COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0       4.356  -2.453   0.040  1.00  0.00           C  
HETATM    2  C   UNK A   0       5.044  -1.730  -0.925  1.00  0.00           C  
HETATM    3  C   UNK A   0       4.615  -0.477  -1.305  1.00  0.00           C  
HETATM    4  C   UNK A   0       3.480   0.073  -0.717  1.00  0.00           C  
HETATM    5  C   UNK A   0       2.785  -0.664   0.261  1.00  0.00           C  
HETATM    6  C   UNK A   0       3.236  -1.936   0.626  1.00  0.00           C  
HETATM    7  N   UNK A   0       2.819   1.270  -0.879  1.00  0.00           N  
HETATM    8  C   UNK A   0       1.730   1.318  -0.040  1.00  0.00           C  
HETATM    9  C   UNK A   0       1.659   0.169   0.678  1.00  0.00           C  
HETATM   10  C   UNK A   0       0.782   2.448   0.064  1.00  0.00           C  
HETATM   11  C   UNK A   0       0.617  -0.181   1.709  1.00  0.00           C  
HETATM   12  C   UNK A   0      -0.537  -0.882   1.039  1.00  0.00           C  
HETATM   13  C   UNK A   0       0.289   3.058  -1.090  1.00  0.00           C  
HETATM   14  C   UNK A   0      -0.594   4.113  -0.986  1.00  0.00           C  
HETATM   15  C   UNK A   0      -0.991   4.566   0.260  1.00  0.00           C  
HETATM   16  C   UNK A   0      -0.506   3.966   1.408  1.00  0.00           C  
HETATM   17  C   UNK A   0       0.373   2.907   1.317  1.00  0.00           C  
HETATM   18  N   UNK A   1      -1.535  -0.163   0.577  1.00  0.00           N  
HETATM   19  C   UNK A   1      -2.577  -0.742  -0.023  1.00  0.00           C  
HETATM   20  C   UNK A   1      -2.592  -2.133  -0.155  1.00  0.00           C  
HETATM   21  C   UNK A   1      -1.503  -2.856   0.355  1.00  0.00           C  
HETATM   22  N   UNK A   1      -0.509  -2.197   0.931  1.00  0.00           N  
HETATM   23  C   UNK A   1      -3.697   0.075  -0.540  1.00  0.00           C  
HETATM   24  O   UNK A   1      -3.630  -2.766  -0.757  1.00  0.00           O  
HETATM   25  O   UNK A   1      -1.466  -4.208   0.255  1.00  0.00           O  
HETATM   26  O   UNK A   1      -4.640  -0.462  -1.085  1.00  0.00           O  
HETATM   27  O   UNK A   1      -3.671   1.416  -0.407  1.00  0.00           O  
HETATM   28  H   UNK A   0       4.706  -3.434   0.326  1.00  0.00           H  
HETATM   29  H   UNK A   0       5.926  -2.154  -1.383  1.00  0.00           H  
HETATM   30  H   UNK A   0       5.158   0.077  -2.056  1.00  0.00           H  
HETATM   31  H   UNK A   0       2.706  -2.504   1.376  1.00  0.00           H  
HETATM   32  H   UNK A   0       1.055  -0.839   2.459  1.00  0.00           H  
HETATM   33  H   UNK A   0       0.260   0.730   2.189  1.00  0.00           H  
HETATM   34  H   UNK A   0       0.599   2.706  -2.063  1.00  0.00           H  
HETATM   35  H   UNK A   0      -0.977   4.586  -1.878  1.00  0.00           H  
HETATM   36  H   UNK A   0      -1.682   5.393   0.336  1.00  0.00           H  
HETATM   37  H   UNK A   0      -0.819   4.325   2.377  1.00  0.00           H  
HETATM   38  H   UNK A   0       0.752   2.439   2.214  1.00  0.00           H  
HETATM   39  H   UNK A   1      -4.425   1.907  -0.760  1.00  0.00           H  
HETATM   40  H   UNK A   0       3.081   1.973  -1.493  1.00  0.00           H  
HETATM   41  H   UNK A   1      -3.521  -2.881  -1.711  1.00  0.00           H  
HETATM   42  H   UNK A   1      -1.045  -4.531  -0.553  1.00  0.00           H  
CONECT    1   28    2    6    6                                       
CONECT    2    1   29    3    3                                       
CONECT    3    2    2   30    4                                       
CONECT    4    3    5    5    7                                       
CONECT    5    4    4    6    9                                       
CONECT    6    5    1    1   31                                       
CONECT    7    4   40    8                                            
CONECT    8    7    9    9   10                                       
CONECT    9    8    8    5   11                                       
CONECT   10    8   13   13   17                                       
CONECT   11    9   32   33   12                                       
CONECT   12   11   22   22   18                                       
CONECT   13   10   10   34   14                                       
CONECT   14   13   35   15   15                                       
CONECT   15   14   14   16   36                                       
CONECT   16   15   17   17   37                                       
CONECT   17   16   16   10   38                                       
CONECT   18   12   19   19                                            
CONECT   19   18   18   20   23                                       
CONECT   20   19   21   21   24                                       
CONECT   21   20   20   22   25                                       
CONECT   22   12   12   21                                            
CONECT   23   19   26   26   27                                       
CONECT   24   20   41                                                 
CONECT   25   21   42                                                 
CONECT   26   23   23                                                 
CONECT   27   23   39                                                 
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    6                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   27                                                      
CONECT   40    7                                                      
CONECT   41   24                                                      
CONECT   42   25                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
