COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.754  -2.180  -0.445  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.165  -1.929   0.055  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.276   0.165  -0.190  1.00  0.00           C  
HETATM    4  N   UNL     1       4.164   1.216  -0.981  1.00  0.00           N  
HETATM    5  C   UNL     1      -0.536   1.107   0.757  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.541   2.039   1.439  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.286   2.849   0.376  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.036   1.897  -0.559  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.035   0.965  -1.246  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.090  -2.705   0.012  1.00  0.00           O  
HETATM   11  O   UNL     1      -2.193  -0.680   0.556  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.269  -0.777  -0.877  1.00  0.00           C  
HETATM   13  C   UNL     1       1.129  -0.519  -0.376  1.00  0.00           C  
HETATM   14  N   UNL     1       1.975   0.281  -1.000  1.00  0.00           N  
HETATM   15  C   UNL     1       3.150   0.421  -0.469  1.00  0.00           C  
HETATM   16  S   UNL     1       3.266  -0.517   0.956  1.00  0.00           S  
HETATM   17  C   UNL     1       1.610  -1.075   0.736  1.00  0.00           C  
HETATM   18  H   UNL     1      -0.127  -2.573   0.355  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.764  -2.863  -1.295  1.00  0.00           H  
HETATM   20  H   UNL     1       4.019   1.720  -1.798  1.00  0.00           H  
HETATM   21  H   UNL     1       5.017   1.268  -0.524  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.011   0.523   1.514  1.00  0.00           H  
HETATM   23  H   UNL     1       0.184   1.699   0.192  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.254   1.447   2.012  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.011   2.717   2.108  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.997   3.517   0.861  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.571   3.436  -0.200  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.746   1.306   0.018  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.570   2.475  -1.313  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.330   1.556  -1.831  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.570   0.281  -1.905  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.317  -0.668  -1.960  1.00  0.00           H  
HETATM   33  H   UNL     1       1.077  -1.752   1.388  1.00  0.00           H  
CONECT    1   12    2   18   19                                       
CONECT    2   11    1   10   10                                       
CONECT    3    9    5   12   11                                       
CONECT    4   15   20   21                                            
CONECT    5    6    3   22   23                                       
CONECT    6    7    5   24   25                                       
CONECT    7    8    6   26   27                                       
CONECT    8    7    9   28   29                                       
CONECT    9    8    3   30   31                                       
CONECT   10    2    2                                                 
CONECT   11    3    2                                                 
CONECT   12    3    1   13   32                                       
CONECT   13   12   17   17   14                                       
CONECT   14   13   15   15                                            
CONECT   15   16   14   14    4                                       
CONECT   16   17   15                                                 
CONECT   17   13   13   16   33                                       
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    4                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    5                                                      
CONECT   24    6                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32   12                                                      
CONECT   33   17                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
