COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.816  -0.476  -0.024  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.209   0.965  -0.749  1.00  0.00           C  
HETATM    3  C   UNL     1       2.981  -1.928  -0.041  1.00  0.00           C  
HETATM    4  C   UNL     1       4.296  -2.171   0.086  1.00  0.00           C  
HETATM    5  C   UNL     1       4.108   0.064   0.118  1.00  0.00           C  
HETATM    6  C   UNL     1       3.192   2.174   0.076  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.582  -0.385   0.819  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.990   0.069  -0.517  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.687   0.855  -0.362  1.00  0.00           C  
HETATM   10  C   UNL     1       1.726   0.403  -0.119  1.00  0.00           C  
HETATM   11  N   UNL     1       0.438  -0.079  -0.265  1.00  0.00           N  
HETATM   12  N   UNL     1       1.963   1.710  -0.064  1.00  0.00           N  
HETATM   13  N   UNL     1       4.243   1.389   0.161  1.00  0.00           N  
HETATM   14  N   UNL     1       4.980  -0.988   0.182  1.00  0.00           N  
HETATM   15  O   UNL     1      -5.165   0.382   1.025  1.00  0.00           O  
HETATM   16  O   UNL     1      -4.613  -1.344  -0.683  1.00  0.00           O  
HETATM   17  S   UNL     1      -4.252  -0.234   0.127  1.00  0.00           S  
HETATM   18  H   UNL     1      -3.138   1.925  -0.238  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.469   1.071  -1.802  1.00  0.00           H  
HETATM   20  H   UNL     1       2.196  -2.664  -0.136  1.00  0.00           H  
HETATM   21  H   UNL     1       4.746  -3.153   0.109  1.00  0.00           H  
HETATM   22  H   UNL     1       3.340   3.244   0.116  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.317  -1.410   1.079  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.390   0.315   1.633  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.907  -0.738  -1.245  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.548   1.502  -1.228  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.734   1.462   0.541  1.00  0.00           H  
HETATM   28  H   UNL     1       0.279  -1.035  -0.304  1.00  0.00           H  
HETATM   29  H   UNL     1       5.942  -0.907   0.281  1.00  0.00           H  
CONECT    1    3   10    5    5                                       
CONECT    2    8   17   18   19                                       
CONECT    3    4    4    1   20                                       
CONECT    4   14    3    3   21                                       
CONECT    5   13   14    1    1                                       
CONECT    6   12   13   13   22                                       
CONECT    7   17    8   23   24                                       
CONECT    8    7    9    2   25                                       
CONECT    9   11    8   26   27                                       
CONECT   10   11   12   12    1                                       
CONECT   11    9   10   28                                            
CONECT   12   10   10    6                                            
CONECT   13    6    6    5                                            
CONECT   14    5    4   29                                            
CONECT   15   17   17                                                 
CONECT   16   17   17                                                 
CONECT   17   15   15   16   16                                       
CONECT   17    7    2                                                 
CONECT   18    2                                                      
CONECT   19    2                                                      
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    6                                                      
CONECT   23    7                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    9                                                      
CONECT   27    9                                                      
CONECT   28   11                                                      
CONECT   29   14                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
