COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.736  -1.631   0.114  1.00  0.00           C  
HETATM    2  C   UNL     1       3.182   1.128   1.674  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.568   0.512  -0.533  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.615  -0.212   0.247  1.00  0.00           C  
HETATM    5  C   UNL     1       1.348  -1.070  -0.055  1.00  0.00           C  
HETATM    6  C   UNL     1       1.161   0.300  -0.121  1.00  0.00           C  
HETATM    7  C   UNL     1       0.265  -1.926  -0.149  1.00  0.00           C  
HETATM    8  C   UNL     1       2.800  -2.454   1.402  1.00  0.00           C  
HETATM    9  C   UNL     1       3.073  -2.526  -1.080  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.107   0.819  -0.276  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.203  -0.039  -0.366  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.008  -1.419  -0.304  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.618  -0.314  -0.619  1.00  0.00           N  
HETATM   14  N   UNL     1      -4.518   0.652   1.298  1.00  0.00           N  
HETATM   15  N   UNL     1      -5.737  -0.970   0.089  1.00  0.00           N  
HETATM   16  O   UNL     1       1.988   2.682  -0.136  1.00  0.00           O  
HETATM   17  O   UNL     1       3.465   0.880  -0.967  1.00  0.00           O  
HETATM   18  O   UNL     1      -2.735   1.718  -0.591  1.00  0.00           O  
HETATM   19  S   UNL     1       2.547   1.382  -0.006  1.00  0.00           S  
HETATM   20  H   UNL     1       3.454  -0.813   0.169  1.00  0.00           H  
HETATM   21  H   UNL     1       2.407   1.380   2.398  1.00  0.00           H  
HETATM   22  H   UNL     1       3.470   0.084   1.799  1.00  0.00           H  
HETATM   23  H   UNL     1       4.051   1.766   1.834  1.00  0.00           H  
HETATM   24  H   UNL     1       0.418  -2.994  -0.101  1.00  0.00           H  
HETATM   25  H   UNL     1       2.082  -3.272   1.347  1.00  0.00           H  
HETATM   26  H   UNL     1       3.805  -2.860   1.524  1.00  0.00           H  
HETATM   27  H   UNL     1       2.560  -1.816   2.253  1.00  0.00           H  
HETATM   28  H   UNL     1       3.027  -1.939  -1.998  1.00  0.00           H  
HETATM   29  H   UNL     1       4.078  -2.931  -0.958  1.00  0.00           H  
HETATM   30  H   UNL     1       2.355  -3.344  -1.135  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.252   1.888  -0.327  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.852  -2.088  -0.378  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.686   1.121   1.465  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.282   0.797   1.878  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.467  -0.895   0.723  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.806  -1.584  -0.659  1.00  0.00           H  
CONECT    1    9    8    5   20                                       
CONECT    2   19   21   22   23                                       
CONECT    3   11   18   18   13                                       
CONECT    4   15   13   13   14                                       
CONECT    5    1    7    7    6                                       
CONECT    6    5   19   10   10                                       
CONECT    7    5    5   12   24                                       
CONECT    8    1   25   26   27                                       
CONECT    9    1   28   29   30                                       
CONECT   10    6    6   11   31                                       
CONECT   11   12   12   10    3                                       
CONECT   12    7   11   11   32                                       
CONECT   13    3    4    4                                            
CONECT   14    4   33   34                                            
CONECT   15    4   35   36                                            
CONECT   16   19   19                                                 
CONECT   17   19   19                                                 
CONECT   18    3    3                                                 
CONECT   19   16   16    2    6                                       
CONECT   19   17   17                                                 
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    2                                                      
CONECT   23    2                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    8                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   12                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
