COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.823   0.119   1.376  1.00  0.00           O  
HETATM    2  C   UNL     1       2.211   0.816   0.462  1.00  0.00           C  
HETATM    3  C   UNL     1       3.373   0.368  -0.386  1.00  0.00           C  
HETATM    4  N   UNL     1       1.599   1.988   0.201  1.00  0.00           N  
HETATM    5  C   UNL     1       2.068   2.830  -0.902  1.00  0.00           C  
HETATM    6  C   UNL     1       0.465   2.421   1.022  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.817   1.907   0.419  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.409   0.723   0.698  1.00  0.00           C  
HETATM    9  N   UNL     1      -2.534   0.639  -0.048  1.00  0.00           N  
HETATM   10  N   UNL     1      -2.633   1.811  -0.809  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.607   2.572  -0.525  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.440  -0.430  -0.058  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.560  -0.385  -0.877  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.451  -1.441  -0.885  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.228  -2.542  -0.079  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.112  -2.590   0.738  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.215  -1.540   0.746  1.00  0.00           C  
HETATM   18  H   UNL     1       3.052   0.276  -1.424  1.00  0.00           H  
HETATM   19  H   UNL     1       4.177   1.101  -0.317  1.00  0.00           H  
HETATM   20  H   UNL     1       1.539   2.559  -1.816  1.00  0.00           H  
HETATM   21  H   UNL     1       1.877   3.877  -0.668  1.00  0.00           H  
HETATM   22  H   UNL     1       3.138   2.679  -1.044  1.00  0.00           H  
HETATM   23  H   UNL     1       0.576   2.026   2.032  1.00  0.00           H  
HETATM   24  H   UNL     1       0.438   3.510   1.059  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.048  -0.022   1.392  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.402   3.543  -0.950  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.736   0.475  -1.506  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.323  -1.406  -1.521  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.926  -3.366  -0.086  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.941  -3.451   1.366  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.344  -1.578   1.383  1.00  0.00           H  
HETATM   32  S   UNL     1       3.969  -1.240   0.206  1.00  0.00           S  
HETATM   33  C   UNL     1       5.344  -1.605  -0.920  1.00  0.00           C  
HETATM   34  C   UNL     1       5.965  -2.953  -0.546  1.00  0.00           C  
HETATM   35  H   UNL     1       4.974  -1.647  -1.944  1.00  0.00           H  
HETATM   36  H   UNL     1       6.098  -0.823  -0.837  1.00  0.00           H  
HETATM   37  H   UNL     1       6.791  -3.173  -1.223  1.00  0.00           H  
HETATM   38  H   UNL     1       6.335  -2.912   0.478  1.00  0.00           H  
HETATM   39  H   UNL     1       5.210  -3.736  -0.628  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    4    1    1    3                                       
CONECT    3    2   18   19   32                                       
CONECT    4    6    5    2                                            
CONECT    5    4   20   21   22                                       
CONECT    6    7    4   23   24                                       
CONECT    7   11    8    8    6                                       
CONECT    8    9    7    7   25                                       
CONECT    9   12   10    8                                            
CONECT   10    9   11   11                                            
CONECT   11   10   10    7   26                                       
CONECT   12   17   17   13    9                                       
CONECT   13   14   14   12   27                                       
CONECT   14   15   13   13   28                                       
CONECT   15   16   16   14   29                                       
CONECT   16   15   15   17   30                                       
CONECT   17   16   12   12   31                                       
CONECT   18    3                                                      
CONECT   19    3                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    6                                                      
CONECT   25    8                                                      
CONECT   26   11                                                      
CONECT   27   13                                                      
CONECT   28   14                                                      
CONECT   29   15                                                      
CONECT   30   16                                                      
CONECT   31   17                                                      
CONECT   32    3   33                                                 
CONECT   33   32   34   35   36                                       
CONECT   34   33   37   38   39                                       
CONECT   35   33                                                      
CONECT   36   33                                                      
CONECT   37   34                                                      
CONECT   38   34                                                      
CONECT   39   34                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
