COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.926   1.448  -0.555  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.285   1.204  -0.625  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.814   0.069  -0.040  1.00  0.00           C  
HETATM    4  N   UNL     1      -6.269  -0.191  -0.115  1.00  0.00           N1+
HETATM    5  O   UNL     1      -7.000   0.594  -0.691  1.00  0.00           O  
HETATM    6  O   UNL     1      -6.736  -1.191   0.401  1.00  0.00           O1-
HETATM    7  C   UNL     1      -3.985  -0.822   0.614  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.626  -0.578   0.684  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.096   0.554   0.094  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.614   0.820   0.170  1.00  0.00           C  
HETATM   11  C   UNL     1       0.153  -0.054  -0.857  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.068   0.373   1.473  1.00  0.00           N  
HETATM   13  O   UNL     1       1.244  -0.238   1.233  1.00  0.00           O  
HETATM   14  C   UNL     1       1.533  -0.179  -0.175  1.00  0.00           C  
HETATM   15  O   UNL     1       2.329   0.961  -0.477  1.00  0.00           O  
HETATM   16  C   UNL     1       3.621   0.952   0.136  1.00  0.00           C  
HETATM   17  C   UNL     1       4.381   2.221  -0.257  1.00  0.00           C  
HETATM   18  O   UNL     1       3.713   3.363   0.284  1.00  0.00           O  
HETATM   19  C   UNL     1       4.400  -0.277  -0.339  1.00  0.00           C  
HETATM   20  O   UNL     1       5.675  -0.313   0.306  1.00  0.00           O  
HETATM   21  C   UNL     1       3.612  -1.542   0.013  1.00  0.00           C  
HETATM   22  O   UNL     1       4.303  -2.690  -0.483  1.00  0.00           O  
HETATM   23  C   UNL     1       2.224  -1.460  -0.632  1.00  0.00           C  
HETATM   24  O   UNL     1       1.445  -2.590  -0.235  1.00  0.00           O  
HETATM   25  H   UNL     1      -2.512   2.335  -1.013  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.933   1.901  -1.137  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.398  -1.709   1.071  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.978  -1.275   1.195  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.405   1.878   0.009  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.318  -1.030  -0.970  1.00  0.00           H  
HETATM   31  H   UNL     1       0.235   0.453  -1.819  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.694  -0.280   1.923  1.00  0.00           H  
HETATM   33  H   UNL     1       3.510   0.916   1.219  1.00  0.00           H  
HETATM   34  H   UNL     1       5.396   2.173   0.136  1.00  0.00           H  
HETATM   35  H   UNL     1       4.415   2.302  -1.344  1.00  0.00           H  
HETATM   36  H   UNL     1       4.141   4.205   0.074  1.00  0.00           H  
HETATM   37  H   UNL     1       4.540  -0.224  -1.419  1.00  0.00           H  
HETATM   38  H   UNL     1       6.227   0.461   0.129  1.00  0.00           H  
HETATM   39  H   UNL     1       3.507  -1.617   1.096  1.00  0.00           H  
HETATM   40  H   UNL     1       5.193  -2.800  -0.122  1.00  0.00           H  
HETATM   41  H   UNL     1       2.327  -1.451  -1.717  1.00  0.00           H  
HETATM   42  H   UNL     1       1.828  -3.441  -0.489  1.00  0.00           H  
CONECT    1    9    9    2   25                                       
CONECT    2    1    3    3   26                                       
CONECT    3    2    2    7    4                                       
CONECT    4    3    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4                                                      
CONECT    7    8    8    3   27                                       
CONECT    8    9    7    7   28                                       
CONECT    9   10    1    1    8                                       
CONECT   10   11   12    9   29                                       
CONECT   11   14   10   30   31                                       
CONECT   12   13   10   32                                            
CONECT   13   14   12                                                 
CONECT   14   23   15   13   11                                       
CONECT   15   16   14                                                 
CONECT   16   19   17   15   33                                       
CONECT   17   18   16   34   35                                       
CONECT   18   17   36                                                 
CONECT   19   20   21   16   37                                       
CONECT   20   19   38                                                 
CONECT   21   22   19   23   39                                       
CONECT   22   21   40                                                 
CONECT   23   21   24   14   41                                       
CONECT   24   23   42                                                 
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   16                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
