COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.300   2.507   0.291  1.00  0.00           C  
HETATM    2  C   UNL     1       1.043   1.202   0.164  1.00  0.00           C  
HETATM    3  C   UNL     1       2.404   1.202  -0.070  1.00  0.00           C  
HETATM    4  C   UNL     1       3.088  -0.001  -0.187  1.00  0.00           C  
HETATM    5  C   UNL     1       1.041  -1.201   0.165  1.00  0.00           C  
HETATM    6  N   UNL     1       4.467  -0.002  -0.424  1.00  0.00           N  
HETATM    7  C   UNL     1       2.402  -1.203  -0.069  1.00  0.00           C  
HETATM    8  C   UNL     1       0.297  -2.505   0.294  1.00  0.00           C  
HETATM    9  C   UNL     1       0.360   0.001   0.287  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.980   0.002   0.523  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.839  -0.002  -0.619  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.276   0.000  -0.166  1.00  0.00           C  
HETATM   13  O   UNL     1      -3.538   0.003   1.014  1.00  0.00           O  
HETATM   14  H   UNL     1      -0.053   2.821  -0.691  1.00  0.00           H  
HETATM   15  H   UNL     1      -0.552   2.377   0.959  1.00  0.00           H  
HETATM   16  H   UNL     1       0.968   3.267   0.698  1.00  0.00           H  
HETATM   17  H   UNL     1       2.936   2.137  -0.163  1.00  0.00           H  
HETATM   18  H   UNL     1       4.945   0.838  -0.506  1.00  0.00           H  
HETATM   19  H   UNL     1       4.944  -0.842  -0.506  1.00  0.00           H  
HETATM   20  H   UNL     1       2.934  -2.139  -0.160  1.00  0.00           H  
HETATM   21  H   UNL     1       0.292  -2.819   1.338  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.728  -2.374  -0.051  1.00  0.00           H  
HETATM   23  H   UNL     1       0.790  -3.266  -0.312  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.647   0.887  -1.221  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.647  -0.893  -1.216  1.00  0.00           H  
HETATM   26  O   UNL     1      -4.266  -0.003  -1.072  1.00  0.00           O  
HETATM   27  H   UNL     1      -5.172  -0.002  -0.734  1.00  0.00           H  
CONECT    1    2   14   15   16                                       
CONECT    2    1    3    3    9                                       
CONECT    3    2    2    4   17                                       
CONECT    4    3    6    7    7                                       
CONECT    5    7    8    9    9                                       
CONECT    6    4   18   19                                            
CONECT    7    4    4    5   20                                       
CONECT    8    5   21   22   23                                       
CONECT    9    2    5    5   10                                       
CONECT   10    9   11                                                 
CONECT   11   10   12   24   25                                       
CONECT   12   11   13   13   26                                       
CONECT   13   12   12                                                 
CONECT   14    1                                                      
CONECT   15    1                                                      
CONECT   16    1                                                      
CONECT   17    3                                                      
CONECT   18    6                                                      
CONECT   19    6                                                      
CONECT   20    7                                                      
CONECT   21    8                                                      
CONECT   22    8                                                      
CONECT   23    8                                                      
CONECT   24   11                                                      
CONECT   25   11                                                      
CONECT   26   12   27                                                 
CONECT   27   26                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
