COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.959   1.792   0.198  1.00  0.00           N  
HETATM    2  CA  UNL     1       2.620   0.394   0.497  1.00  0.00           C  
HETATM    3  C   UNL     1       3.692  -0.511  -0.052  1.00  0.00           C  
HETATM    4  O   UNL     1       3.826  -1.759   0.425  1.00  0.00           O  
HETATM    5  OXT UNL     1       4.432  -0.114  -0.921  1.00  0.00           O  
HETATM    6  C   UNL     1       1.278   0.045  -0.149  1.00  0.00           C  
HETATM    7  C   UNL     1       0.169   0.878   0.498  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.153   0.534  -0.139  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.158   0.145   0.607  1.00  0.00           C  
HETATM   10  B   UNL     1      -3.523  -0.210  -0.050  1.00  0.00           B1-
HETATM   11  O   UNL     1      -3.434  -0.042  -1.404  1.00  0.00           O  
HETATM   12  O   UNL     1      -3.838  -1.510   0.229  1.00  0.00           O  
HETATM   13  O   UNL     1      -4.496   0.612   0.448  1.00  0.00           O  
HETATM   14  H1  UNL     1       2.170   2.350   0.489  1.00  0.00           H  
HETATM   15  H2  UNL     1       3.013   1.868  -0.807  1.00  0.00           H  
HETATM   16  HA  UNL     1       2.549   0.261   1.577  1.00  0.00           H  
HETATM   17  H   UNL     1       4.514  -2.340   0.072  1.00  0.00           H  
HETATM   18  H   UNL     1       1.320   0.263  -1.216  1.00  0.00           H  
HETATM   19  H   UNL     1       1.069  -1.015  -0.002  1.00  0.00           H  
HETATM   20  H   UNL     1       0.126   0.660   1.565  1.00  0.00           H  
HETATM   21  H   UNL     1       0.378   1.937   0.351  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.273   0.607  -1.210  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.039   0.072   1.678  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.211   0.886  -1.556  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.891  -1.585   1.192  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.323   0.359   0.016  1.00  0.00           H  
CONECT    1    2   14   15                                            
CONECT    2    1    3    6   16                                       
CONECT    3    2    4    5    5                                       
CONECT    4    3   17                                                 
CONECT    5    3    3                                                 
CONECT    6    2    7   18   19                                       
CONECT    7    6    8   20   21                                       
CONECT    8    7    9    9   22                                       
CONECT    9    8    8   10   23                                       
CONECT   10    9   11   12   13                                       
CONECT   11   10   24                                                 
CONECT   12   10   25                                                 
CONECT   13   10   26                                                 
CONECT   14    1                                                      
CONECT   15    1                                                      
CONECT   16    2                                                      
CONECT   17    4                                                      
CONECT   18    6                                                      
CONECT   19    6                                                      
CONECT   20    7                                                      
CONECT   21    7                                                      
CONECT   22    8                                                      
CONECT   23    9                                                      
CONECT   24   11                                                      
CONECT   25   12                                                      
CONECT   26   13                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
