COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.611   0.931   0.582  1.00  0.00           N  
HETATM    2  C   UNL     1      -4.562   0.063   0.206  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.236  -1.132  -0.649  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.433  -0.743  -0.246  1.00  0.00           C  
HETATM    5  C   UNL     1       2.260   0.017  -0.178  1.00  0.00           C  
HETATM    6  C   UNL     1       2.374  -1.249   0.383  1.00  0.00           C  
HETATM    7  C   UNL     1       4.740  -0.946   0.600  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.791  -1.566  -0.377  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.868  -0.367  -0.619  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.324   0.790   0.230  1.00  0.00           C  
HETATM   11  S   UNL     1       0.681   0.624  -0.671  1.00  0.00           S  
HETATM   12  O   UNL     1      -1.511   1.604   0.612  1.00  0.00           O  
HETATM   13  O   UNL     1      -5.707   0.245   0.562  1.00  0.00           O  
HETATM   14  C   UNL     1       3.612  -1.725   0.770  1.00  0.00           C  
HETATM   15  C   UNL     1       4.632   0.324   0.044  1.00  0.00           C  
HETATM   16  C   UNL     1       3.391   0.806  -0.345  1.00  0.00           C  
HETATM   17  N   UNL     1       5.772   1.114  -0.122  1.00  0.00           N  
HETATM   18  H   UNL     1      -3.864   1.693   1.127  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.914  -1.951  -0.405  1.00  0.00           H  
HETATM   20  H   UNL     1      -4.346  -0.869  -1.701  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.375  -0.940   0.824  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.137  -1.637  -0.796  1.00  0.00           H  
HETATM   23  H   UNL     1       1.495  -1.861   0.517  1.00  0.00           H  
HETATM   24  H   UNL     1       5.706  -1.321   0.903  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.697  -1.898   0.657  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.521  -2.381  -1.049  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.909  -0.082  -1.670  1.00  0.00           H  
HETATM   28  H   UNL     1       3.698  -2.709   1.206  1.00  0.00           H  
HETATM   29  H   UNL     1       3.304   1.792  -0.778  1.00  0.00           H  
HETATM   30  H   UNL     1       5.696   2.000  -0.509  1.00  0.00           H  
HETATM   31  H   UNL     1       6.639   0.776   0.151  1.00  0.00           H  
CONECT    1   10    2   18                                            
CONECT    2    1   13   13    3                                       
CONECT    3    2    8   19   20                                       
CONECT    4   11    9   21   22                                       
CONECT    5   16   11    6    6                                       
CONECT    6    5    5   14   23                                       
CONECT    7   15   14   14   24                                       
CONECT    8    9    3   25   26                                       
CONECT    9   10    4    8   27                                       
CONECT   10   12   12    1    9                                       
CONECT   11    5    4                                                 
CONECT   12   10   10                                                 
CONECT   13    2    2                                                 
CONECT   14    7    7    6   28                                       
CONECT   15   17   16   16    7                                       
CONECT   16   15   15    5   29                                       
CONECT   17   15   30   31                                            
CONECT   18    1                                                      
CONECT   19    3                                                      
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    4                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    8                                                      
CONECT   27    9                                                      
CONECT   28   14                                                      
CONECT   29   16                                                      
CONECT   30   17                                                      
CONECT   31   17                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
