COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.464   0.516   0.001  1.00  0.00           N  
HETATM    2  C   UNL     1       0.770   1.457  -0.001  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.515   1.896  -0.002  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.589   0.978   0.000  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.699   0.201   0.001  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.303  -0.394   0.001  1.00  0.00           C  
HETATM    7  C   UNL     1       4.854   0.054   0.008  1.00  0.00           C  
HETATM    8  C   UNL     1       2.456  -0.380  -0.004  1.00  0.00           C  
HETATM    9  O   UNL     1       2.702  -1.571  -0.007  1.00  0.00           O  
HETATM   10  C   UNL     1       1.056   0.085  -0.005  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.912   1.212  -0.001  1.00  0.00           N  
HETATM   12  S   UNL     1      -2.832  -1.268   0.002  1.00  0.00           S  
HETATM   13  C   UNL     1       0.013  -0.838   0.002  1.00  0.00           C  
HETATM   14  H   UNL     1       3.268   1.466   0.004  1.00  0.00           H  
HETATM   15  H   UNL     1       1.579   2.172  -0.001  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.718   2.957  -0.003  1.00  0.00           H  
HETATM   17  H   UNL     1      -4.777   0.270   0.001  1.00  0.00           H  
HETATM   18  H   UNL     1       5.032  -0.548   0.899  1.00  0.00           H  
HETATM   19  H   UNL     1       5.042  -0.548  -0.881  1.00  0.00           H  
HETATM   20  H   UNL     1       5.523   0.915   0.011  1.00  0.00           H  
HETATM   21  H   UNL     1       0.228  -1.896   0.008  1.00  0.00           H  
CONECT    1    7    8   14                                            
CONECT    2   10   10    3   15                                       
CONECT    3    2    4    4   16                                       
CONECT    4    3    3    6   11                                       
CONECT    5   12   11   11   17                                       
CONECT    6   13   13    4   12                                       
CONECT    7    1   18   19   20                                       
CONECT    8    9    9    1   10                                       
CONECT    9    8    8                                                 
CONECT   10    8    2    2   13                                       
CONECT   11    4    5    5                                            
CONECT   12    6    5                                                 
CONECT   13   10    6    6   21                                       
CONECT   14    1                                                      
CONECT   15    2                                                      
CONECT   16    3                                                      
CONECT   17    5                                                      
CONECT   18    7                                                      
CONECT   19    7                                                      
CONECT   20    7                                                      
CONECT   21   13                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
