COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.330   0.381   0.827  1.00  0.00           O  
HETATM    2  C   UNL     1       3.224   1.368   0.131  1.00  0.00           C  
HETATM    3  C   UNL     1       4.425   2.242  -0.126  1.00  0.00           C  
HETATM    4  N   UNL     1       2.034   1.681  -0.419  1.00  0.00           N  
HETATM    5  C   UNL     1       0.948   0.809  -0.277  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.343   1.316  -0.183  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.419   0.460  -0.044  1.00  0.00           C  
HETATM    8  B   UNL     1      -2.860   1.037   0.061  1.00  0.00           B1-
HETATM    9  O   UNL     1      -3.400   1.145  -1.191  1.00  0.00           O  
HETATM   10  O   UNL     1      -3.632   0.201   0.819  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.219  -0.905   0.003  1.00  0.00           C  
HETATM   12  C   UNL     1       1.159  -0.560  -0.237  1.00  0.00           C  
HETATM   13  C   UNL     1       0.073  -1.425  -0.091  1.00  0.00           C  
HETATM   14  C   UNL     1       0.290  -2.885  -0.041  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.657  -3.636   0.082  1.00  0.00           O  
HETATM   16  O   UNL     1       1.538  -3.384  -0.132  1.00  0.00           O  
HETATM   17  O   UNL     1      -2.816   2.272   0.645  1.00  0.00           O  
HETATM   18  H   UNL     1       4.945   1.893  -1.017  1.00  0.00           H  
HETATM   19  H   UNL     1       4.099   3.272  -0.275  1.00  0.00           H  
HETATM   20  H   UNL     1       5.098   2.195   0.730  1.00  0.00           H  
HETATM   21  H   UNL     1       1.929   2.509  -0.912  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.506   2.384  -0.219  1.00  0.00           H  
HETATM   23  H   UNL     1       2.160  -0.956  -0.314  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.063  -1.570   0.113  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.463   0.305  -1.666  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.545   0.499   0.927  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.443   2.272   1.538  1.00  0.00           H  
HETATM   28  H   UNL     1       1.630  -4.346  -0.095  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   18   19   20                                       
CONECT    4    2    5   21                                            
CONECT    5    4    6   12   12                                       
CONECT    6    5    7    7   22                                       
CONECT    7    6    6    8   11                                       
CONECT    8    7    9   10   17                                       
CONECT    9    8   25                                                 
CONECT   10    8   26                                                 
CONECT   11    7   13   13   24                                       
CONECT   12    5    5   13   23                                       
CONECT   13   11   11   12   14                                       
CONECT   14   13   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   28                                                 
CONECT   17    8   27                                                 
CONECT   18    3                                                      
CONECT   19    3                                                      
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    6                                                      
CONECT   23   12                                                      
CONECT   24   11                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   17                                                      
CONECT   28   16                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
