COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.017  -0.360  -0.261  1.00  0.00           C  
HETATM    2  N   UNL     1      -0.622  -0.671   0.062  1.00  0.00           N  
HETATM    3  S   UNL     1       0.001   0.743  -2.099  1.00  0.00           S  
HETATM    4  C   UNL     1      -2.905  -1.550   0.112  1.00  0.00           C  
HETATM    5  N   UNL     1       1.654  -0.494  -0.427  1.00  0.00           N  
HETATM    6  O   UNL     1      -2.529  -2.689  -0.665  1.00  0.00           O  
HETATM    7  C   UNL     1      -4.367  -1.195  -0.172  1.00  0.00           C  
HETATM    8  N   UNL     1       1.956  -1.273   0.698  1.00  0.00           N  
HETATM    9  O   UNL     1      -5.210  -2.273   0.242  1.00  0.00           O  
HETATM   10  C   UNL     1      -4.734   0.071   0.608  1.00  0.00           C  
HETATM   11  O   UNL     1      -6.075   0.453   0.295  1.00  0.00           O  
HETATM   12  C   UNL     1      -3.776   1.199   0.216  1.00  0.00           C  
HETATM   13  O   UNL     1      -2.431   0.791   0.477  1.00  0.00           O  
HETATM   14  C   UNL     1      -4.098   2.450   1.035  1.00  0.00           C  
HETATM   15  O   UNL     1      -3.283   3.535   0.588  1.00  0.00           O  
HETATM   16  C   UNL     1       0.370  -0.208  -0.724  1.00  0.00           C  
HETATM   17  O   UNL     1       7.864  -0.239   0.445  1.00  0.00           O  
HETATM   18  C   UNL     1       3.192  -1.449   1.052  1.00  0.00           C  
HETATM   19  C   UNL     1       4.228  -0.498   0.610  1.00  0.00           C  
HETATM   20  C   UNL     1       5.580  -0.824   0.739  1.00  0.00           C  
HETATM   21  C   UNL     1       6.547   0.074   0.321  1.00  0.00           C  
HETATM   22  C   UNL     1       6.173   1.295  -0.224  1.00  0.00           C  
HETATM   23  C   UNL     1       4.835   1.620  -0.352  1.00  0.00           C  
HETATM   24  C   UNL     1       3.862   0.731   0.055  1.00  0.00           C  
HETATM   25  H   UNL     1      -2.107  -0.160  -1.328  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.413  -1.210   0.841  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.784  -1.777   1.172  1.00  0.00           H  
HETATM   28  H   UNL     1       2.368  -0.161  -0.993  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.611  -2.967  -0.538  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.499  -1.017  -1.239  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.028  -3.109  -0.207  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.651  -0.123   1.678  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.737  -0.218   0.513  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.890   1.419  -0.845  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.149   2.708   0.906  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.899   2.256   2.089  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.434   4.363   1.064  1.00  0.00           H  
HETATM   38  H   UNL     1       8.234  -0.693  -0.324  1.00  0.00           H  
HETATM   39  H   UNL     1       3.461  -2.293   1.670  1.00  0.00           H  
HETATM   40  H   UNL     1       5.869  -1.774   1.163  1.00  0.00           H  
HETATM   41  H   UNL     1       6.930   1.994  -0.548  1.00  0.00           H  
HETATM   42  H   UNL     1       4.550   2.572  -0.776  1.00  0.00           H  
HETATM   43  H   UNL     1       2.818   0.987  -0.050  1.00  0.00           H  
CONECT    1    4   13    2   25                                       
CONECT    2    1   16   26                                            
CONECT    3   16   16                                                 
CONECT    4    1    7    6   27                                       
CONECT    5   16    8   28                                            
CONECT    6    4   29                                                 
CONECT    7    4    9   10   30                                       
CONECT    8    5   18   18                                            
CONECT    9    7   31                                                 
CONECT   10    7   11   12   32                                       
CONECT   11   10   33                                                 
CONECT   12   10   14   13   34                                       
CONECT   13    1   12                                                 
CONECT   14   12   15   35   36                                       
CONECT   15   14   37                                                 
CONECT   16    2    3    3    5                                       
CONECT   17   21   38                                                 
CONECT   18    8    8   19   39                                       
CONECT   19   18   20   20   24                                       
CONECT   20   19   19   21   40                                       
CONECT   21   17   20   22   22                                       
CONECT   22   21   21   23   41                                       
CONECT   23   22   24   24   42                                       
CONECT   24   19   23   23   43                                       
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   20                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
