COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.054   0.580   0.747  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.833  -0.290  -0.106  1.00  0.00           C  
HETATM    3  O   UNL     1      -0.340  -1.084  -0.879  1.00  0.00           O  
HETATM    4  C   UNL     1      -2.768   0.773   0.925  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.968   2.095   0.228  1.00  0.00           C  
HETATM    6  O   UNL     1      -2.646   2.222  -0.929  1.00  0.00           O  
HETATM    7  O   UNL     1      -3.503   3.130   0.894  1.00  0.00           O  
HETATM    8  N   UNL     1      -2.173  -0.186  -0.009  1.00  0.00           N  
HETATM    9  C   UNL     1      -3.035  -1.031  -0.839  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.339  -2.334  -0.095  1.00  0.00           C  
HETATM   11  N   UNL     1      -4.203  -3.182  -0.927  1.00  0.00           N1+
HETATM   12  N   UNL     1       1.458   0.278   0.458  1.00  0.00           N  
HETATM   13  C   UNL     1       2.111   0.969  -0.526  1.00  0.00           C  
HETATM   14  C   UNL     1       2.095  -0.672   1.167  1.00  0.00           C  
HETATM   15  O   UNL     1       1.497  -1.270   2.040  1.00  0.00           O  
HETATM   16  N   UNL     1       3.385  -0.970   0.922  1.00  0.00           N  
HETATM   17  C   UNL     1       4.062  -0.315  -0.043  1.00  0.00           C  
HETATM   18  O   UNL     1       5.229  -0.584  -0.265  1.00  0.00           O  
HETATM   19  C   UNL     1       3.405   0.691  -0.792  1.00  0.00           C  
HETATM   20  C   UNL     1       4.141   1.441  -1.872  1.00  0.00           C  
HETATM   21  H   UNL     1      -0.145   1.629   0.527  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.150   0.385   1.800  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.104   0.909   1.778  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.730   0.395   1.270  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.611   3.957   0.406  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.967  -0.506  -1.048  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.527  -1.258  -1.776  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.407  -2.859   0.113  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.846  -2.107   0.842  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.066  -2.695  -1.121  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.734  -3.392  -1.795  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.404  -4.041  -0.437  1.00  0.00           H  
HETATM   33  H   UNL     1       1.594   1.733  -1.087  1.00  0.00           H  
HETATM   34  H   UNL     1       3.829  -1.658   1.442  1.00  0.00           H  
HETATM   35  H   UNL     1       4.611   2.326  -1.445  1.00  0.00           H  
HETATM   36  H   UNL     1       4.906   0.796  -2.306  1.00  0.00           H  
HETATM   37  H   UNL     1       3.438   1.742  -2.649  1.00  0.00           H  
CONECT    1    2   12   21   22                                       
CONECT    2    1    3    3    8                                       
CONECT    3    2    2                                                 
CONECT    4    5    8   23   24                                       
CONECT    5    4    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    5   25                                                 
CONECT    8    2    4    9                                            
CONECT    9    8   10   26   27                                       
CONECT   10    9   11   28   29                                       
CONECT   11   10   30   31   32                                       
CONECT   12    1   13   14                                            
CONECT   13   12   19   19   33                                       
CONECT   14   12   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   34                                            
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   13   13   17   20                                       
CONECT   20   19   35   36   37                                       
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    4                                                      
CONECT   24    4                                                      
CONECT   25    7                                                      
CONECT   26    9                                                      
CONECT   27    9                                                      
CONECT   28   10                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   13                                                      
CONECT   34   16                                                      
CONECT   35   20                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
