COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.222  -0.642   0.021  1.00  0.00           C  
HETATM    2  C   UNL     1       3.699  -1.903   0.212  1.00  0.00           C  
HETATM    3  C   UNL     1       2.325  -2.100   0.243  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.593  -0.370  -0.624  1.00  0.00           C  
HETATM    5  C   UNL     1       1.469  -1.025   0.082  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.001  -0.869   0.060  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.647   0.975  -0.215  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.441   0.292  -1.348  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.435   0.627   1.029  1.00  0.00           C  
HETATM   10  N   UNL     1       3.906   1.725  -0.330  1.00  0.00           N  
HETATM   11  N   UNL     1      -0.290   0.430  -0.136  1.00  0.00           N  
HETATM   12  C   UNL     1       3.376   0.458  -0.138  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.491  -0.120   0.687  1.00  0.00           N  
HETATM   14  O   UNL     1       0.879   2.365  -0.428  1.00  0.00           O  
HETATM   15  C   UNL     1       0.832   1.164  -0.247  1.00  0.00           C  
HETATM   16  C   UNL     1       1.995   0.270  -0.114  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.812  -1.764   0.195  1.00  0.00           O  
HETATM   18  O   UNL     1      -4.471  -1.020  -1.149  1.00  0.00           O  
HETATM   19  O   UNL     1      -2.153   0.971   2.157  1.00  0.00           O  
HETATM   20  H   UNL     1       5.293  -0.503  -0.001  1.00  0.00           H  
HETATM   21  H   UNL     1       4.363  -2.745   0.337  1.00  0.00           H  
HETATM   22  H   UNL     1       1.924  -3.092   0.392  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.618   2.054  -0.365  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.825  -0.454  -1.852  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.809   1.031  -2.059  1.00  0.00           H  
HETATM   26  H   UNL     1       4.868   1.850  -0.354  1.00  0.00           H  
HETATM   27  H   UNL     1       3.315   2.486  -0.440  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.131  -0.453   1.336  1.00  0.00           H  
CONECT    1   12   12    2   20                                       
CONECT    2    3    3    1   21                                       
CONECT    3    5    2    2   22                                       
CONECT    4   18   18   13    8                                       
CONECT    5    6   16   16    3                                       
CONECT    6   11   17   17    5                                       
CONECT    7    8    9   11   23                                       
CONECT    8    4    7   24   25                                       
CONECT    9   13    7   19   19                                       
CONECT   10   12   26   27                                            
CONECT   11    7   15    6                                            
CONECT   12   16   10    1    1                                       
CONECT   13    4    9   28                                            
CONECT   14   15   15                                                 
CONECT   15   14   14   11   16                                       
CONECT   16   15    5    5   12                                       
CONECT   17    6    6                                                 
CONECT   18    4    4                                                 
CONECT   19    9    9                                                 
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25    8                                                      
CONECT   26   10                                                      
CONECT   27   10                                                      
CONECT   28   13                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
