COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.208  -1.831   0.746  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.465  -1.301  -0.482  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.859   0.790  -0.520  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.772   2.245  -0.056  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.793   0.029   0.381  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.381   0.740  -1.957  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.409   0.918  -0.381  1.00  0.00           C  
HETATM    8  C   UNL     1       0.919   0.271  -0.452  1.00  0.00           C  
HETATM    9  C   UNL     1       2.000   0.814   0.241  1.00  0.00           C  
HETATM   10  C   UNL     1       3.242   0.197   0.167  1.00  0.00           C  
HETATM   11  C   UNL     1       3.409  -0.959  -0.598  1.00  0.00           C  
HETATM   12  C   UNL     1       2.334  -1.492  -1.283  1.00  0.00           C  
HETATM   13  C   UNL     1       1.094  -0.889  -1.211  1.00  0.00           C  
HETATM   14  C   UNL     1       4.848  -1.385  -0.482  1.00  0.00           C  
HETATM   15  O   UNL     1       5.546  -0.471   0.362  1.00  0.00           O  
HETATM   16  O   UNL     1      -0.491   2.123  -0.252  1.00  0.00           O  
HETATM   17  N   UNL     1      -1.527   0.170  -0.458  1.00  0.00           N  
HETATM   18  O   UNL     1      -4.870   0.520   0.646  1.00  0.00           O  
HETATM   19  N   UNL     1      -3.492  -1.162   0.902  1.00  0.00           N  
HETATM   20  C   UNL     1      -4.525  -1.844   1.685  1.00  0.00           C  
HETATM   21  B   UNL     1       4.639   0.529   0.803  1.00  0.00           B  
HETATM   22  H   UNL     1      -2.374  -2.902   0.630  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.602  -1.657   1.635  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.425  -1.626  -0.452  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.941  -1.674  -1.389  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.777   2.653   0.052  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.257   2.290   0.903  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.220   2.829  -0.793  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.701   1.288  -2.609  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.442  -0.297  -2.286  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.371   1.195  -2.001  1.00  0.00           H  
HETATM   32  H   UNL     1       1.872   1.708   0.833  1.00  0.00           H  
HETATM   33  H   UNL     1       2.463  -2.389  -1.870  1.00  0.00           H  
HETATM   34  H   UNL     1       0.258  -1.312  -1.748  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.438  -1.553   2.732  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.510  -1.563   1.311  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.396  -2.922   1.595  1.00  0.00           H  
HETATM   38  O   UNL     1       4.938   1.623   1.658  1.00  0.00           O  
HETATM   39  H   UNL     1       4.897  -2.386  -0.054  1.00  0.00           H  
HETATM   40  H   UNL     1       5.307  -1.390  -1.471  1.00  0.00           H  
HETATM   41  H   UNL     1       5.861   1.655   1.947  1.00  0.00           H  
CONECT    1   19    2   22   23                                       
CONECT    2    1   17   24   25                                       
CONECT    3    5   17    6    4                                       
CONECT    4    3   26   27   28                                       
CONECT    5   19   18   18    3                                       
CONECT    6    3   29   30   31                                       
CONECT    7   17    8   16   16                                       
CONECT    8   13    7    9    9                                       
CONECT    9    8    8   10   32                                       
CONECT   10   11   11    9   21                                       
CONECT   11   12   14   10   10                                       
CONECT   12   13   13   11   33                                       
CONECT   13   12   12    8   34                                       
CONECT   14   11   15   39   40                                       
CONECT   15   14   21                                                 
CONECT   16    7    7                                                 
CONECT   17    2    3    7                                            
CONECT   18    5    5                                                 
CONECT   19   20    1    5                                            
CONECT   20   19   35   36   37                                       
CONECT   21   10   15   38                                            
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    9                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   20                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
CONECT   38   21   41                                                 
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   38                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
