COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.126  -1.782   0.661  1.00  0.00           O  
HETATM    2  C   UNL     1       4.760  -0.638   0.476  1.00  0.00           C  
HETATM    3  N   UNL     1       5.541   0.391   0.864  1.00  0.00           N  
HETATM    4  O   UNL     1       6.786   0.138   1.487  1.00  0.00           O  
HETATM    5  C   UNL     1       3.462  -0.373  -0.181  1.00  0.00           C  
HETATM    6  C   UNL     1       2.654  -1.436  -0.589  1.00  0.00           C  
HETATM    7  C   UNL     1       1.444  -1.183  -1.200  1.00  0.00           C  
HETATM    8  C   UNL     1       1.030   0.121  -1.410  1.00  0.00           C  
HETATM    9  C   UNL     1       1.827   1.179  -1.007  1.00  0.00           C  
HETATM   10  C   UNL     1       3.036   0.939  -0.389  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.293   0.390  -2.079  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.345   0.477  -1.064  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.085  -0.577  -0.604  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.985  -2.023  -1.033  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.254  -2.746  -0.563  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.495  -2.447   0.856  1.00  0.00           N  
HETATM   17  C   UNL     1      -4.463  -3.388   1.434  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.937  -1.055   1.041  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.966  -0.148   0.328  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.774   1.278   0.471  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.731   1.623  -0.429  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.388   2.244   1.274  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.940   3.535   1.145  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.927   3.879   0.264  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.293   2.942  -0.533  1.00  0.00           C  
HETATM   26  H   UNL     1       5.249   1.304   0.716  1.00  0.00           H  
HETATM   27  H   UNL     1       7.274   0.937   1.730  1.00  0.00           H  
HETATM   28  H   UNL     1       2.976  -2.454  -0.426  1.00  0.00           H  
HETATM   29  H   UNL     1       0.818  -2.004  -1.517  1.00  0.00           H  
HETATM   30  H   UNL     1       1.496   2.194  -1.170  1.00  0.00           H  
HETATM   31  H   UNL     1       3.657   1.766  -0.076  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.238   1.331  -2.627  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.521  -0.421  -2.771  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.909  -2.081  -2.118  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.108  -2.482  -0.577  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.105  -2.408  -1.155  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.128  -3.821  -0.691  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.110  -4.409   1.289  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.571  -3.189   2.501  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.429  -3.264   0.943  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.934  -0.928   0.620  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.950  -0.813   2.104  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.179   1.986   1.963  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.391   4.308   1.749  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.616   4.911   0.204  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.503   3.222  -1.214  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    5    1    1    3                                       
CONECT    3    2    4   26                                            
CONECT    4    3   27                                                 
CONECT    5   10    2    6    6                                       
CONECT    6    5    5    7   28                                       
CONECT    7    8    8    6   29                                       
CONECT    8    9   11    7    7                                       
CONECT    9   10   10    8   30                                       
CONECT   10    9    9    5   31                                       
CONECT   11    8   12   32   33                                       
CONECT   12   13   11   21                                            
CONECT   13   14   19   19   12                                       
CONECT   14   15   13   34   35                                       
CONECT   15   14   16   36   37                                       
CONECT   16   15   17   18                                            
CONECT   17   16   38   39   40                                       
CONECT   18   16   19   41   42                                       
CONECT   19   13   13   18   20                                       
CONECT   20   19   21   21   22                                       
CONECT   21   12   20   20   25                                       
CONECT   22   20   23   23   43                                       
CONECT   23   22   22   24   44                                       
CONECT   24   25   25   23   45                                       
CONECT   25   21   24   24   46                                       
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
