COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.966   2.069  -1.657  1.00  0.00           N  
HETATM    2  O   UNL     1       3.446   3.588   1.350  1.00  0.00           O  
HETATM    3  O   UNL     1       3.353   3.198  -0.823  1.00  0.00           O  
HETATM    4  C   UNL     1       3.006   2.889   0.292  1.00  0.00           C  
HETATM    5  C   UNL     1       2.080   1.718   0.495  1.00  0.00           C  
HETATM    6  C   UNL     1       1.732   1.101  -0.861  1.00  0.00           C  
HETATM    7  C   UNL     1       0.907  -0.142  -0.651  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.380  -0.147  -0.495  1.00  0.00           N  
HETATM    9  N   UNL     1       1.418  -1.409  -0.606  1.00  0.00           N  
HETATM   10  C   UNL     1       0.398  -2.273  -0.404  1.00  0.00           C  
HETATM   11  O   UNL     1       0.465  -3.485  -0.308  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.811  -1.434  -0.329  1.00  0.00           C  
HETATM   13  C   UNL     1       2.830  -1.769  -0.752  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.107  -1.859  -0.135  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.183  -0.879   0.023  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.479  -1.302   0.352  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.921   0.488  -0.147  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.482  -0.380   0.498  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.932   1.401   0.002  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.217   0.974   0.322  1.00  0.00           C  
HETATM   21  O   UNL     1      -6.214   1.883   0.468  1.00  0.00           O  
HETATM   22  C   UNL     1       3.491  -1.771   0.602  1.00  0.00           C  
HETATM   23  O   UNL     1       2.848  -1.500   1.589  1.00  0.00           O  
HETATM   24  O   UNL     1       4.794  -2.075   0.713  1.00  0.00           O  
HETATM   25  H   UNL     1       5.173  -2.063   1.603  1.00  0.00           H  
HETATM   26  H   UNL     1       4.039   4.331   1.170  1.00  0.00           H  
HETATM   27  H   UNL     1       2.570   0.970   1.120  1.00  0.00           H  
HETATM   28  H   UNL     1       1.167   2.057   0.985  1.00  0.00           H  
HETATM   29  H   UNL     1       2.651   0.842  -1.388  1.00  0.00           H  
HETATM   30  H   UNL     1       0.780   1.710  -2.582  1.00  0.00           H  
HETATM   31  H   UNL     1       0.110   2.325  -1.189  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.329  -2.916  -0.099  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.924   0.821  -0.395  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.732   2.454  -0.129  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.310   2.220   1.369  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.481  -0.705   0.751  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.686  -2.353   0.488  1.00  0.00           H  
HETATM   38  H   UNL     1       2.908  -2.761  -1.196  1.00  0.00           H  
HETATM   39  H   UNL     1       3.326  -1.042  -1.396  1.00  0.00           H  
CONECT    1    6   30   31                                            
CONECT    2   26    4                                                 
CONECT    3    4    4                                                 
CONECT    4    2    3    3    5                                       
CONECT    5    4   27   28    6                                       
CONECT    6    1    5   29    7                                       
CONECT    7    6    8    8    9                                       
CONECT    8    7    7   12                                            
CONECT    9    7   10   13                                            
CONECT   10    9   12   11   11                                       
CONECT   11   10   10                                                 
CONECT   12    8   10   14   14                                       
CONECT   13    9   38   39   22                                       
CONECT   14   12   12   32   15                                       
CONECT   15   14   17   17   16                                       
CONECT   16   15   18   18   37                                       
CONECT   17   15   15   33   19                                       
CONECT   18   16   16   20   36                                       
CONECT   19   17   34   20   20                                       
CONECT   20   18   19   19   21                                       
CONECT   21   20   35                                                 
CONECT   22   13   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25                                                 
CONECT   25   24                                                      
CONECT   26    2                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32   14                                                      
CONECT   33   17                                                      
CONECT   34   19                                                      
CONECT   35   21                                                      
CONECT   36   18                                                      
CONECT   37   16                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
