COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.106   3.836   0.924  1.00  0.00           C  
HETATM    2  O   UNL     1       2.592   2.800   0.068  1.00  0.00           O  
HETATM    3  C   UNL     1       1.537   1.986  -0.202  1.00  0.00           C  
HETATM    4  C   UNL     1       0.290   2.264   0.339  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.782   1.437   0.064  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.611   0.329  -0.753  1.00  0.00           C  
HETATM    7  O   UNL     1      -1.667  -0.485  -1.023  1.00  0.00           O  
HETATM    8  C   UNL     1      -2.794   0.057  -0.332  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.022  -0.817  -0.595  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.229  -0.236   0.145  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.457  -1.110  -0.119  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.646  -0.539   0.610  1.00  0.00           C  
HETATM   13  O   UNL     1      -8.841  -1.144   0.523  1.00  0.00           O  
HETATM   14  O   UNL     1      -7.523   0.465   1.272  1.00  0.00           O  
HETATM   15  C   UNL     1       0.635   0.051  -1.294  1.00  0.00           C  
HETATM   16  C   UNL     1       1.706   0.881  -1.024  1.00  0.00           C  
HETATM   17  C   UNL     1       3.060   0.580  -1.612  1.00  0.00           C  
HETATM   18  C   UNL     1       3.877  -0.203  -0.617  1.00  0.00           C  
HETATM   19  C   UNL     1       4.759   0.438   0.232  1.00  0.00           C  
HETATM   20  N   UNL     1       5.463  -0.279   1.096  1.00  0.00           N  
HETATM   21  C   UNL     1       5.331  -1.596   1.156  1.00  0.00           C  
HETATM   22  N   UNL     1       6.084  -2.308   2.072  1.00  0.00           N  
HETATM   23  N   UNL     1       4.497  -2.247   0.360  1.00  0.00           N  
HETATM   24  C   UNL     1       3.756  -1.591  -0.527  1.00  0.00           C  
HETATM   25  N   UNL     1       2.884  -2.275  -1.358  1.00  0.00           N  
HETATM   26  H   UNL     1       2.921   4.517   1.169  1.00  0.00           H  
HETATM   27  H   UNL     1       1.314   4.385   0.415  1.00  0.00           H  
HETATM   28  H   UNL     1       1.712   3.396   1.840  1.00  0.00           H  
HETATM   29  H   UNL     1       0.158   3.126   0.975  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.752   1.653   0.486  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.587   0.080   0.738  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.985   1.070  -0.687  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.229  -0.840  -1.665  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.831  -1.829  -0.241  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.022  -0.213   1.215  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.420   0.776  -0.210  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.664  -1.133  -1.189  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.266  -2.123   0.236  1.00  0.00           H  
HETATM   39  H   UNL     1      -9.603  -0.777   0.991  1.00  0.00           H  
HETATM   40  H   UNL     1       0.767  -0.811  -1.930  1.00  0.00           H  
HETATM   41  H   UNL     1       2.938  -0.006  -2.523  1.00  0.00           H  
HETATM   42  H   UNL     1       3.570   1.514  -1.847  1.00  0.00           H  
HETATM   43  H   UNL     1       4.874   1.511   0.191  1.00  0.00           H  
HETATM   44  H   UNL     1       6.699  -1.843   2.661  1.00  0.00           H  
HETATM   45  H   UNL     1       5.997  -3.273   2.126  1.00  0.00           H  
HETATM   46  H   UNL     1       2.810  -3.240  -1.295  1.00  0.00           H  
HETATM   47  H   UNL     1       2.347  -1.789  -2.003  1.00  0.00           H  
CONECT    1    2   26   27   28                                       
CONECT    2    1    3                                                 
CONECT    3    2    4    4   16                                       
CONECT    4    3    3    5   29                                       
CONECT    5    4    6    6   30                                       
CONECT    6    5    5    7   15                                       
CONECT    7    6    8                                                 
CONECT    8    7    9   31   32                                       
CONECT    9    8   10   33   34                                       
CONECT   10    9   11   35   36                                       
CONECT   11   10   12   37   38                                       
CONECT   12   11   13   14   14                                       
CONECT   13   12   39                                                 
CONECT   14   12   12                                                 
CONECT   15    6   16   16   40                                       
CONECT   16    3   15   15   17                                       
CONECT   17   16   18   41   42                                       
CONECT   18   17   19   19   24                                       
CONECT   19   18   18   20   43                                       
CONECT   20   19   21   21                                            
CONECT   21   20   20   22   23                                       
CONECT   22   21   44   45                                            
CONECT   23   21   24   24                                            
CONECT   24   18   23   23   25                                       
CONECT   25   24   46   47                                            
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   19                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
