   1.119   0.958  1.00  0.00           C  
HETATM    6  C   UNL     1       0.565  -0.356   1.308  1.00  0.00           C  
HETATM    7  O   UNL     1       1.758  -0.998   0.966  1.00  0.00           O  
HETATM    8  C   UNL     1       2.390  -0.645  -0.260  1.00  0.00           C  
HETATM    9  C   UNL     1       3.724  -1.382  -0.386  1.00  0.00           C  
HETATM   10  O   UNL     1       3.483  -2.784  -0.520  1.00  0.00           O  
HETATM   11  N   UNL     1      -0.977   1.410   0.664  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.782   0.430   0.415  1.00  0.00           C  
HETATM   13  S   UNL     1      -0.869  -1.091   0.452  1.00  0.00           S  
HETATM   14  N   UNL     1      -3.129   0.547   0.163  1.00  0.00           N  
HETATM   15  C   UNL     1      -3.931  -0.649  -0.105  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.364  -0.250  -0.348  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.968  -0.616  -1.451  1.00  0.00           C  
HETATM   18  H   UNL     1       1.987   3.350  -0.866  1.00  0.00           H  
HETATM   19  H   UNL     1       0.748   1.344  -1.143  1.00  0.00           H  
HETATM   20  H   UNL     1       3.202   1.141   0.649  1.00  0.00           H  
HETATM   21  H   UNL     1       4.227   0.849  -1.489  1.00  0.00           H  
HETATM   22  H   UNL     1       0.707   1.707   1.832  1.00  0.00           H  
HETATM   23  H   UNL     1       0.405  -0.473   2.380  1.00  0.00           H  
HETATM   24  H   UNL     1       1.743  -0.904  -1.097  1.00  0.00           H  
HETATM   25  H   UNL     1       4.258  -1.019  -1.265  1.00  0.00           H  
HETATM   26  H   UNL     1       4.326  -1.200   0.505  1.00  0.00           H  
HETATM   27  H   UNL     1       4.286  -3.315  -0.605  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.548   1.422   0.162  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.541  -1.158  -0.987  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.881  -1.320   0.752  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.892   0.338   0.387  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.439  -1.204  -2.187  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.995  -0.330  -1.625  1.00  0.00           H  
CONECT    1    2   18                                                 
CONECT    2    1    3    5   19                                       
CONECT    3    2    4    8   20                                       
CONECT    4    3   21                                                 
CONECT    5    2    6   11   22                                       
CONECT    6    5    7   13   23                                       
CONECT    7    6    8                                                 
CONECT    8    3    7    9   24                                       
CONECT    9    8   10   25   26                                       
CONECT   10    9   27                                                 
CONECT   11    5   12   12                                            
CONECT   12   11   11   13   14                                       
CONECT   13    6   12                                                 
CONECT   14   12   15   28                                            
CONECT   15   14   16   29   30                                       
CONECT   16   15   17   17   31                                       
CONECT   17   16   16   32   33                                       
CONECT   18    1                                                      
CONECT   19    2                                                      
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26    9                                                      
CONECT   27   10                                                      
CONECT   28   14                                                      
CONECT   29   15                                                      
CONECT   30   15                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   17                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
