COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.169  -0.845  -0.433  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.417   0.450  -0.235  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.770   1.778  -0.333  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.120   0.100   0.111  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.828   2.760  -0.086  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.535   2.411   0.258  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.181   1.077   0.357  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.508  -1.928  -1.021  1.00  0.00           O  
HETATM    9  B   UNL     1      -1.079  -1.459   0.129  1.00  0.00           B1-
HETATM   10  O   UNL     1      -0.380  -1.899   1.218  1.00  0.00           O  
HETATM   11  O   UNL     1      -2.391  -1.870   0.208  1.00  0.00           O  
HETATM   12  C   UNL     1       1.227   0.695   0.732  1.00  0.00           C  
HETATM   13  C   UNL     1       2.042   0.439  -0.537  1.00  0.00           C  
HETATM   14  C   UNL     1       3.451   0.057  -0.162  1.00  0.00           C  
HETATM   15  O   UNL     1       4.350  -0.215  -1.120  1.00  0.00           O  
HETATM   16  O   UNL     1       3.770  -0.004   1.002  1.00  0.00           O  
HETATM   17  H   UNL     1      -4.154  -0.779   0.029  1.00  0.00           H  
HETATM   18  H   UNL     1      -3.268  -1.061  -1.497  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.780   2.051  -0.602  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.103   3.802  -0.163  1.00  0.00           H  
HETATM   21  H   UNL     1       0.198   3.180   0.449  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.455  -2.892  -1.069  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.320  -2.862   1.284  1.00  0.00           H  
HETATM   24  H   UNL     1       1.684   1.505   1.300  1.00  0.00           H  
HETATM   25  H   UNL     1       1.209  -0.209   1.340  1.00  0.00           H  
HETATM   26  H   UNL     1       1.585  -0.371  -1.105  1.00  0.00           H  
HETATM   27  H   UNL     1       2.061   1.344  -1.145  1.00  0.00           H  
HETATM   28  H   UNL     1       5.241  -0.455  -0.831  1.00  0.00           H  
CONECT    1   11    2   17   18                                       
CONECT    2    3    1    4    4                                       
CONECT    3    5    5    2   19                                       
CONECT    4    2    2    9    7                                       
CONECT    5    3    3    6   20                                       
CONECT    6    5    7    7   21                                       
CONECT    7    6    6    4   12                                       
CONECT    8    9   22                                                 
CONECT    9    8   11    4   10                                       
CONECT   10    9   23                                                 
CONECT   11    1    9                                                 
CONECT   12    7   13   24   25                                       
CONECT   13   14   12   26   27                                       
CONECT   14   16   16   15   13                                       
CONECT   15   14   28                                                 
CONECT   16   14   14                                                 
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    3                                                      
CONECT   20    5                                                      
CONECT   21    6                                                      
CONECT   22    8                                                      
CONECT   23   10                                                      
CONECT   24   12                                                      
CONECT   25   12                                                      
CONECT   26   13                                                      
CONECT   27   13                                                      
CONECT   28   15                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
