COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNK     1       3.622  -0.024   1.963  1.00  0.00           O  
HETATM    2  C   UNK     1       3.715   0.250   0.790  1.00  0.00           C  
HETATM    3  C   UNK     1       2.721  -0.309  -0.195  1.00  0.00           C  
HETATM    4  N   UNK     1       2.064  -1.487   0.386  1.00  0.00           N  
HETATM    5  C   UNK     1       1.669   0.754  -0.517  1.00  0.00           C  
HETATM    6  S   UNK     1       0.563   0.138  -1.816  1.00  0.00           S  
HETATM    7  S   UNK     1      -0.666  -1.151  -0.802  1.00  0.00           S  
HETATM    8  C   UNK     1      -1.917  -0.087  -0.164  1.00  0.00           C  
HETATM    9  C   UNK     1      -1.869   1.275  -0.421  1.00  0.00           C  
HETATM   10  C   UNK     1      -2.852   2.108   0.080  1.00  0.00           C  
HETATM   11  C   UNK     1      -3.884   1.588   0.839  1.00  0.00           C  
HETATM   12  C   UNK     1      -3.940   0.231   1.100  1.00  0.00           C  
HETATM   13  C   UNK     1      -2.962  -0.613   0.596  1.00  0.00           C  
HETATM   14  N   UNK     1      -3.020  -1.987   0.855  1.00  0.00           N  
HETATM   15  O   UNK     1       4.701   1.056   0.365  1.00  0.00           O  
HETATM   16  H   UNK     1       5.312   1.393   1.035  1.00  0.00           H  
HETATM   17  H   UNK     1       3.239  -0.596  -1.110  1.00  0.00           H  
HETATM   18  H   UNK     1       1.470  -1.226   1.158  1.00  0.00           H  
HETATM   19  H   UNK     1       1.545  -1.994  -0.315  1.00  0.00           H  
HETATM   20  H   UNK     1       1.089   0.974   0.380  1.00  0.00           H  
HETATM   21  H   UNK     1       2.164   1.663  -0.861  1.00  0.00           H  
HETATM   22  H   UNK     1      -1.063   1.685  -1.012  1.00  0.00           H  
HETATM   23  H   UNK     1      -2.812   3.169  -0.120  1.00  0.00           H  
HETATM   24  H   UNK     1      -4.649   2.243   1.228  1.00  0.00           H  
HETATM   25  H   UNK     1      -4.747  -0.172   1.693  1.00  0.00           H  
HETATM   26  H   UNK     1      -2.332  -2.576   0.505  1.00  0.00           H  
HETATM   27  H   UNK     1      -3.747  -2.351   1.383  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1   15    3                                       
CONECT    3    2    4    5   17                                       
CONECT    4    3   18   19                                            
CONECT    5    3    6   20   21                                       
CONECT    6    5    7                                                 
CONECT    7    6    8                                                 
CONECT    8    7    9   13   13                                       
CONECT    9    8   10   10   22                                       
CONECT   10    9    9   11   23                                       
CONECT   11   10   12   12   24                                       
CONECT   12   11   11   13   25                                       
CONECT   13    8    8   12   14                                       
CONECT   14   13   26   27                                            
CONECT   15    2   16                                                 
CONECT   16   15                                                      
CONECT   17    3                                                      
CONECT   18    4                                                      
CONECT   19    4                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    9                                                      
CONECT   23   10                                                      
CONECT   24   11                                                      
CONECT   25   12                                                      
CONECT   26   14                                                      
CONECT   27   14                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
