COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.806  -1.273  -1.389  1.00  0.00           O  
HETATM    2  C   UNL     1       4.212  -0.567  -0.598  1.00  0.00           C  
HETATM    3  N   UNL     1       4.879   0.375   0.097  1.00  0.00           N  
HETATM    4  C   UNL     1       6.320   0.549  -0.101  1.00  0.00           C  
HETATM    5  C   UNL     1       6.826   1.676   0.802  1.00  0.00           C  
HETATM    6  C   UNL     1       8.334   1.937   0.828  1.00  0.00           C  
HETATM    7  C   UNL     1       7.398   2.922   0.124  1.00  0.00           C  
HETATM    8  C   UNL     1       2.758  -0.738  -0.403  1.00  0.00           C  
HETATM    9  C   UNL     1       2.073   0.076   0.502  1.00  0.00           C  
HETATM   10  C   UNL     1       0.718  -0.084   0.683  1.00  0.00           C  
HETATM   11  C   UNL     1       2.065  -1.711  -1.128  1.00  0.00           C  
HETATM   12  C   UNL     1       0.709  -1.870  -0.945  1.00  0.00           C  
HETATM   13  C   UNL     1       0.028  -1.059  -0.037  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.432  -1.231   0.159  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.945  -2.473   0.533  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.015  -3.640   0.739  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.305  -2.635   0.716  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.164  -1.571   0.530  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.292  -0.153  -0.025  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.663  -0.323   0.155  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.584   0.816  -0.045  1.00  0.00           C  
HETATM   22  N   UNL     1      -4.250   2.034  -0.400  1.00  0.00           N  
HETATM   23  N   UNL     1      -5.310   2.760  -0.476  1.00  0.00           N  
HETATM   24  O   UNL     1      -5.924   0.795   0.099  1.00  0.00           O  
HETATM   25  C   UNL     1      -6.354   2.039  -0.175  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.784   2.513  -0.148  1.00  0.00           C  
HETATM   27  H   UNL     1       4.404   0.938   0.729  1.00  0.00           H  
HETATM   28  H   UNL     1       6.835  -0.378   0.151  1.00  0.00           H  
HETATM   29  H   UNL     1       6.516   0.803  -1.142  1.00  0.00           H  
HETATM   30  H   UNL     1       6.275   1.816   1.732  1.00  0.00           H  
HETATM   31  H   UNL     1       8.774   2.250   1.774  1.00  0.00           H  
HETATM   32  H   UNL     1       8.965   1.306   0.201  1.00  0.00           H  
HETATM   33  H   UNL     1       7.413   2.940  -0.966  1.00  0.00           H  
HETATM   34  H   UNL     1       7.223   3.883   0.607  1.00  0.00           H  
HETATM   35  H   UNL     1       2.607   0.831   1.060  1.00  0.00           H  
HETATM   36  H   UNL     1       0.188   0.546   1.382  1.00  0.00           H  
HETATM   37  H   UNL     1       2.592  -2.339  -1.831  1.00  0.00           H  
HETATM   38  H   UNL     1       0.174  -2.622  -1.505  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.817  -4.121  -0.219  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.077  -3.286   1.167  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.476  -4.358   1.418  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.697  -3.599   1.005  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.226  -1.704   0.674  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.898   0.812  -0.311  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.026   2.881   0.849  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.914   3.316  -0.873  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.446   1.684  -0.401  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    8    1    1                                       
CONECT    3    4    2   27                                            
CONECT    4    5    3   28   29                                       
CONECT    5    6    7    4   30                                       
CONECT    6    7    5   31   32                                       
CONECT    7    6    5   33   34                                       
CONECT    8    9    2   11   11                                       
CONECT    9   10   10    8   35                                       
CONECT   10    9    9   13   36                                       
CONECT   11    8    8   12   37                                       
CONECT   12   13   13   11   38                                       
CONECT   13   10   14   12   12                                       
CONECT   14   15   13   19   19                                       
CONECT   15   16   17   17   14                                       
CONECT   16   15   39   40   41                                       
CONECT   17   15   15   18   42                                       
CONECT   18   17   20   20   43                                       
CONECT   19   14   14   20   44                                       
CONECT   20   18   18   19   21                                       
CONECT   21   20   24   22   22                                       
CONECT   22   21   21   23                                            
CONECT   23   22   25   25                                            
CONECT   24   21   25                                                 
CONECT   25   24   26   23   23                                       
CONECT   26   25   45   46   47                                       
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
