COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.340  -0.194   2.038  1.00  0.00           N  
HETATM    2  C   UNL     1       1.605   0.056   1.489  1.00  0.00           C  
HETATM    3  S   UNL     1      -0.999   0.345   1.191  1.00  0.00           S  
HETATM    4  O   UNL     1      -2.014  -0.631   1.379  1.00  0.00           O  
HETATM    5  O   UNL     1      -1.114   1.734   1.470  1.00  0.00           O  
HETATM    6  C   UNL     1       1.882   0.208   0.201  1.00  0.00           C  
HETATM    7  N   UNL     1       3.217   0.428  -0.179  1.00  0.00           N  
HETATM    8  C   UNL     1       0.196  -0.910   3.308  1.00  0.00           C  
HETATM    9  C   UNL     1       0.207   0.092   4.463  1.00  0.00           C  
HETATM   10  C   UNL     1       0.055  -0.655   5.790  1.00  0.00           C  
HETATM   11  O   UNL     1       0.065   0.281   6.869  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.078  -0.473   8.073  1.00  0.00           C  
HETATM   13  C   UNL     1       1.052   0.047  -2.239  1.00  0.00           C  
HETATM   14  C   UNL     1       0.833   0.154  -0.861  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.491   0.215  -0.475  1.00  0.00           C  
HETATM   16  S   UNL     1      -1.396   0.127  -1.979  1.00  0.00           S  
HETATM   17  C   UNL     1       0.000   0.010  -3.090  1.00  0.00           C  
HETATM   18  S   UNL     1       0.006  -0.118  -4.848  1.00  0.00           S  
HETATM   19  N   UNL     1      -0.030  -1.730  -5.226  1.00  0.00           N  
HETATM   20  O   UNL     1      -1.241   0.407  -5.278  1.00  0.00           O  
HETATM   21  O   UNL     1       1.283   0.346  -5.265  1.00  0.00           O  
HETATM   22  H   UNL     1       2.431   0.133   2.180  1.00  0.00           H  
HETATM   23  H   UNL     1       3.914   0.466   0.494  1.00  0.00           H  
HETATM   24  H   UNL     1       3.442   0.542  -1.116  1.00  0.00           H  
HETATM   25  H   UNL     1       1.023  -1.610   3.427  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.746  -1.457   3.311  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.619   0.792   4.345  1.00  0.00           H  
HETATM   28  H   UNL     1       1.149   0.639   4.460  1.00  0.00           H  
HETATM   29  H   UNL     1       0.882  -1.355   5.908  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.887  -1.202   5.793  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.075   0.202   8.928  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.019  -1.023   8.047  1.00  0.00           H  
HETATM   33  H   UNL     1       0.750  -1.176   8.163  1.00  0.00           H  
HETATM   34  H   UNL     1       2.060  -0.006  -2.623  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.032  -2.010  -6.155  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.050  -2.394  -4.519  1.00  0.00           H  
CONECT    1    2    3    8                                            
CONECT    2    1    6    6   22                                       
CONECT    3    1    4    4    5                                       
CONECT    3    5   15                                                 
CONECT    4    3    3                                                 
CONECT    5    3    3                                                 
CONECT    6    2    2    7   14                                       
CONECT    7    6   23   24                                            
CONECT    8    1    9   25   26                                       
CONECT    9    8   10   27   28                                       
CONECT   10    9   11   29   30                                       
CONECT   11   10   12                                                 
CONECT   12   11   31   32   33                                       
CONECT   13   14   17   17   34                                       
CONECT   14    6   13   15   15                                       
CONECT   15    3   14   14   16                                       
CONECT   16   15   17                                                 
CONECT   17   13   13   16   18                                       
CONECT   18   17   19   20   20                                       
CONECT   18   21   21                                                 
CONECT   19   18   35   36                                            
CONECT   20   18   18                                                 
CONECT   21   18   18                                                 
CONECT   22    2                                                      
CONECT   23    7                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26    8                                                      
CONECT   27    9                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   10                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
