COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK     1      -6.244  -1.101  -0.421  1.00  0.00           N  
HETATM    2  C   UNK     1      -4.035  -1.574   0.226  1.00  0.00           C  
HETATM    3  C   UNK     1      -1.904  -1.352   0.561  1.00  0.00           C  
HETATM    4  C   UNK     1      -5.851   0.084  -0.851  1.00  0.00           C  
HETATM    5  C   UNK     1      -5.383  -1.957   0.119  1.00  0.00           C  
HETATM    6  N   UNK     1      -4.600   0.485  -0.772  1.00  0.00           N  
HETATM    7  C   UNK     1      -3.668  -0.303  -0.246  1.00  0.00           C  
HETATM    8  O   UNK     1       7.673  -0.215   0.304  1.00  0.00           O  
HETATM    9  C   UNK     1       6.705  -1.141   0.222  1.00  0.00           C  
HETATM   10  O   UNK     1       6.830  -2.197   0.795  1.00  0.00           O  
HETATM   11  C   UNK     1       5.463  -0.864  -0.585  1.00  0.00           C  
HETATM   12  N   UNK     1       4.803  -2.133  -0.920  1.00  0.00           N  
HETATM   13  C   UNK     1       4.507   0.007   0.233  1.00  0.00           C  
HETATM   14  S   UNK     1       3.012   0.341  -0.739  1.00  0.00           S  
HETATM   15  C   UNK     1       2.020   1.368   0.379  1.00  0.00           C  
HETATM   16  C   UNK     1       0.702   1.741  -0.305  1.00  0.00           C  
HETATM   17  O   UNK     1      -0.099   0.563  -0.496  1.00  0.00           O  
HETATM   18  C   UNK     1      -0.101   2.701   0.594  1.00  0.00           C  
HETATM   19  O   UNK     1      -0.327   3.942  -0.078  1.00  0.00           O  
HETATM   20  C   UNK     1      -1.441   1.963   0.835  1.00  0.00           C  
HETATM   21  O   UNK     1      -2.542   2.872   0.772  1.00  0.00           O  
HETATM   22  C   UNK     1      -1.479   0.964  -0.349  1.00  0.00           C  
HETATM   23  N   UNK     1      -2.319  -0.191  -0.022  1.00  0.00           N  
HETATM   24  N   UNK     1      -2.913  -2.162   0.704  1.00  0.00           N  
HETATM   25  N   UNK     1      -5.804  -3.197   0.567  1.00  0.00           N  
HETATM   26  H   UNK     1      -0.889  -1.567   0.857  1.00  0.00           H  
HETATM   27  H   UNK     1      -6.584   0.749  -1.284  1.00  0.00           H  
HETATM   28  H   UNK     1       8.451  -0.438   0.833  1.00  0.00           H  
HETATM   29  H   UNK     1       5.735  -0.342  -1.503  1.00  0.00           H  
HETATM   30  H   UNK     1       4.541  -2.636  -0.086  1.00  0.00           H  
HETATM   31  H   UNK     1       4.003  -1.979  -1.515  1.00  0.00           H  
HETATM   32  H   UNK     1       4.235  -0.514   1.150  1.00  0.00           H  
HETATM   33  H   UNK     1       4.996   0.949   0.481  1.00  0.00           H  
HETATM   34  H   UNK     1       1.810   0.812   1.293  1.00  0.00           H  
HETATM   35  H   UNK     1       2.571   2.276   0.624  1.00  0.00           H  
HETATM   36  H   UNK     1       0.905   2.211  -1.267  1.00  0.00           H  
HETATM   37  H   UNK     1       0.419   2.866   1.537  1.00  0.00           H  
HETATM   38  H   UNK     1      -0.829   4.585   0.442  1.00  0.00           H  
HETATM   39  H   UNK     1      -1.428   1.436   1.789  1.00  0.00           H  
HETATM   40  H   UNK     1      -2.513   3.572   1.439  1.00  0.00           H  
HETATM   41  H   UNK     1      -1.834   1.454  -1.255  1.00  0.00           H  
HETATM   42  H   UNK     1      -6.738  -3.450   0.489  1.00  0.00           H  
HETATM   43  H   UNK     1      -5.166  -3.813   0.961  1.00  0.00           H  
CONECT    1    4    5    5                                            
CONECT    2    7    7    5   24                                       
CONECT    3   23   24   24   26                                       
CONECT    4    6    6    1   27                                       
CONECT    5    1    1    2   25                                       
CONECT    6    4    4    7                                            
CONECT    7    6   23    2    2                                       
CONECT    8    9   28                                                 
CONECT    9   10   10   11    8                                       
CONECT   10    9    9                                                 
CONECT   11   12    9   13   29                                       
CONECT   12   11   30   31                                            
CONECT   13   11   14   32   33                                       
CONECT   14   13   15                                                 
CONECT   15   14   16   34   35                                       
CONECT   16   15   17   18   36                                       
CONECT   17   16   22                                                 
CONECT   18   16   19   20   37                                       
CONECT   19   18   38                                                 
CONECT   20   21   22   18   39                                       
CONECT   21   20   40                                                 
CONECT   22   17   20   23   41                                       
CONECT   23   22    7    3                                            
CONECT   24    2    3    3                                            
CONECT   25    5   42   43                                            
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    8                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   25                                                      
CONECT   43   25                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
