COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.424   1.835   2.123  1.00  0.00           C  
HETATM    2  N   UNL     1       0.255  -1.909   0.736  1.00  0.00           N  
HETATM    3  C   UNL     1       5.943   0.275  -1.897  1.00  0.00           C  
HETATM    4  C   UNL     1       6.433   0.877  -0.745  1.00  0.00           C  
HETATM    5  C   UNL     1       5.608   0.952   0.362  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.393   1.251   1.406  1.00  0.00           C  
HETATM    7  C   UNL     1       4.657  -0.228  -1.903  1.00  0.00           C  
HETATM    8  C   UNL     1       4.322   0.424   0.286  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.018   2.830  -1.969  1.00  0.00           C  
HETATM   10  C   UNL     1       1.399  -1.442   1.200  1.00  0.00           C  
HETATM   11  C   UNL     1       1.728  -0.101   1.061  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.618  -1.128   0.123  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.281   2.711   1.482  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.153   2.468  -0.512  1.00  0.00           C  
HETATM   15  C   UNL     1       0.835   0.756   0.421  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.358   0.231  -0.054  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.816  -1.670  -0.352  1.00  0.00           N  
HETATM   18  O   UNL     1      -1.260   1.029  -0.685  1.00  0.00           O  
HETATM   19  C   UNL     1      -2.257   1.576   0.059  1.00  0.00           C  
HETATM   20  S   UNL     1       3.258   0.511   1.687  1.00  0.00           S  
HETATM   21  N   UNL     1       3.894  -0.147  -0.830  1.00  0.00           N  
HETATM   22  N   UNL     1      -4.127   2.994   0.203  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.839   1.856  -2.815  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.075  -2.982  -0.184  1.00  0.00           C  
HETATM   25  O   UNL     1      -1.267  -3.694   0.380  1.00  0.00           O  
HETATM   26  N   UNL     1      -3.230  -3.505  -0.642  1.00  0.00           N  
HETATM   27  C   UNL     1      -3.511  -4.931  -0.460  1.00  0.00           C  
HETATM   28  H   UNL     1      -3.560   1.605   3.169  1.00  0.00           H  
HETATM   29  H   UNL     1       6.560   0.205  -2.780  1.00  0.00           H  
HETATM   30  H   UNL     1       7.435   1.278  -0.715  1.00  0.00           H  
HETATM   31  H   UNL     1       5.957   1.413   1.275  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.711   0.560   1.880  1.00  0.00           H  
HETATM   33  H   UNL     1       4.271  -0.692  -2.799  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.383   3.845  -2.126  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.969   2.772  -2.262  1.00  0.00           H  
HETATM   36  H   UNL     1       2.087  -2.111   1.695  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.086   3.169   2.036  1.00  0.00           H  
HETATM   38  H   UNL     1       1.065   1.804   0.299  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.460  -1.102  -0.802  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.741   2.118  -3.868  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.473   0.841  -2.658  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.887   1.914  -2.522  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.874  -2.937  -1.093  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.740  -5.520  -0.956  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.520  -5.167   0.604  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.484  -5.168  -0.892  1.00  0.00           H  
CONECT    1   13    6    6   28                                       
CONECT    2   12   10   10                                            
CONECT    3    4    7    7   29                                       
CONECT    4    5    5    3   30                                       
CONECT    5    4    4    8   31                                       
CONECT    6    1    1   19   32                                       
CONECT    7    3    3   21   33                                       
CONECT    8    5   20   21   21                                       
CONECT    9   14   23   34   35                                       
CONECT   10    2    2   11   36                                       
CONECT   11   15   15   10   20                                       
CONECT   12   17   16   16    2                                       
CONECT   13   22   22    1   37                                       
CONECT   14   22    9   19   19                                       
CONECT   15   16   11   11   38                                       
CONECT   16   18   12   12   15                                       
CONECT   17   24   12   39                                            
CONECT   18   19   16                                                 
CONECT   19   14   14    6   18                                       
CONECT   20   11    8                                                 
CONECT   21    8    8    7                                            
CONECT   22   13   13   14                                            
CONECT   23    9   40   41   42                                       
CONECT   24   25   25   17   26                                       
CONECT   25   24   24                                                 
CONECT   26   24   27   43                                            
CONECT   27   26   44   45   46                                       
CONECT   28    1                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
CONECT   43   26                                                      
CONECT   44   27                                                      
CONECT   45   27                                                      
CONECT   46   27                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
