COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.491   2.363  -0.306  1.00  0.00           C  
HETATM    2  N   UNL     1       1.350   3.261  -0.086  1.00  0.00           N  
HETATM    3  C   UNL     1       2.006   0.937  -0.348  1.00  0.00           C  
HETATM    4  N   UNL     1       0.763   0.580  -0.209  1.00  0.00           N  
HETATM    5  N   UNL     1       2.813  -0.145  -0.543  1.00  0.00           N  
HETATM    6  C   UNL     1       4.265  -0.109  -0.740  1.00  0.00           C  
HETATM    7  C   UNL     1       4.955  -0.205   0.596  1.00  0.00           C  
HETATM    8  O   UNL     1       4.302  -0.295   1.609  1.00  0.00           O  
HETATM    9  C   UNL     1       2.043  -1.256  -0.522  1.00  0.00           C  
HETATM   10  O   UNL     1       2.406  -2.409  -0.661  1.00  0.00           O  
HETATM   11  C   UNL     1       0.666  -0.767  -0.298  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.488  -1.532  -0.202  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.747  -0.902  -0.127  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.836   0.489  -0.339  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.031   1.123  -0.273  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.240   0.346   0.021  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.113  -1.100   0.236  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.891  -1.677   0.152  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.418   0.936   0.091  1.00  0.00           N  
HETATM   20  N   UNL     1      -6.338   0.329   0.317  1.00  0.00           N1+
HETATM   21  N   UNL     1      -7.257  -0.277   0.544  1.00  0.00           N1-
HETATM   22  O   UNL     1       6.296  -0.192   0.661  1.00  0.00           O  
HETATM   23  H   UNL     1       2.972   2.611  -1.252  1.00  0.00           H  
HETATM   24  H   UNL     1       3.207   2.479   0.508  1.00  0.00           H  
HETATM   25  H   UNL     1       0.848   3.010   0.753  1.00  0.00           H  
HETATM   26  H   UNL     1       1.649   4.225  -0.053  1.00  0.00           H  
HETATM   27  H   UNL     1       4.567  -0.948  -1.366  1.00  0.00           H  
HETATM   28  H   UNL     1       4.542   0.826  -1.226  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.421  -2.610  -0.185  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.942   1.055  -0.555  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.093   2.189  -0.436  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.986  -1.699   0.450  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.790  -2.741   0.309  1.00  0.00           H  
HETATM   34  H   UNL     1       6.693  -0.256   1.541  1.00  0.00           H  
CONECT    1    2    3   23   24                                       
CONECT    2    1   25   26                                            
CONECT    3    1    4    4    5                                       
CONECT    4    3    3   11                                            
CONECT    5    3    6    9                                            
CONECT    6    5    7   27   28                                       
CONECT    7    8    8    6   22                                       
CONECT    8    7    7                                                 
CONECT    9    5   11   10   10                                       
CONECT   10    9    9                                                 
CONECT   11    4    9   12   12                                       
CONECT   12   11   11   13   29                                       
CONECT   13   18   12   14   14                                       
CONECT   14   13   13   15   30                                       
CONECT   15   16   16   14   31                                       
CONECT   16   17   19   15   15                                       
CONECT   17   18   18   16   32                                       
CONECT   18   17   17   13   33                                       
CONECT   19   20   20   16                                            
CONECT   20   21   21   19   19                                       
CONECT   21   20   20                                                 
CONECT   22    7   34                                                 
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    6                                                      
CONECT   28    6                                                      
CONECT   29   12                                                      
CONECT   30   14                                                      
CONECT   31   15                                                      
CONECT   32   17                                                      
CONECT   33   18                                                      
CONECT   34   22                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
