COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK     1       4.521  -0.239  -0.740  1.00  0.00           N  
HETATM    2  C   UNK     1       3.368   0.670  -0.679  1.00  0.00           C  
HETATM    3  C   UNK     1       2.262   0.035   0.166  1.00  0.00           C  
HETATM    4  O   UNK     1       1.781  -1.142  -0.486  1.00  0.00           O  
HETATM    5  S   UNK     1       0.672  -1.860   0.270  1.00  0.00           S  
HETATM    6  O   UNK     1       0.459  -3.092  -0.405  1.00  0.00           O  
HETATM    7  O   UNK     1       1.007  -1.776   1.648  1.00  0.00           O  
HETATM    8  C   UNK     1       3.790   1.975  -0.054  1.00  0.00           C  
HETATM    9  O   UNK     1       4.792   2.026   0.620  1.00  0.00           O  
HETATM   10  O   UNK     1       3.054   3.081  -0.248  1.00  0.00           O  
HETATM   11  H   UNK     1       5.240   0.129  -1.345  1.00  0.00           H  
HETATM   12  H   UNK     1       4.885  -0.424   0.183  1.00  0.00           H  
HETATM   13  H   UNK     1       2.996   0.853  -1.687  1.00  0.00           H  
HETATM   14  H   UNK     1       2.660  -0.230   1.146  1.00  0.00           H  
HETATM   15  H   UNK     1       1.444   0.744   0.285  1.00  0.00           H  
HETATM   16  H   UNK     1       3.365   3.894   0.173  1.00  0.00           H  
HETATM   17  C   UNK     1      -0.800  -0.915   0.057  1.00  0.00           C  
HETATM   18  C   UNK     1      -1.640  -1.174  -1.010  1.00  0.00           C  
HETATM   19  C   UNK     1      -2.795  -0.433  -1.176  1.00  0.00           C  
HETATM   20  C   UNK     1      -3.109   0.568  -0.276  1.00  0.00           C  
HETATM   21  C   UNK     1      -2.270   0.827   0.791  1.00  0.00           C  
HETATM   22  C   UNK     1      -1.117   0.083   0.960  1.00  0.00           C  
HETATM   23  C   UNK     1      -4.368   1.377  -0.459  1.00  0.00           C  
HETATM   24  C   UNK     1      -5.522   0.699   0.283  1.00  0.00           C  
HETATM   25  N   UNK     1      -6.748   1.487   0.105  1.00  0.00           N  
HETATM   26  H   UNK     1      -1.394  -1.956  -1.713  1.00  0.00           H  
HETATM   27  H   UNK     1      -3.450  -0.635  -2.010  1.00  0.00           H  
HETATM   28  H   UNK     1      -2.516   1.609   1.494  1.00  0.00           H  
HETATM   29  H   UNK     1      -0.461   0.285   1.794  1.00  0.00           H  
HETATM   30  H   UNK     1      -4.217   2.379  -0.057  1.00  0.00           H  
HETATM   31  H   UNK     1      -4.607   1.443  -1.520  1.00  0.00           H  
HETATM   32  H   UNK     1      -5.673  -0.303  -0.119  1.00  0.00           H  
HETATM   33  H   UNK     1      -5.283   0.633   1.344  1.00  0.00           H  
HETATM   34  H   UNK     1      -7.526   1.060   0.586  1.00  0.00           H  
HETATM   35  H   UNK     1      -6.614   2.440   0.410  1.00  0.00           H  
CONECT    1    2   11   12                                            
CONECT    2    8    1    3   13                                       
CONECT    3    2    4   14   15                                       
CONECT    4    3    5                                                 
CONECT    5    4    6    6    7                                       
CONECT    5    7   17                                                 
CONECT    6    5    5                                                 
CONECT    7    5    5                                                 
CONECT    8    9    9    2   10                                       
CONECT    9    8    8                                                 
CONECT   10    8   16                                                 
CONECT   11    1                                                      
CONECT   12    1                                                      
CONECT   13    2                                                      
CONECT   14    3                                                      
CONECT   15    3                                                      
CONECT   16   10                                                      
CONECT   17    5   18   22   22                                       
CONECT   18   17   19   19   26                                       
CONECT   19   18   18   20   27                                       
CONECT   20   19   21   21   23                                       
CONECT   21   20   20   22   28                                       
CONECT   22   21   17   17   29                                       
CONECT   23   20   24   30   31                                       
CONECT   24   23   25   32   33                                       
CONECT   25   24   34   35                                            
CONECT   26   18                                                      
CONECT   27   19                                                      
CONECT   28   21                                                      
CONECT   29   22                                                      
CONECT   30   23                                                      
CONECT   31   23                                                      
CONECT   32   24                                                      
CONECT   33   24                                                      
CONECT   34   25                                                      
CONECT   35   25                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
