COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  OXT UNL     1      -3.762  -3.202   0.184  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.008  -2.086   0.209  1.00  0.00           C  
HETATM    3  O   UNL     1      -1.799  -2.171   0.269  1.00  0.00           O  
HETATM    4  CA  UNL     1      -3.656  -0.754   0.165  1.00  0.00           C  
HETATM    5  N   UNL     1      -5.017  -0.648  -0.027  1.00  0.00           N  
HETATM    6  C   UNL     1      -5.622   0.550  -0.071  1.00  0.00           C  
HETATM    7  O   UNL     1      -6.825   0.600  -0.242  1.00  0.00           O  
HETATM    8  N   UNL     1      -4.934   1.697   0.071  1.00  0.00           N  
HETATM    9  C   UNL     1      -3.599   1.673   0.262  1.00  0.00           C  
HETATM   10  O   UNL     1      -2.973   2.708   0.391  1.00  0.00           O  
HETATM   11  C   UNL     1      -2.915   0.375   0.318  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.425   0.296   0.530  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.713   0.362  -0.822  1.00  0.00           C  
HETATM   14  C   UNL     1       0.777   0.283  -0.610  1.00  0.00           C  
HETATM   15  C   UNL     1       1.509   1.442  -0.422  1.00  0.00           C  
HETATM   16  C   UNL     1       2.873   1.376  -0.227  1.00  0.00           C  
HETATM   17  C   UNL     1       1.407  -0.948  -0.599  1.00  0.00           C  
HETATM   18  C   UNL     1       2.772  -1.026  -0.404  1.00  0.00           C  
HETATM   19  C   UNL     1       3.514   0.139  -0.220  1.00  0.00           C  
HETATM   20  C   UNL     1       4.981   0.061  -0.011  1.00  0.00           C  
HETATM   21  C   UNL     1       5.722   1.225   0.184  1.00  0.00           C  
HETATM   22  C   UNL     1       7.087   1.147   0.378  1.00  0.00           C  
HETATM   23  C   UNL     1       7.718  -0.084   0.378  1.00  0.00           C  
HETATM   24  C   UNL     1       6.988  -1.242   0.185  1.00  0.00           C  
HETATM   25  C   UNL     1       5.622  -1.176  -0.004  1.00  0.00           C  
HETATM   26  HXT UNL     1      -3.294  -4.048   0.215  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.400   2.546   0.034  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.102   1.131   1.152  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.177  -0.643   1.026  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.036  -0.473  -1.444  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.960   1.301  -1.318  1.00  0.00           H  
HETATM   32  H   UNL     1       1.011   2.401  -0.429  1.00  0.00           H  
HETATM   33  H   UNL     1       3.444   2.281  -0.081  1.00  0.00           H  
HETATM   34  H   UNL     1       0.831  -1.850  -0.741  1.00  0.00           H  
HETATM   35  H   UNL     1       3.263  -1.988  -0.396  1.00  0.00           H  
HETATM   36  H   UNL     1       5.230   2.186   0.183  1.00  0.00           H  
HETATM   37  H   UNL     1       7.662   2.048   0.529  1.00  0.00           H  
HETATM   38  H   UNL     1       8.786  -0.140   0.529  1.00  0.00           H  
HETATM   39  H   UNL     1       7.486  -2.200   0.186  1.00  0.00           H  
HETATM   40  H   UNL     1       5.052  -2.082  -0.149  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.547  -1.453  -0.133  1.00  0.00           H  
CONECT    1    2   26                                                 
CONECT    2    4    3    3    1                                       
CONECT    3    2    2                                                 
CONECT    4   11   11    2    5                                       
CONECT    5    4    6   41                                            
CONECT    6    8    5    7    7                                       
CONECT    7    6    6                                                 
CONECT    8    9    6   27                                            
CONECT    9   10   10   11    8                                       
CONECT   10    9    9                                                 
CONECT   11   12    9    4    4                                       
CONECT   12   13   11   28   29                                       
CONECT   13   14   12   30   31                                       
CONECT   14   15   13   17   17                                       
CONECT   15   16   16   14   32                                       
CONECT   16   15   15   19   33                                       
CONECT   17   14   14   18   34                                       
CONECT   18   19   19   17   35                                       
CONECT   19   16   20   18   18                                       
CONECT   20   21   19   25   25                                       
CONECT   21   22   22   20   36                                       
CONECT   22   21   21   23   37                                       
CONECT   23   22   24   24   38                                       
CONECT   24   23   23   25   39                                       
CONECT   25   20   20   24   40                                       
CONECT   26    1                                                      
CONECT   27    8                                                      
CONECT   28   12                                                      
CONECT   29   12                                                      
CONECT   30   13                                                      
CONECT   31   13                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   21                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   24                                                      
CONECT   40   25                                                      
CONECT   41    5                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
