COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.779  -0.674  -0.112  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.788   0.310  -0.279  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.040   1.627   0.112  1.00  0.00           C  
HETATM    4  C   UNL     1       2.931  -1.168   2.018  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.982  -1.660  -1.031  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.638  -0.371  -0.879  1.00  0.00           C  
HETATM    7  C   UNL     1       0.682   0.254  -1.248  1.00  0.00           C  
HETATM    8  C   UNL     1       1.592   0.288  -0.019  1.00  0.00           C  
HETATM    9  C   UNL     1       2.864   1.023  -0.356  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.259  -1.858  -0.583  1.00  0.00           N  
HETATM   11  C   UNL     1      -4.004  -0.319   0.444  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.250   1.953   0.656  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.232   0.986   0.823  1.00  0.00           C  
HETATM   14  O   UNL     1       3.293   1.002  -1.486  1.00  0.00           O  
HETATM   15  O   UNL     1       3.521   1.700   0.599  1.00  0.00           O  
HETATM   16  S   UNL     1       1.990  -1.408   0.486  1.00  0.00           S  
HETATM   17  H   UNL     1      -1.281   2.385  -0.015  1.00  0.00           H  
HETATM   18  H   UNL     1       3.820  -0.574   1.809  1.00  0.00           H  
HETATM   19  H   UNL     1       2.310  -0.649   2.748  1.00  0.00           H  
HETATM   20  H   UNL     1       3.227  -2.138   2.418  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.346  -2.425  -1.452  1.00  0.00           H  
HETATM   22  H   UNL     1       1.155  -0.334  -2.035  1.00  0.00           H  
HETATM   23  H   UNL     1       0.515   1.271  -1.605  1.00  0.00           H  
HETATM   24  H   UNL     1       1.082   0.800   0.797  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.727  -2.708  -0.591  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.774  -1.065   0.578  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.445   2.971   0.959  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.184   1.259   1.254  1.00  0.00           H  
HETATM   29  H   UNL     1       4.332   2.156   0.335  1.00  0.00           H  
CONECT    1   10    2   11   11                                       
CONECT    2    6    3    3    1                                       
CONECT    3    2    2   12   17                                       
CONECT    4   16   18   19   20                                       
CONECT    5    6    6   10   21                                       
CONECT    6    7    5    5    2                                       
CONECT    7    6    8   22   23                                       
CONECT    8    7    9   16   24                                       
CONECT    9   14   14    8   15                                       
CONECT   10    5    1   25                                            
CONECT   11    1    1   13   26                                       
CONECT   12    3   13   13   27                                       
CONECT   13   11   12   12   28                                       
CONECT   14    9    9                                                 
CONECT   15    9   29                                                 
CONECT   16    4    8                                                 
CONECT   17    3                                                      
CONECT   18    4                                                      
CONECT   19    4                                                      
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25   10                                                      
CONECT   26   11                                                      
CONECT   27   12                                                      
CONECT   28   13                                                      
CONECT   29   15                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
