COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK     1       4.310  -3.814   0.230  1.00  0.00           C  
HETATM    2  N   UNK     1       4.912  -2.488   0.422  1.00  0.00           N  
HETATM    3  C   UNK     1       6.184  -2.492  -0.313  1.00  0.00           C  
HETATM    4  C   UNK     1       4.080  -1.575  -0.223  1.00  0.00           C  
HETATM    5  C   UNK     1       3.845  -1.682  -1.577  1.00  0.00           C  
HETATM    6  C   UNK     1       3.016  -0.775  -2.229  1.00  0.00           C  
HETATM    7  C   UNK     1       2.417   0.243  -1.552  1.00  0.00           C  
HETATM    8  C   UNK     1       2.630   0.388  -0.171  1.00  0.00           C  
HETATM    9  C   UNK     1       2.024   1.429   0.554  1.00  0.00           C  
HETATM   10  S   UNK     1       0.979   2.587  -0.265  1.00  0.00           S  
HETATM   11  O   UNK     1       1.697   3.006  -1.417  1.00  0.00           O  
HETATM   12  O   UNK     1       0.483   3.446   0.752  1.00  0.00           O  
HETATM   13  N   UNK     1      -0.335   1.755  -0.832  1.00  0.00           N  
HETATM   14  C   UNK     1      -1.260   1.117   0.109  1.00  0.00           C  
HETATM   15  C   UNK     1      -2.566   0.777  -0.611  1.00  0.00           C  
HETATM   16  C   UNK     1      -3.532   0.112   0.371  1.00  0.00           C  
HETATM   17  C   UNK     1      -4.838  -0.229  -0.349  1.00  0.00           C  
HETATM   18  C   UNK     1      -5.804  -0.894   0.633  1.00  0.00           C  
HETATM   19  C   UNK     1      -7.133  -1.118  -0.042  1.00  0.00           C  
HETATM   20  O   UNK     1      -8.004  -0.104  -0.160  1.00  0.00           O  
HETATM   21  O   UNK     1      -7.413  -2.210  -0.477  1.00  0.00           O  
HETATM   22  N   UNK     1      -5.251  -2.185   1.066  1.00  0.00           N  
HETATM   23  C   UNK     1       2.255   1.542   1.891  1.00  0.00           C  
HETATM   24  C   UNK     1       3.079   0.636   2.556  1.00  0.00           C  
HETATM   25  C   UNK     1       3.678  -0.387   1.886  1.00  0.00           C  
HETATM   26  C   UNK     1       3.467  -0.533   0.506  1.00  0.00           C  
HETATM   27  H   UNK     1       3.358  -3.861   0.760  1.00  0.00           H  
HETATM   28  H   UNK     1       4.143  -3.988  -0.833  1.00  0.00           H  
HETATM   29  H   UNK     1       4.981  -4.578   0.622  1.00  0.00           H  
HETATM   30  H   UNK     1       6.006  -2.791  -1.346  1.00  0.00           H  
HETATM   31  H   UNK     1       6.618  -1.493  -0.294  1.00  0.00           H  
HETATM   32  H   UNK     1       6.872  -3.196   0.155  1.00  0.00           H  
HETATM   33  H   UNK     1       4.309  -2.480  -2.138  1.00  0.00           H  
HETATM   34  H   UNK     1       2.847  -0.879  -3.291  1.00  0.00           H  
HETATM   35  H   UNK     1       1.777   0.938  -2.076  1.00  0.00           H  
HETATM   36  H   UNK     1      -0.493   1.689  -1.786  1.00  0.00           H  
HETATM   37  H   UNK     1      -0.811   0.203   0.498  1.00  0.00           H  
HETATM   38  H   UNK     1      -1.467   1.800   0.934  1.00  0.00           H  
HETATM   39  H   UNK     1      -3.016   1.691  -1.000  1.00  0.00           H  
HETATM   40  H   UNK     1      -2.359   0.095  -1.436  1.00  0.00           H  
HETATM   41  H   UNK     1      -3.083  -0.802   0.760  1.00  0.00           H  
HETATM   42  H   UNK     1      -3.739   0.794   1.196  1.00  0.00           H  
HETATM   43  H   UNK     1      -5.288   0.685  -0.738  1.00  0.00           H  
HETATM   44  H   UNK     1      -4.631  -0.911  -1.174  1.00  0.00           H  
HETATM   45  H   UNK     1      -5.942  -0.249   1.501  1.00  0.00           H  
HETATM   46  H   UNK     1      -8.857  -0.248  -0.593  1.00  0.00           H  
HETATM   47  H   UNK     1      -5.961  -2.632   1.626  1.00  0.00           H  
HETATM   48  H   UNK     1      -5.141  -2.746   0.234  1.00  0.00           H  
HETATM   49  H   UNK     1       1.791   2.345   2.445  1.00  0.00           H  
HETATM   50  H   UNK     1       3.243   0.746   3.617  1.00  0.00           H  
HETATM   51  H   UNK     1       4.314  -1.083   2.414  1.00  0.00           H  
CONECT    1    2   27   28   29                                       
CONECT    2    1    3    4                                            
CONECT    3    2   30   31   32                                       
CONECT    4    2    5   26   26                                       
CONECT    5    4    6    6   33                                       
CONECT    6    5    5    7   34                                       
CONECT    7    6    8    8   35                                       
CONECT    8    7    7    9   26                                       
CONECT    9    8   10   23   23                                       
CONECT   10    9   11   11   12                                       
CONECT   10   12   13                                                 
CONECT   11   10   10                                                 
CONECT   12   10   10                                                 
CONECT   13   10   14   36                                            
CONECT   14   13   15   37   38                                       
CONECT   15   14   16   39   40                                       
CONECT   16   15   17   41   42                                       
CONECT   17   16   18   43   44                                       
CONECT   18   17   19   22   45                                       
CONECT   19   18   20   21   21                                       
CONECT   20   19   46                                                 
CONECT   21   19   19                                                 
CONECT   22   18   47   48                                            
CONECT   23    9    9   24   49                                       
CONECT   24   23   25   25   50                                       
CONECT   25   24   24   26   51                                       
CONECT   26    4    4    8   25                                       
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   20                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
