COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.943  -0.220   1.292  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.217  -0.122   1.173  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.578  -0.032   0.597  1.00  0.00           C  
HETATM    4  N   UNL     1       0.470  -0.271   2.551  1.00  0.00           N  
HETATM    5  C   UNL     1      -4.948   0.052   0.915  1.00  0.00           C  
HETATM    6  N   UNL     1      -0.930  -0.206   2.455  1.00  0.00           N  
HETATM    7  C   UNL     1      -5.121   0.137  -0.479  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.693  -0.031   1.441  1.00  0.00           C  
HETATM    9  O   UNL     1      -6.502   0.287  -2.208  1.00  0.00           O  
HETATM   10  N   UNL     1      -6.355   0.213  -1.001  1.00  0.00           N1+
HETATM   11  O   UNL     1      -7.328   0.209  -0.268  1.00  0.00           O  
HETATM   12  C   UNL     1      -3.995   0.142  -1.324  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.744   0.058  -0.789  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.072  -0.132   0.475  1.00  0.00           N  
HETATM   15  C   UNL     1       2.396  -0.254   0.893  1.00  0.00           C  
HETATM   16  O   UNL     1       2.754   0.992   0.291  1.00  0.00           O  
HETATM   17  C   UNL     1       2.624  -1.388  -0.110  1.00  0.00           C  
HETATM   18  O   UNL     1       2.320  -2.640   0.508  1.00  0.00           O  
HETATM   19  C   UNL     1       4.090  -1.378  -0.555  1.00  0.00           C  
HETATM   20  O   UNL     1       4.295  -2.386  -1.547  1.00  0.00           O  
HETATM   21  C   UNL     1       4.423  -0.004  -1.146  1.00  0.00           C  
HETATM   22  O   UNL     1       5.807   0.041  -1.499  1.00  0.00           O  
HETATM   23  C   UNL     1       4.125   1.077  -0.103  1.00  0.00           C  
HETATM   24  C   UNL     1       4.398   2.456  -0.706  1.00  0.00           C  
HETATM   25  O   UNL     1       4.233   3.457   0.301  1.00  0.00           O  
HETATM   26  H   UNL     1       0.993  -0.338   3.365  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.809   0.048   1.568  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.559  -0.096   2.510  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.122   0.206  -2.394  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.880   0.062  -1.436  1.00  0.00           H  
HETATM   31  H   UNL     1       3.012  -0.421   1.777  1.00  0.00           H  
HETATM   32  H   UNL     1       1.979  -1.243  -0.976  1.00  0.00           H  
HETATM   33  H   UNL     1       2.443  -3.405  -0.071  1.00  0.00           H  
HETATM   34  H   UNL     1       4.733  -1.571   0.303  1.00  0.00           H  
HETATM   35  H   UNL     1       4.102  -3.283  -1.241  1.00  0.00           H  
HETATM   36  H   UNL     1       3.814   0.169  -2.033  1.00  0.00           H  
HETATM   37  H   UNL     1       6.067  -0.621  -2.153  1.00  0.00           H  
HETATM   38  H   UNL     1       4.764   0.927   0.768  1.00  0.00           H  
HETATM   39  H   UNL     1       5.418   2.490  -1.087  1.00  0.00           H  
HETATM   40  H   UNL     1       3.699   2.642  -1.521  1.00  0.00           H  
HETATM   41  H   UNL     1       4.391   4.359  -0.011  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.410   0.340  -2.537  1.00  0.00           H  
CONECT    1   15    4   14   14                                       
CONECT    2    6    6   14    3                                       
CONECT    3    2    8    8   13                                       
CONECT    4    1    6   26                                            
CONECT    5    8    7    7   27                                       
CONECT    6    4    2    2                                            
CONECT    7    5    5   12   10                                       
CONECT    8    3    3    5   28                                       
CONECT    9   10   42                                                 
CONECT   10    7    9   11   11                                       
CONECT   11   10   10                                                 
CONECT   12   13   13    7   29                                       
CONECT   13    3   12   12   30                                       
CONECT   14    1    1    2                                            
CONECT   15   17   16    1   31                                       
CONECT   16   23   15                                                 
CONECT   17   19   18   15   32                                       
CONECT   18   17   33                                                 
CONECT   19   20   21   17   34                                       
CONECT   20   19   35                                                 
CONECT   21   22   19   23   36                                       
CONECT   22   21   37                                                 
CONECT   23   21   24   16   38                                       
CONECT   24   25   23   39   40                                       
CONECT   25   24   41                                                 
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    8                                                      
CONECT   29   12                                                      
CONECT   30   13                                                      
CONECT   31   15                                                      
CONECT   32   17                                                      
CONECT   33   18                                                      
CONECT   34   19                                                      
CONECT   35   20                                                      
CONECT   36   21                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   24                                                      
CONECT   40   24                                                      
CONECT   41   25                                                      
CONECT   42    9                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
