COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1       3.723  -0.119   0.085  1.00  0.00           S  
HETATM    2  N   UNL     1       4.231  -0.162  -1.491  1.00  0.00           N  
HETATM    3  O   UNL     1       4.027  -1.391   0.640  1.00  0.00           O  
HETATM    4  O   UNL     1       4.207   1.102   0.629  1.00  0.00           O  
HETATM    5  C   UNL     1       1.966   0.008   0.063  1.00  0.00           C  
HETATM    6  C   UNL     1       1.192  -1.139   0.060  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.185  -1.046   0.043  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.795   0.207   0.030  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.011   1.359   0.034  1.00  0.00           C  
HETATM   10  C   UNL     1       1.365   1.254   0.056  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.275   0.313   0.006  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.885   1.567  -0.013  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.262   1.664  -0.035  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.040   0.522  -0.040  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.441  -0.731  -0.021  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.058  -0.838  -0.004  1.00  0.00           C  
HETATM   17  N   UNL     1      -5.231  -1.883  -0.026  1.00  0.00           N  
HETATM   18  H   UNL     1       4.726  -0.928  -1.820  1.00  0.00           H  
HETATM   19  H   UNL     1       4.033   0.579  -2.084  1.00  0.00           H  
HETATM   20  H   UNL     1       1.666  -2.109   0.070  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.788  -1.941   0.039  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.480   2.332   0.023  1.00  0.00           H  
HETATM   23  H   UNL     1       1.973   2.146   0.059  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.281   2.461  -0.009  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.733   2.637  -0.049  1.00  0.00           H  
HETATM   26  H   UNL     1      -6.117   0.604  -0.057  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.590  -1.811   0.010  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.198  -1.809  -0.041  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.812  -2.758  -0.013  1.00  0.00           H  
CONECT    1    5    2    4    4                                       
CONECT    1    3    3                                                 
CONECT    2    1   18   19                                            
CONECT    3    1    1                                                 
CONECT    4    1    1                                                 
CONECT    5   10   10    6    1                                       
CONECT    6    7    7    5   20                                       
CONECT    7    8    6    6   21                                       
CONECT    8   11    9    9    7                                       
CONECT    9    8    8   10   22                                       
CONECT   10    9    5    5   23                                       
CONECT   11   16   16   12    8                                       
CONECT   12   13   13   11   24                                       
CONECT   13   14   12   12   25                                       
CONECT   14   15   15   13   26                                       
CONECT   15   17   14   14   16                                       
CONECT   16   15   11   11   27                                       
CONECT   17   15   28   29                                            
CONECT   18    2                                                      
CONECT   19    2                                                      
CONECT   20    6                                                      
CONECT   21    7                                                      
CONECT   22    9                                                      
CONECT   23   10                                                      
CONECT   24   12                                                      
CONECT   25   13                                                      
CONECT   26   14                                                      
CONECT   27   16                                                      
CONECT   28   17                                                      
CONECT   29   17                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
