COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.489   0.518   0.223  1.00  0.00           C  
HETATM    2  C   UNL     1       5.660  -0.382   0.625  1.00  0.00           C  
HETATM    3  C   UNL     1       4.353  -2.338   0.054  1.00  0.00           C  
HETATM    4  C   UNL     1       3.182  -1.439  -0.348  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.000   1.961   0.355  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.678   1.256   0.189  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.472   0.899   0.003  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.020   1.171  -0.065  1.00  0.00           C  
HETATM    9  C   UNL     1       0.472   2.364  -0.448  1.00  0.00           C  
HETATM   10  C   UNL     1       2.138   0.609   0.156  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.047  -0.311  -0.092  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.458  -1.683  -0.274  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.486  -2.727   0.175  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.829  -2.520  -0.529  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.442  -1.211  -0.052  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.502  -0.085   0.024  1.00  0.00           C  
HETATM   17  N   UNL     1      -2.460   1.844   0.172  1.00  0.00           N  
HETATM   18  N   UNL     1       0.894   0.255   0.254  1.00  0.00           N  
HETATM   19  N   UNL     1       3.225  -0.200   0.442  1.00  0.00           N  
HETATM   20  N   UNL     1       5.617  -1.620  -0.165  1.00  0.00           N  
HETATM   21  O   UNL     1      -5.615  -1.107   0.242  1.00  0.00           O  
HETATM   22  S   UNL     1       2.231   2.279  -0.395  1.00  0.00           S  
HETATM   23  H   UNL     1       4.502   1.424   0.828  1.00  0.00           H  
HETATM   24  H   UNL     1       4.578   0.782  -0.831  1.00  0.00           H  
HETATM   25  H   UNL     1       6.599   0.138   0.436  1.00  0.00           H  
HETATM   26  H   UNL     1       5.585  -0.624   1.685  1.00  0.00           H  
HETATM   27  H   UNL     1       4.264  -2.602   1.108  1.00  0.00           H  
HETATM   28  H   UNL     1       4.340  -3.245  -0.550  1.00  0.00           H  
HETATM   29  H   UNL     1       3.257  -1.196  -1.408  1.00  0.00           H  
HETATM   30  H   UNL     1       2.243  -1.959  -0.159  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.386   2.243  -0.624  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.708   1.294   0.847  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.861   2.855   0.962  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.111   3.225  -0.739  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.214  -1.839  -1.325  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.554  -1.775   0.328  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.109  -3.723  -0.059  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.632  -2.644   1.252  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.672  -2.478  -1.607  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.498  -3.346  -0.288  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.305   2.797   0.265  1.00  0.00           H  
HETATM   42  H   UNL     1       5.758  -1.429  -1.145  1.00  0.00           H  
CONECT    1    2   19   23   24                                       
CONECT    2   20    1   25   26                                       
CONECT    3   20    4   27   28                                       
CONECT    4   19    3   29   30                                       
CONECT    5    6   31   32   33                                       
CONECT    6   16   16    5   17                                       
CONECT    7   11   11    8   17                                       
CONECT    8    7    9    9   18                                       
CONECT    9    8    8   22   34                                       
CONECT   10   22   18   18   19                                       
CONECT   11   12   16    7    7                                       
CONECT   12   13   11   35   36                                       
CONECT   13   14   12   37   38                                       
CONECT   14   13   15   39   40                                       
CONECT   15   14   21   21   16                                       
CONECT   16   15   11    6    6                                       
CONECT   17    7    6   41                                            
CONECT   18    8   10   10                                            
CONECT   19   10    1    4                                            
CONECT   20    2    3   42                                            
CONECT   21   15   15                                                 
CONECT   22    9   10                                                 
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    9                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   17                                                      
CONECT   42   20                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
