COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.175   0.489  -0.598  1.00  0.00           N  
HETATM    2  C   UNL     1       0.090  -0.856  -0.594  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.752   0.292  -0.100  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.927   1.396   0.171  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.099   0.809   0.967  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.921  -1.309  -0.149  1.00  0.00           C  
HETATM    7  C   UNL     1       2.271  -1.479   0.450  1.00  0.00           C  
HETATM    8  C   UNL     1       4.305   1.763  -0.551  1.00  0.00           C  
HETATM    9  C   UNL     1       3.410   0.590  -0.241  1.00  0.00           C  
HETATM   10  C   UNL     1       1.534  -0.607  -0.244  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.740  -0.830  -1.002  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.085   0.287  -0.301  1.00  0.00           N  
HETATM   13  O   UNL     1      -0.230   1.222   0.479  1.00  0.00           O  
HETATM   14  O   UNL     1      -4.749  -0.190   0.178  1.00  0.00           O  
HETATM   15  S   UNL     1       3.886  -0.800   0.634  1.00  0.00           S  
HETATM   16  H   UNL     1      -0.244  -1.780  -0.122  1.00  0.00           H  
HETATM   17  H   UNL     1      -0.013  -0.942  -1.676  1.00  0.00           H  
HETATM   18  H   UNL     1      -3.307   1.958  -0.682  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.342   2.055   0.813  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.725   0.360   1.887  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.808   1.601   1.208  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.502  -2.040  -0.711  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.547  -1.766   0.767  1.00  0.00           H  
HETATM   24  H   UNL     1       1.936  -2.432   0.831  1.00  0.00           H  
HETATM   25  H   UNL     1       4.231   2.498   0.250  1.00  0.00           H  
HETATM   26  H   UNL     1       5.336   1.420  -0.636  1.00  0.00           H  
HETATM   27  H   UNL     1       3.995   2.218  -1.492  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.030  -1.646  -1.137  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.101  -0.493  -1.973  1.00  0.00           H  
CONECT    1    9    9   10                                            
CONECT    2   10    3   16   17                                       
CONECT    3    2   13   13   12                                       
CONECT    4   12    5   18   19                                       
CONECT    5    4   14   20   21                                       
CONECT    6   11   14   22   23                                       
CONECT    7   15   10   10   24                                       
CONECT    8    9   25   26   27                                       
CONECT    9    8   15    1    1                                       
CONECT   10    7    7    1    2                                       
CONECT   11   12    6   28   29                                       
CONECT   12    3    4   11                                            
CONECT   13    3    3                                                 
CONECT   14    5    6                                                 
CONECT   15    9    7                                                 
CONECT   16    2                                                      
CONECT   17    2                                                      
CONECT   18    4                                                      
CONECT   19    4                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    6                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    8                                                      
CONECT   27    8                                                      
CONECT   28   11                                                      
CONECT   29   11                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
