COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.499  -1.168  -0.513  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.944  -1.019  -0.276  1.00  0.00           C  
HETATM    3  N   UNL     1      -4.060  -0.905  -0.092  1.00  0.00           N  
HETATM    4  C   UNL     1      -0.727  -0.291   0.475  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.986   1.174   0.199  1.00  0.00           C  
HETATM    6  N   UNL     1       0.195   1.733  -0.112  1.00  0.00           N  
HETATM    7  C   UNL     1       1.241   0.810  -0.080  1.00  0.00           C  
HETATM    8  C   UNL     1       2.602   0.966  -0.333  1.00  0.00           C  
HETATM    9  C   UNL     1       3.454  -0.115  -0.235  1.00  0.00           C  
HETATM   10  C   UNL     1       2.965  -1.360   0.114  1.00  0.00           C  
HETATM   11  C   UNL     1       1.613  -1.523   0.366  1.00  0.00           C  
HETATM   12  C   UNL     1       0.762  -0.446   0.269  1.00  0.00           C  
HETATM   13  O   UNL     1      -2.059   1.738   0.249  1.00  0.00           O  
HETATM   14  H   UNL     1      -1.213  -2.210  -0.375  1.00  0.00           H  
HETATM   15  H   UNL     1      -1.265  -0.859  -1.532  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.001  -0.541   1.500  1.00  0.00           H  
HETATM   17  H   UNL     1       0.308   2.671  -0.334  1.00  0.00           H  
HETATM   18  H   UNL     1       2.992   1.936  -0.606  1.00  0.00           H  
HETATM   19  H   UNL     1       4.508   0.012  -0.432  1.00  0.00           H  
HETATM   20  H   UNL     1       3.635  -2.204   0.189  1.00  0.00           H  
HETATM   21  H   UNL     1       1.228  -2.495   0.639  1.00  0.00           H  
CONECT    1    2    4   14   15                                       
CONECT    2    1    3    3    3                                       
CONECT    3    2    2    2                                            
CONECT    4    1    5   12   16                                       
CONECT    5    4    6   13   13                                       
CONECT    6    5    7   17                                            
CONECT    7    6    8    8   12                                       
CONECT    8    7    7    9   18                                       
CONECT    9    8   10   10   19                                       
CONECT   10    9    9   11   20                                       
CONECT   11   10   12   12   21                                       
CONECT   12    4    7   11   11                                       
CONECT   13    5    5                                                 
CONECT   14    1                                                      
CONECT   15    1                                                      
CONECT   16    4                                                      
CONECT   17    6                                                      
CONECT   18    8                                                      
CONECT   19    9                                                      
CONECT   20   10                                                      
CONECT   21   11                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
