COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -0.914   1.565  -1.837  1.00  0.00           S  
HETATM    2  C   UNL     1      -1.139   1.514  -3.638  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.625   0.120  -3.988  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.814  -0.074  -4.503  1.00  0.00           C  
HETATM    5  CA  UNL     1      -0.693  -1.033  -3.720  1.00  0.00           C  
HETATM    6  C   UNL     1       0.392  -1.038  -4.765  1.00  0.00           C  
HETATM    7  O   UNL     1       0.206  -1.691  -5.923  1.00  0.00           O  
HETATM    8  OXT UNL     1       1.430  -0.455  -4.561  1.00  0.00           O  
HETATM    9  N   UNL     1      -0.086  -0.935  -2.408  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.095   0.031  -1.592  1.00  0.00           C  
HETATM   11  CA  UNL     1       0.653  -0.151  -0.297  1.00  0.00           C  
HETATM   12  C   UNL     1       2.077   0.310  -0.471  1.00  0.00           C  
HETATM   13  O   UNL     1       2.925  -0.469  -0.837  1.00  0.00           O  
HETATM   14  OXT UNL     1       2.404   1.587  -0.219  1.00  0.00           O  
HETATM   15  N   UNL     1       0.009   0.637   0.755  1.00  0.00           N  
HETATM   16  C   UNL     1       0.062   0.222   2.036  1.00  0.00           C  
HETATM   17  O   UNL     1       0.644  -0.803   2.318  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.599   1.034   3.119  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.394   0.358   4.450  1.00  0.00           C  
HETATM   20  C   UNL     1       0.615   0.514   5.340  1.00  0.00           C  
HETATM   21  C   UNL     1       0.594  -0.216   6.513  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.430  -1.075   6.734  1.00  0.00           C  
HETATM   23  S   UNL     1      -1.416  -0.861   5.261  1.00  0.00           S  
HETATM   24  H   UNL     1      -0.192   1.714  -4.140  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.882   2.252  -3.939  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.467   0.766  -4.687  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.141  -1.074  -4.744  1.00  0.00           H  
HETATM   28  HA  UNL     1      -1.253  -1.966  -3.784  1.00  0.00           H  
HETATM   29  H   UNL     1       0.903  -1.695  -6.593  1.00  0.00           H  
HETATM   30  HA  UNL     1       0.645  -1.205  -0.018  1.00  0.00           H  
HETATM   31  HXT UNL     1       3.318   1.883  -0.331  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.455   1.458   0.530  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.159   2.031   3.147  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.666   1.114   2.912  1.00  0.00           H  
HETATM   35  H   UNL     1       1.421   1.205   5.140  1.00  0.00           H  
HETATM   36  H   UNL     1       1.384  -0.107   7.241  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.606  -1.721   7.582  1.00  0.00           H  
CONECT    1    2   10                                                 
CONECT    2    1    3   24   25                                       
CONECT    3    2    4    4    5                                       
CONECT    4    3    3   26   27                                       
CONECT    5    3    6    9   28                                       
CONECT    6    5    7    8    8                                       
CONECT    7    6   29                                                 
CONECT    8    6    6                                                 
CONECT    9    5   10   10                                            
CONECT   10    1    9    9   11                                       
CONECT   11   10   12   15   30                                       
CONECT   12   11   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   31                                                 
CONECT   15   11   16   32                                            
CONECT   16   15   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   33   34                                       
CONECT   19   18   20   20   23                                       
CONECT   20   19   19   21   35                                       
CONECT   21   20   22   22   36                                       
CONECT   22   21   21   23   37                                       
CONECT   23   19   22                                                 
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30   11                                                      
CONECT   31   14                                                      
CONECT   32   15                                                      
CONECT   33   18                                                      
CONECT   34   18                                                      
CONECT   35   20                                                      
CONECT   36   21                                                      
CONECT   37   22                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
