COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.596  -0.975   0.242  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.162   0.623  -0.125  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.010   1.729   0.062  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.948   3.012   0.251  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.958   0.548   0.079  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.498  -1.060   0.039  1.00  0.00           C  
HETATM    7  C   UNL     1       2.172  -0.486   0.208  1.00  0.00           C  
HETATM    8  C   UNL     1       4.350   1.352   0.441  1.00  0.00           C  
HETATM    9  C   UNL     1       5.227   2.066  -0.594  1.00  0.00           C  
HETATM   10  C   UNL     1       6.806   0.259  -0.645  1.00  0.00           C  
HETATM   11  C   UNL     1       6.009  -0.548   0.388  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.664  -0.645  -0.038  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.066  -0.608  -0.115  1.00  0.00           C  
HETATM   14  N   UNL     1      -4.700   0.581  -0.057  1.00  0.00           N  
HETATM   15  N   UNL     1      -2.665   1.740   0.127  1.00  0.00           N  
HETATM   16  N   UNL     1      -0.659   0.245   0.122  1.00  0.00           N  
HETATM   17  N   UNL     1       4.610  -0.094   0.352  1.00  0.00           N  
HETATM   18  N   UNL     1      -1.716  -1.660  -0.062  1.00  0.00           N  
HETATM   19  O   UNL     1       6.585   1.654  -0.424  1.00  0.00           O  
HETATM   20  O   UNL     1       3.831  -2.164   0.176  1.00  0.00           O  
HETATM   21  O   UNL     1      -4.615   2.783   0.106  1.00  0.00           O  
HETATM   22  S   UNL     1       1.051  -1.899   0.055  1.00  0.00           S  
HETATM   23  S   UNL     1      -4.963  -2.059  -0.259  1.00  0.00           S  
HETATM   24  H   UNL     1      -6.551  -0.391  -0.219  1.00  0.00           H  
HETATM   25  H   UNL     1      -6.555   1.080   0.783  1.00  0.00           H  
HETATM   26  H   UNL     1      -6.469   1.212  -0.990  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.665   3.832   0.273  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.366   3.013   1.172  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.280   3.137  -0.601  1.00  0.00           H  
HETATM   30  H   UNL     1       1.951   0.056   1.128  1.00  0.00           H  
HETATM   31  H   UNL     1       2.037   0.179  -0.646  1.00  0.00           H  
HETATM   32  H   UNL     1       4.597   1.709   1.441  1.00  0.00           H  
HETATM   33  H   UNL     1       3.299   1.549   0.230  1.00  0.00           H  
HETATM   34  H   UNL     1       4.890   1.806  -1.598  1.00  0.00           H  
HETATM   35  H   UNL     1       5.152   3.144  -0.453  1.00  0.00           H  
HETATM   36  H   UNL     1       7.868   0.037  -0.539  1.00  0.00           H  
HETATM   37  H   UNL     1       6.476  -0.007  -1.649  1.00  0.00           H  
HETATM   38  H   UNL     1       6.057  -1.609   0.142  1.00  0.00           H  
HETATM   39  H   UNL     1       6.423  -0.383   1.383  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.889  -2.611  -0.136  1.00  0.00           H  
CONECT    1   20   20   17    7                                       
CONECT    2   14   24   25   26                                       
CONECT    3   14   15   21   21                                       
CONECT    4   15   27   28   29                                       
CONECT    5   12   12   16   15                                       
CONECT    6   18   22   16   16                                       
CONECT    7    1   22   30   31                                       
CONECT    8    9   17   32   33                                       
CONECT    9   19    8   34   35                                       
CONECT   10   11   19   36   37                                       
CONECT   11   10   17   38   39                                       
CONECT   12   13   18    5    5                                       
CONECT   13   23   23   12   14                                       
CONECT   14   13    2    3                                            
CONECT   15    5    3    4                                            
CONECT   16    6    6    5                                            
CONECT   17   11    1    8                                            
CONECT   18   12    6   40                                            
CONECT   19   10    9                                                 
CONECT   20    1    1                                                 
CONECT   21    3    3                                                 
CONECT   22    7    6                                                 
CONECT   23   13   13                                                 
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   18                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
