COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.893   0.546  -0.500  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.051   1.293  -0.473  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.272   2.826  -0.442  1.00  0.00           C  
HETATM    4  O   UNL     1      -4.395   1.441  -0.112  1.00  0.00           O  
HETATM    5  C   UNL     1      -3.259   0.698  -0.138  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.308  -0.668   0.175  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.143  -1.426   0.148  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.929  -0.820  -0.190  1.00  0.00           C  
HETATM    9  C   UNL     1       0.305  -1.615  -0.226  1.00  0.00           C  
HETATM   10  C   UNL     1       1.511  -1.001  -0.121  1.00  0.00           C  
HETATM   11  S   UNL     1       1.840   0.703   0.248  1.00  0.00           S  
HETATM   12  C   UNL     1       3.602   0.528   0.164  1.00  0.00           C  
HETATM   13  S   UNL     1       4.762   1.763   0.408  1.00  0.00           S  
HETATM   14  N   UNL     1       3.852  -0.754  -0.126  1.00  0.00           N  
HETATM   15  C   UNL     1       2.843  -1.596  -0.280  1.00  0.00           C  
HETATM   16  O   UNL     1       3.008  -2.774  -0.537  1.00  0.00           O  
HETATM   17  C   UNL     1      -4.556  -1.281   0.521  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.578  -1.783   0.804  1.00  0.00           C  
HETATM   19  H   UNL     1       0.043   1.013  -0.766  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.017   2.345  -0.712  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.592   3.307   0.261  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.880   2.925  -1.454  1.00  0.00           H  
HETATM   23  H   UNL     1      -5.252   3.301  -0.384  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.175  -2.478   0.389  1.00  0.00           H  
HETATM   25  H   UNL     1       0.253  -2.688  -0.336  1.00  0.00           H  
HETATM   26  H   UNL     1       4.766  -1.065  -0.218  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.493  -2.233   1.058  1.00  0.00           H  
CONECT    1    2    8    8   19                                       
CONECT    2    5    5    1   20                                       
CONECT    3    4   21   22   23                                       
CONECT    4    3    5                                                 
CONECT    5    4    2    2    6                                       
CONECT    6    5   17    7    7                                       
CONECT    7    6    6    8   24                                       
CONECT    8    1    1    7    9                                       
CONECT    9    8   10   10   25                                       
CONECT   10    9    9   11   15                                       
CONECT   11   10   12                                                 
CONECT   12   11   14   13   13                                       
CONECT   13   12   12                                                 
CONECT   14   15   12   26                                            
CONECT   15   10   16   16   14                                       
CONECT   16   15   15                                                 
CONECT   17   18   18   18    6                                       
CONECT   18   17   17   17   27                                       
CONECT   19    1                                                      
CONECT   20    2                                                      
CONECT   21    3                                                      
CONECT   22    3                                                      
CONECT   23    3                                                      
CONECT   24    7                                                      
CONECT   25    9                                                      
CONECT   26   14                                                      
CONECT   27   18                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
