COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.968   0.534   0.172  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.431  -0.515  -0.618  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.747  -1.719  -0.635  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.147  -0.836   0.915  1.00  0.00           C  
HETATM    5  C   UNL     1       0.095  -1.015   1.749  1.00  0.00           C  
HETATM    6  C   UNL     1       1.303  -0.610   0.944  1.00  0.00           C  
HETATM    7  C   UNL     1       3.428   0.091  -0.476  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.826   0.368   0.938  1.00  0.00           C  
HETATM    9  O   UNL     1      -3.804   1.602   0.013  1.00  0.00           O  
HETATM   10  O   UNL     1      -4.559  -0.106  -1.269  1.00  0.00           O  
HETATM   11  C   UNL     1      -4.546   1.334  -1.191  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.607  -1.878   0.132  1.00  0.00           C  
HETATM   13  C   UNL     1       1.760   0.708   0.971  1.00  0.00           C  
HETATM   14  N   UNL     1       1.944  -1.500   0.210  1.00  0.00           N  
HETATM   15  N   UNL     1       2.828   1.028   0.248  1.00  0.00           N  
HETATM   16  O   UNL     1       1.127   1.644   1.719  1.00  0.00           O  
HETATM   17  N   UNL     1       2.976  -1.158  -0.479  1.00  0.00           N  
HETATM   18  S   UNL     1       4.845   0.507  -1.437  1.00  0.00           S  
HETATM   19  H   UNL     1      -3.103  -2.534  -1.247  1.00  0.00           H  
HETATM   20  H   UNL     1       0.027  -0.391   2.641  1.00  0.00           H  
HETATM   21  H   UNL     1       0.188  -2.060   2.043  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.464   1.180   1.551  1.00  0.00           H  
HETATM   23  H   UNL     1      -5.562   1.720  -1.109  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.040   1.763  -2.056  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.075  -2.818   0.117  1.00  0.00           H  
HETATM   26  H   UNL     1       1.465   1.720   2.622  1.00  0.00           H  
HETATM   27  H   UNL     1       5.863   0.258  -0.493  1.00  0.00           H  
CONECT    1    2    2    8    9                                       
CONECT    2    1    1    3   10                                       
CONECT    3    2   12   12   19                                       
CONECT    4    8    8   12    5                                       
CONECT    5    4    6   20   21                                       
CONECT    6    5   13   13   14                                       
CONECT    7   15   15   17   18                                       
CONECT    8    1    4    4   22                                       
CONECT    9    1   11                                                 
CONECT   10    2   11                                                 
CONECT   11    9   10   23   24                                       
CONECT   12    3    3    4   25                                       
CONECT   13    6    6   15   16                                       
CONECT   14    6   17   17                                            
CONECT   15   13    7    7                                            
CONECT   16   13   26                                                 
CONECT   17   14   14    7                                            
CONECT   18    7   27                                                 
CONECT   19    3                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    8                                                      
CONECT   23   11                                                      
CONECT   24   11                                                      
CONECT   25   12                                                      
CONECT   26   16                                                      
CONECT   27   18                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
