COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.462   0.763   1.104  1.00  0.00           O  
HETATM    2  C   UNL     1       1.522   0.534  -0.086  1.00  0.00           C  
HETATM    3  N   UNL     1       2.717   0.512  -0.708  1.00  0.00           N  
HETATM    4  C   UNL     1       3.944   0.766   0.052  1.00  0.00           C  
HETATM    5  B   UNL     1       4.720  -0.611   0.283  1.00  0.00           B1-
HETATM    6  O   UNL     1       5.039  -1.163  -0.926  1.00  0.00           O  
HETATM    7  O   UNL     1       5.865  -0.375   0.992  1.00  0.00           O  
HETATM    8  C   UNL     1       4.838   1.731  -0.729  1.00  0.00           C  
HETATM    9  C   UNL     1       0.261   0.268  -0.867  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.945   0.344   0.072  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.226   0.074  -0.721  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.432   0.151   0.217  1.00  0.00           C  
HETATM   13  CA  UNL     1      -4.712  -0.120  -0.576  1.00  0.00           C  
HETATM   14  N   UNL     1      -4.696  -1.501  -1.076  1.00  0.00           N  
HETATM   15  C   UNL     1      -5.909   0.076   0.320  1.00  0.00           C  
HETATM   16  O   UNL     1      -6.364   1.314   0.570  1.00  0.00           O  
HETATM   17  OXT UNL     1      -6.457  -0.881   0.813  1.00  0.00           O  
HETATM   18  O   UNL     1       3.921  -1.473   0.981  1.00  0.00           O  
HETATM   19  H   UNL     1       2.765   0.330  -1.660  1.00  0.00           H  
HETATM   20  H   UNL     1       0.157   1.014  -1.654  1.00  0.00           H  
HETATM   21  H   UNL     1       0.312  -0.726  -1.312  1.00  0.00           H  
HETATM   22  H   UNL     1       3.690   1.206   1.016  1.00  0.00           H  
HETATM   23  H   UNL     1       4.308   2.670  -0.887  1.00  0.00           H  
HETATM   24  H   UNL     1       5.751   1.919  -0.164  1.00  0.00           H  
HETATM   25  H   UNL     1       5.092   1.291  -1.694  1.00  0.00           H  
HETATM   26  H   UNL     1       4.274  -1.357  -1.484  1.00  0.00           H  
HETATM   27  H   UNL     1       5.714   0.018   1.863  1.00  0.00           H  
HETATM   28  H   UNL     1       4.330  -2.332   1.158  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.841  -0.402   0.859  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.997   1.338   0.517  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.330   0.820  -1.509  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.174  -0.920  -1.166  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.328  -0.595   1.005  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.483   1.144   0.662  1.00  0.00           H  
HETATM   35  HA  UNL     1      -4.772   0.571  -1.417  1.00  0.00           H  
HETATM   36  H1  UNL     1      -4.642  -2.161  -0.314  1.00  0.00           H  
HETATM   37  H2  UNL     1      -5.501  -1.685  -1.657  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.134   1.389   1.150  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    9                                       
CONECT    3    2    4   19                                            
CONECT    4    3    5    8   22                                       
CONECT    5    4    6    7   18                                       
CONECT    6    5   26                                                 
CONECT    7    5   27                                                 
CONECT    8    4   23   24   25                                       
CONECT    9    2   10   20   21                                       
CONECT   10    9   11   29   30                                       
CONECT   11   10   12   31   32                                       
CONECT   12   11   13   33   34                                       
CONECT   13   12   14   15   35                                       
CONECT   14   13   36   37                                            
CONECT   15   13   16   17   17                                       
CONECT   16   15   38                                                 
CONECT   17   15   15                                                 
CONECT   18    5   28                                                 
CONECT   19    3                                                      
CONECT   20    9                                                      
CONECT   21    9                                                      
CONECT   22    4                                                      
CONECT   23    8                                                      
CONECT   24    8                                                      
CONECT   25    8                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28   18                                                      
CONECT   29   10                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
