COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.524   1.120   0.731  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.840  -0.199   0.021  1.00  0.00           C  
HETATM    3  N   UNL     1      -2.205  -0.614   0.353  1.00  0.00           N  
HETATM    4  C   UNL     1      -3.247  -0.132  -0.353  1.00  0.00           C  
HETATM    5  O   UNL     1      -3.055   0.645  -1.264  1.00  0.00           O  
HETATM    6  C   UNL     1      -4.652  -0.560  -0.012  1.00  0.00           C  
HETATM    7  C   UNL     1       0.140  -1.279   0.467  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.316  -2.551   0.002  1.00  0.00           O  
HETATM    9  C   UNL     1       1.533  -1.009  -0.095  1.00  0.00           C  
HETATM   10  O   UNL     1       2.362  -2.152   0.123  1.00  0.00           O  
HETATM   11  C   UNL     1       2.151   0.207   0.600  1.00  0.00           C  
HETATM   12  C   UNL     1       3.574   0.425   0.082  1.00  0.00           C  
HETATM   13  O   UNL     1       3.551   0.535  -1.342  1.00  0.00           O  
HETATM   14  S   UNL     1       1.136   1.672   0.238  1.00  0.00           S  
HETATM   15  H   UNL     1      -0.757  -0.059  -1.057  1.00  0.00           H  
HETATM   16  H   UNL     1      -2.359  -1.237   1.081  1.00  0.00           H  
HETATM   17  H   UNL     1      -4.626  -1.256   0.827  1.00  0.00           H  
HETATM   18  H   UNL     1      -5.242   0.315   0.260  1.00  0.00           H  
HETATM   19  H   UNL     1      -5.103  -1.049  -0.875  1.00  0.00           H  
HETATM   20  H   UNL     1       0.190  -1.292   1.556  1.00  0.00           H  
HETATM   21  H   UNL     1       0.258  -3.289   0.247  1.00  0.00           H  
HETATM   22  H   UNL     1       1.460  -0.814  -1.165  1.00  0.00           H  
HETATM   23  H   UNL     1       3.265  -2.053  -0.210  1.00  0.00           H  
HETATM   24  H   UNL     1       2.175   0.039   1.676  1.00  0.00           H  
HETATM   25  H   UNL     1       3.980   1.341   0.511  1.00  0.00           H  
HETATM   26  H   UNL     1       4.199  -0.420   0.371  1.00  0.00           H  
HETATM   27  H   UNL     1       4.422   0.675  -1.740  1.00  0.00           H  
HETATM   28  O   UNL     1      -1.487   2.108   0.358  1.00  0.00           O  
HETATM   29  H   UNL     1      -0.554   0.970   1.810  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.344   2.971   0.769  1.00  0.00           H  
CONECT    1    2   14   28   29                                       
CONECT    2    1    3    7   15                                       
CONECT    3    2   16    4                                            
CONECT    4    6    3    5    5                                       
CONECT    5    4    4                                                 
CONECT    6    4   17   18   19                                       
CONECT    7    2   20    8    9                                       
CONECT    8    7   21                                                 
CONECT    9    7   10   11   22                                       
CONECT   10    9   23                                                 
CONECT   11    9   24   12   14                                       
CONECT   12   11   25   26   13                                       
CONECT   13   12   27                                                 
CONECT   14    1   11                                                 
CONECT   15    2                                                      
CONECT   16    3                                                      
CONECT   17    6                                                      
CONECT   18    6                                                      
CONECT   19    6                                                      
CONECT   20    7                                                      
CONECT   21    8                                                      
CONECT   22    9                                                      
CONECT   23   10                                                      
CONECT   24   11                                                      
CONECT   25   12                                                      
CONECT   26   12                                                      
CONECT   27   13                                                      
CONECT   28    1   30                                                 
CONECT   29    1                                                      
CONECT   30   28                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
