COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.560  -1.209  -0.526  1.00  0.00           O  
HETATM    2  S   UNL     1       3.299  -0.064   0.273  1.00  0.00           S  
HETATM    3  O   UNL     1       3.710   0.048   1.629  1.00  0.00           O  
HETATM    4  O   UNL     1       3.912   1.120  -0.461  1.00  0.00           O  
HETATM    5  O   UNL     1       1.790   0.133   0.264  1.00  0.00           O  
HETATM    6  N   UNL     1       1.162  -0.144  -1.028  1.00  0.00           N  
HETATM    7  C   UNL     1      -0.290   0.066  -0.964  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.580   1.518  -0.579  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.093   1.747  -0.544  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.718   0.832   0.515  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.185   0.951   0.465  1.00  0.00           C  
HETATM   12  N   UNL     1      -5.316   1.043   0.427  1.00  0.00           N  
HETATM   13  N   UNL     1      -2.324  -0.555   0.235  1.00  0.00           N  
HETATM   14  C   UNL     1      -3.254  -1.522   0.112  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.924  -2.644  -0.209  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.895  -0.868   0.090  1.00  0.00           C  
HETATM   17  H   UNL     1       1.379  -1.078  -1.343  1.00  0.00           H  
HETATM   18  H   UNL     1      -0.733  -0.148  -1.936  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.158   1.725   0.405  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.130   2.185  -1.314  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.298   2.787  -0.293  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.519   1.517  -1.520  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.362   1.121   1.504  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.294  -1.298   0.301  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.778  -1.903  -0.229  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.390  -0.717   1.044  1.00  0.00           H  
HETATM   27  H   UNL     1       4.878   1.094  -0.512  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    3    5    1                                       
CONECT    2    1    4                                                 
CONECT    3    2    2                                                 
CONECT    4    2   27                                                 
CONECT    5    6    2                                                 
CONECT    6    7    5   17                                            
CONECT    7   16    8    6   18                                       
CONECT    8    7    9   19   20                                       
CONECT    9   10    8   21   22                                       
CONECT   10   11   13    9   23                                       
CONECT   11   12   12   12   10                                       
CONECT   12   11   11   11                                            
CONECT   13   16   10   14                                            
CONECT   14   13   15   15   24                                       
CONECT   15   14   14                                                 
CONECT   16   13    7   25   26                                       
CONECT   17    6                                                      
CONECT   18    7                                                      
CONECT   19    8                                                      
CONECT   20    8                                                      
CONECT   21    9                                                      
CONECT   22    9                                                      
CONECT   23   10                                                      
CONECT   24   14                                                      
CONECT   25   16                                                      
CONECT   26   16                                                      
CONECT   27    4                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
