COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK     1      -2.562  -0.243  -1.831  1.00  0.00           N  
HETATM    2  C   UNK     1      -2.575  -0.722  -0.442  1.00  0.00           C  
HETATM    3  C   UNK     1      -3.903  -0.394   0.190  1.00  0.00           C  
HETATM    4  O   UNK     1      -4.603   0.468  -0.287  1.00  0.00           O  
HETATM    5  C   UNK     1      -1.454  -0.038   0.344  1.00  0.00           C  
HETATM    6  S   UNK     1       0.145  -0.433  -0.417  1.00  0.00           S  
HETATM    7  C   UNK     1       1.099   1.936   0.511  1.00  0.00           C  
HETATM    8  C   UNK     1       1.328   0.452   0.636  1.00  0.00           C  
HETATM    9  C   UNK     1       2.754   0.117   0.195  1.00  0.00           C  
HETATM   10  C   UNK     1       2.944  -1.378   0.202  1.00  0.00           C  
HETATM   11  O   UNK     1       1.410   2.570  -0.630  1.00  0.00           O  
HETATM   12  O   UNK     1       0.635   2.556   1.439  1.00  0.00           O  
HETATM   13  O   UNK     1       2.974   0.618  -1.125  1.00  0.00           O  
HETATM   14  O   UNK     1       3.148  -1.966  -0.834  1.00  0.00           O  
HETATM   15  O   UNK     1       2.886  -2.056   1.359  1.00  0.00           O  
HETATM   16  H   UNK     1      -3.251  -0.727  -2.386  1.00  0.00           H  
HETATM   17  H   UNK     1      -2.701   0.756  -1.870  1.00  0.00           H  
HETATM   18  H   UNK     1      -2.422  -1.801  -0.428  1.00  0.00           H  
HETATM   19  H   UNK     1      -1.606   1.041   0.330  1.00  0.00           H  
HETATM   20  H   UNK     1      -1.463  -0.394   1.374  1.00  0.00           H  
HETATM   21  H   UNK     1       1.188   0.148   1.673  1.00  0.00           H  
HETATM   22  H   UNK     1       3.464   0.577   0.882  1.00  0.00           H  
HETATM   23  H   UNK     1       1.246   3.522  -0.663  1.00  0.00           H  
HETATM   24  H   UNK     1       2.376   0.252  -1.790  1.00  0.00           H  
HETATM   25  H   UNK     1       3.014  -3.014   1.313  1.00  0.00           H  
HETATM   26  O   UNK     1      -4.308  -1.060   1.283  1.00  0.00           O  
HETATM   27  H   UNK     1      -5.168  -0.814   1.653  1.00  0.00           H  
CONECT    1    2   16   17                                            
CONECT    2    3    5    1   18                                       
CONECT    3    4    4    2   26                                       
CONECT    4    3    3                                                 
CONECT    5    6    2   19   20                                       
CONECT    6    5    8                                                 
CONECT    7   12   12   11    8                                       
CONECT    8    6    7    9   21                                       
CONECT    9   10    8   13   22                                       
CONECT   10   14   14   15    9                                       
CONECT   11    7   23                                                 
CONECT   12    7    7                                                 
CONECT   13    9   24                                                 
CONECT   14   10   10                                                 
CONECT   15   10   25                                                 
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    5                                                      
CONECT   20    5                                                      
CONECT   21    8                                                      
CONECT   22    9                                                      
CONECT   23   11                                                      
CONECT   24   13                                                      
CONECT   25   15                                                      
CONECT   26    3   27                                                 
CONECT   27   26                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
