COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -6.004   0.860   0.057  1.00  0.00           N  
HETATM    2  O   UNL     1      -6.599  -1.256  -0.247  1.00  0.00           O  
HETATM    3  S   UNL     1      -3.323   1.661   0.250  1.00  0.00           S  
HETATM    4  C   UNL     1      -9.238  -1.000  -0.303  1.00  0.00           C  
HETATM    5  N   UNL     1      -4.179  -0.674  -0.097  1.00  0.00           N  
HETATM    6  O   UNL     1       8.151   1.307  -0.793  1.00  0.00           O  
HETATM    7  S   UNL     1       1.661   1.339   0.361  1.00  0.00           S  
HETATM    8  C   UNL     1      -6.937  -0.100  -0.104  1.00  0.00           C  
HETATM    9  N   UNL     1       0.104  -0.606   0.046  1.00  0.00           N  
HETATM   10  O   UNL     1       8.630  -0.509   0.391  1.00  0.00           O  
HETATM   11  C   UNL     1      -8.399   0.264  -0.105  1.00  0.00           C  
HETATM   12  N   UNL     1       2.370  -1.347   0.015  1.00  0.00           N  
HETATM   13  C   UNL     1      -4.655   0.525   0.053  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.870  -0.807  -0.074  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.195  -2.144  -0.236  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.174   0.333   0.104  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.701   0.449   0.165  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.077   1.628   0.346  1.00  0.00           C  
HETATM   19  C   UNL     1       1.380  -0.382   0.117  1.00  0.00           C  
HETATM   20  C   UNL     1       3.708  -0.970  -0.026  1.00  0.00           C  
HETATM   21  C   UNL     1       4.672  -1.760   0.596  1.00  0.00           C  
HETATM   22  C   UNL     1       5.991  -1.391   0.558  1.00  0.00           C  
HETATM   23  C   UNL     1       6.370  -0.220  -0.107  1.00  0.00           C  
HETATM   24  C   UNL     1       7.788   0.179  -0.151  1.00  0.00           C  
HETATM   25  C   UNL     1       5.399   0.570  -0.732  1.00  0.00           C  
HETATM   26  C   UNL     1       4.082   0.193  -0.694  1.00  0.00           C  
HETATM   27  H   UNL     1      -6.274   1.784   0.171  1.00  0.00           H  
HETATM   28  H   UNL     1     -10.296  -0.737  -0.304  1.00  0.00           H  
HETATM   29  H   UNL     1      -8.978  -1.464  -1.255  1.00  0.00           H  
HETATM   30  H   UNL     1      -9.039  -1.700   0.509  1.00  0.00           H  
HETATM   31  H   UNL     1       9.092   1.528  -0.794  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.599   0.963  -0.917  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.659   0.727   0.847  1.00  0.00           H  
HETATM   34  H   UNL     1       2.129  -2.286  -0.027  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.001  -2.328  -1.292  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.253  -2.145   0.312  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.843  -2.928   0.156  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.560   2.588   0.463  1.00  0.00           H  
HETATM   39  H   UNL     1       4.379  -2.664   1.110  1.00  0.00           H  
HETATM   40  H   UNL     1       6.738  -2.003   1.041  1.00  0.00           H  
HETATM   41  H   UNL     1       5.688   1.475  -1.246  1.00  0.00           H  
HETATM   42  H   UNL     1       3.332   0.801  -1.179  1.00  0.00           H  
CONECT    1   13    8   27                                            
CONECT    2    8    8                                                 
CONECT    3   16   13                                                 
CONECT    4   11   28   29   30                                       
CONECT    5   14   13   13                                            
CONECT    6   24   31                                                 
CONECT    7   19   18                                                 
CONECT    8    1    2    2   11                                       
CONECT    9   19   19   17                                            
CONECT   10   24   24                                                 
CONECT   11    4    8   32   33                                       
CONECT   12   20   19   34                                            
CONECT   13    1    3    5    5                                       
CONECT   14    5   16   16   15                                       
CONECT   15   14   35   36   37                                       
CONECT   16    3   14   14   17                                       
CONECT   17    9   16   18   18                                       
CONECT   18    7   17   17   38                                       
CONECT   19    7    9    9   12                                       
CONECT   20   12   26   26   21                                       
CONECT   21   20   22   22   39                                       
CONECT   22   21   21   23   40                                       
CONECT   23   22   25   25   24                                       
CONECT   24    6   10   10   23                                       
CONECT   25   23   23   26   41                                       
CONECT   26   20   20   25   42                                       
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   18                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   25                                                      
CONECT   42   26                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
