COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.278  -0.158  -0.056  1.00  0.00           C  
HETATM    2  C   UNL     1       3.587   0.976  -0.454  1.00  0.00           C  
HETATM    3  C   UNL     1       2.202  -1.104   0.643  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.264   1.494  -0.153  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.682   1.760   0.365  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.519   0.526   0.100  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.503  -0.915  -0.320  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.229  -1.269  -0.269  1.00  0.00           C  
HETATM    9  N   UNL     1       2.277   1.054  -0.309  1.00  0.00           N  
HETATM   10  C   UNL     1       3.573  -1.223   0.502  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.966  -1.663  -0.411  1.00  0.00           C  
HETATM   12  C   UNL     1       1.576   0.062   0.216  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.004  -0.681  -0.210  1.00  0.00           C  
HETATM   14  N   UNL     1       0.195   0.191   0.349  1.00  0.00           N  
HETATM   15  N   UNL     1       5.667  -0.235  -0.218  1.00  0.00           N  
HETATM   16  S   UNL     1      -4.272   0.438   0.145  1.00  0.00           S  
HETATM   17  H   UNL     1       4.126   1.805  -0.887  1.00  0.00           H  
HETATM   18  H   UNL     1       1.624  -1.910   1.071  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.270   1.482  -1.243  1.00  0.00           H  
HETATM   20  H   UNL     1       0.407   2.277   0.200  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.651   1.960   1.436  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.111   2.615  -0.157  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.244  -1.857   0.163  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.212  -0.950  -1.370  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.096  -1.903  -0.390  1.00  0.00           H  
HETATM   26  H   UNL     1       4.084  -2.121   0.817  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.706  -2.680  -0.666  1.00  0.00           H  
HETATM   28  H   UNL     1       6.144  -1.033   0.059  1.00  0.00           H  
HETATM   29  H   UNL     1       6.152   0.509  -0.607  1.00  0.00           H  
CONECT    1    2    2   10   15                                       
CONECT    2    9    1    1   17                                       
CONECT    3   12   10   10   18                                       
CONECT    4   14    5   19   20                                       
CONECT    5    4    6   21   22                                       
CONECT    6   16   13   13    5                                       
CONECT    7   13   14   23   24                                       
CONECT    8   11   11   16   25                                       
CONECT    9   12   12    2                                            
CONECT   10    3    3    1   26                                       
CONECT   11    8    8   13   27                                       
CONECT   12   14    9    9    3                                       
CONECT   13   11    6    6    7                                       
CONECT   14    4    7   12                                            
CONECT   15    1   28   29                                            
CONECT   16    8    6                                                 
CONECT   17    2                                                      
CONECT   18    3                                                      
CONECT   19    4                                                      
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    5                                                      
CONECT   23    7                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26   10                                                      
CONECT   27   11                                                      
CONECT   28   15                                                      
CONECT   29   15                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
