COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.918   1.971   0.005  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.925   1.266   0.005  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.031  -0.199   0.001  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.265  -0.847  -0.004  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.310  -2.223  -0.008  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.138  -2.969  -0.008  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.909  -2.350  -0.004  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.836  -0.955   0.001  1.00  0.00           C  
HETATM    9  N   UNL     1      -3.684   1.805   0.004  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.579   1.001   0.003  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.647  -0.307   0.006  1.00  0.00           N  
HETATM   12  S   UNL     1      -0.989   1.760   0.001  1.00  0.00           S  
HETATM   13  C   UNL     1       0.062   0.286   0.001  1.00  0.00           C  
HETATM   14  C   UNL     1       1.510   0.702  -0.001  1.00  0.00           C  
HETATM   15  O   UNL     1       1.803   1.879  -0.002  1.00  0.00           O  
HETATM   16  N   UNL     1       2.480  -0.234   0.000  1.00  0.00           N  
HETATM   17  C   UNL     1       3.813   0.149  -0.002  1.00  0.00           C  
HETATM   18  S   UNL     1       4.358   1.764  -0.004  1.00  0.00           S  
HETATM   19  C   UNL     1       6.043   1.278  -0.006  1.00  0.00           C  
HETATM   20  C   UNL     1       6.152  -0.043  -0.005  1.00  0.00           C  
HETATM   21  C   UNL     1       4.874  -0.719   0.003  1.00  0.00           C  
HETATM   22  C   UNL     1       4.727  -2.178   0.006  1.00  0.00           C  
HETATM   23  O   UNL     1       3.618  -2.679   0.013  1.00  0.00           O  
HETATM   24  N   UNL     1       5.822  -2.965   0.000  1.00  0.00           N  
HETATM   25  H   UNL     1      -7.180  -0.273  -0.004  1.00  0.00           H  
HETATM   26  H   UNL     1      -7.265  -2.728  -0.011  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.192  -4.048  -0.011  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.004  -2.941  -0.004  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.144  -0.307   0.892  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.146  -0.309  -0.888  1.00  0.00           H  
HETATM   31  H   UNL     1       2.246  -1.175   0.001  1.00  0.00           H  
HETATM   32  H   UNL     1       6.879   1.962  -0.008  1.00  0.00           H  
HETATM   33  H   UNL     1       7.100  -0.562  -0.002  1.00  0.00           H  
HETATM   34  H   UNL     1       5.725  -3.930   0.002  1.00  0.00           H  
HETATM   35  H   UNL     1       6.706  -2.566  -0.006  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.577   2.769   0.002  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1    9                                       
CONECT    3    4    4    8    2                                       
CONECT    4    5    3    3   25                                       
CONECT    5    6    6    4   26                                       
CONECT    6    5    5    7   27                                       
CONECT    7    6    8    8   28                                       
CONECT    8    7    7    3   11                                       
CONECT    9    2   10   36                                            
CONECT   10   11   11    9   12                                       
CONECT   11    8   10   10                                            
CONECT   12   13   10                                                 
CONECT   13   14   12   29   30                                       
CONECT   14   16   15   15   13                                       
CONECT   15   14   14                                                 
CONECT   16   17   14   31                                            
CONECT   17   21   21   18   16                                       
CONECT   18   19   17                                                 
CONECT   19   20   20   18   32                                       
CONECT   20   21   19   19   33                                       
CONECT   21   22   20   17   17                                       
CONECT   22   24   23   23   21                                       
CONECT   23   22   22                                                 
CONECT   24   22   34   35                                            
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29   13                                                      
CONECT   30   13                                                      
CONECT   31   16                                                      
CONECT   32   19                                                      
CONECT   33   20                                                      
CONECT   34   24                                                      
CONECT   35   24                                                      
CONECT   36    9                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
