COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.239   1.983  -1.809  1.00  0.00           O  
HETATM    2  V   UNL     1      -2.740   1.438  -0.125  1.00  0.00           V  
HETATM    3  O   UNL     1      -0.988   1.065   0.316  1.00  0.00           O  
HETATM    4  O   UNL     1      -4.516   1.667  -0.540  1.00  0.00           O  
HETATM    5  O   UNL     1      -2.862   2.664   1.240  1.00  0.00           O  
HETATM    6  O   UNL     1      -3.011  -0.354   0.219  1.00  0.00           O  
HETATM    7  C   UNL     1      -1.919  -1.056  -0.381  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.660  -0.174  -0.319  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.561  -2.289   0.474  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.131  -3.555  -0.164  1.00  0.00           C  
HETATM   11  O   UNL     1      -1.831  -4.681   0.663  1.00  0.00           O  
HETATM   12  O   UNL     1      -0.120  -2.340   0.478  1.00  0.00           O  
HETATM   13  C   UNL     1       0.320  -0.969   0.567  1.00  0.00           C  
HETATM   14  N   UNL     1       4.734   1.765   0.584  1.00  0.00           N  
HETATM   15  C   UNL     1       3.618   1.997   1.249  1.00  0.00           C  
HETATM   16  N   UNL     1       2.562   1.216   1.153  1.00  0.00           N  
HETATM   17  C   UNL     1       2.582   0.145   0.366  1.00  0.00           C  
HETATM   18  C   UNL     1       3.747  -0.146  -0.363  1.00  0.00           C  
HETATM   19  C   UNL     1       4.848   0.718  -0.227  1.00  0.00           C  
HETATM   20  N   UNL     1       6.022   0.483  -0.921  1.00  0.00           N  
HETATM   21  N   UNL     1       3.504  -1.274  -1.073  1.00  0.00           N  
HETATM   22  C   UNL     1       2.293  -1.684  -0.831  1.00  0.00           C  
HETATM   23  N   UNL     1       1.683  -0.843   0.051  1.00  0.00           N  
HETATM   24  H   UNL     1      -2.980   2.215  -2.384  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.749   2.572  -0.789  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.743   3.047   1.347  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.148  -1.342  -1.401  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.248  -0.011  -1.309  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.939  -2.172   1.486  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.211  -3.456  -0.266  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.684  -3.698  -1.148  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.164  -5.522   0.319  1.00  0.00           H  
HETATM   33  H   UNL     1       0.270  -0.621   1.595  1.00  0.00           H  
HETATM   34  H   UNL     1       3.568   2.859   1.898  1.00  0.00           H  
HETATM   35  H   UNL     1       6.092  -0.284  -1.510  1.00  0.00           H  
HETATM   36  H   UNL     1       6.774   1.087  -0.818  1.00  0.00           H  
HETATM   37  H   UNL     1       1.838  -2.562  -1.265  1.00  0.00           H  
CONECT    1    2   24                                                 
CONECT    2    5    4    3    6                                       
CONECT    2    1                                                      
CONECT    3    2    8                                                 
CONECT    4    2   25                                                 
CONECT    5    2   26                                                 
CONECT    6    2    7                                                 
CONECT    7    9    6    8   27                                       
CONECT    8    3   13    7   28                                       
CONECT    9   10   12    7   29                                       
CONECT   10    9   11   30   31                                       
CONECT   11   10   32                                                 
CONECT   12    9   13                                                 
CONECT   13   12    8   23   33                                       
CONECT   14   15   15   19                                            
CONECT   15   16   14   14   34                                       
CONECT   16   17   17   15                                            
CONECT   17   23   16   16   18                                       
CONECT   18   17   21   19   19                                       
CONECT   19   18   18   14   20                                       
CONECT   20   19   35   36                                            
CONECT   21   22   22   18                                            
CONECT   22   23   21   21   37                                       
CONECT   23   13   22   17                                            
CONECT   24    1                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   13                                                      
CONECT   34   15                                                      
CONECT   35   20                                                      
CONECT   36   20                                                      
CONECT   37   22                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
