COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.203   0.087  -1.104  1.00  0.00           N  
HETATM    2  C   UNL     1      -3.987   0.506   1.078  1.00  0.00           C  
HETATM    3  C   UNL     1       1.296  -0.889  -0.006  1.00  0.00           C  
HETATM    4  C   UNL     1       0.783  -2.188  -0.018  1.00  0.00           C  
HETATM    5  C   UNL     1       1.641  -3.266  -0.016  1.00  0.00           C  
HETATM    6  C   UNL     1       3.012  -3.068  -0.001  1.00  0.00           C  
HETATM    7  C   UNL     1       2.683  -0.692   0.009  1.00  0.00           C  
HETATM    8  N   UNL     1       5.272   3.211   0.040  1.00  0.00           N  
HETATM    9  C   UNL     1       4.987   2.112   0.036  1.00  0.00           C  
HETATM   10  C   UNL     1       4.617   0.687   0.030  1.00  0.00           C  
HETATM   11  O   UNL     1       3.193   0.565   0.015  1.00  0.00           O  
HETATM   12  C   UNL     1       3.533  -1.789   0.011  1.00  0.00           C  
HETATM   13  C   UNL     1       0.382   0.269  -0.015  1.00  0.00           C  
HETATM   14  O   UNL     1       0.832   1.399  -0.009  1.00  0.00           O  
HETATM   15  N   UNL     1      -0.952   0.076  -0.029  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.859   1.226  -0.037  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.285   0.741  -0.052  1.00  0.00           C  
HETATM   18  S   UNL     1      -5.538  -0.023   0.555  1.00  0.00           S  
HETATM   19  C   UNL     1      -3.977   0.503  -1.221  1.00  0.00           C  
HETATM   20  H   UNL     1      -3.645   0.624   2.096  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.285  -2.348  -0.029  1.00  0.00           H  
HETATM   22  H   UNL     1       1.244  -4.270  -0.025  1.00  0.00           H  
HETATM   23  H   UNL     1       3.678  -3.918   0.002  1.00  0.00           H  
HETATM   24  H   UNL     1       5.032   0.207  -0.856  1.00  0.00           H  
HETATM   25  H   UNL     1       5.014   0.205   0.924  1.00  0.00           H  
HETATM   26  H   UNL     1       4.602  -1.642   0.023  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.311  -0.825  -0.033  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.689   1.829   0.855  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.671   1.830  -0.925  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.521   0.655  -2.188  1.00  0.00           H  
CONECT    1   19   19   18                                            
CONECT    2   17   17   18   20                                       
CONECT    3    4    4    7   13                                       
CONECT    4    5    3    3   21                                       
CONECT    5    6    6    4   22                                       
CONECT    6    5    5   12   23                                       
CONECT    7   12   12    3   11                                       
CONECT    8    9    9    9                                            
CONECT    9   10    8    8    8                                       
CONECT   10   11    9   24   25                                       
CONECT   11    7   10                                                 
CONECT   12    6    7    7   26                                       
CONECT   13    3   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   27                                            
CONECT   16   15   17   28   29                                       
CONECT   17   19   16    2    2                                       
CONECT   18    1    2                                                 
CONECT   19    1    1   17   30                                       
CONECT   20    2                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24   10                                                      
CONECT   25   10                                                      
CONECT   26   12                                                      
CONECT   27   15                                                      
CONECT   28   16                                                      
CONECT   29   16                                                      
CONECT   30   19                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
