COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.502   0.888   0.218  1.00  0.00           C  
HETATM    2  C   UNL     1       3.640  -0.176   0.345  1.00  0.00           C  
HETATM    3  C   UNL     1       2.633  -1.288   0.046  1.00  0.00           C  
HETATM    4  C   UNL     1       5.056  -0.756   0.346  1.00  0.00           C  
HETATM    5  C   UNL     1       6.062   0.357   0.645  1.00  0.00           C  
HETATM    6  C   UNL     1       5.956   1.443  -0.428  1.00  0.00           C  
HETATM    7  C   UNL     1       4.540   2.023  -0.428  1.00  0.00           C  
HETATM    8  C   UNL     1       3.533   0.910  -0.727  1.00  0.00           C  
HETATM    9  N   UNL     1       1.272  -0.760   0.163  1.00  0.00           N  
HETATM   10  C   UNL     1       0.214  -1.566  -0.058  1.00  0.00           C  
HETATM   11  O   UNL     1       0.390  -2.731  -0.354  1.00  0.00           O  
HETATM   12  C   UNL     1      -1.163  -1.031   0.060  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.325   0.258   0.389  1.00  0.00           O  
HETATM   14  C   UNL     1      -2.578   2.277   0.263  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.795   2.903   0.100  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.951   2.165  -0.110  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.900   0.799  -0.161  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.677   0.149  -0.002  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.570  -1.322  -0.064  1.00  0.00           C  
HETATM   20  O   UNL     1      -4.552  -2.043  -0.032  1.00  0.00           O  
HETATM   21  C   UNL     1      -2.205  -1.867  -0.168  1.00  0.00           C  
HETATM   22  H   UNL     1       3.424   0.257   1.322  1.00  0.00           H  
HETATM   23  H   UNL     1       2.793  -1.660  -0.966  1.00  0.00           H  
HETATM   24  H   UNL     1       2.769  -2.102   0.758  1.00  0.00           H  
HETATM   25  H   UNL     1       5.131  -1.529   1.110  1.00  0.00           H  
HETATM   26  H   UNL     1       5.272  -1.188  -0.631  1.00  0.00           H  
HETATM   27  H   UNL     1       5.846   0.789   1.622  1.00  0.00           H  
HETATM   28  H   UNL     1       7.071  -0.056   0.645  1.00  0.00           H  
HETATM   29  H   UNL     1       6.673   2.236  -0.215  1.00  0.00           H  
HETATM   30  H   UNL     1       6.172   1.011  -1.405  1.00  0.00           H  
HETATM   31  H   UNL     1       4.324   2.455   0.549  1.00  0.00           H  
HETATM   32  H   UNL     1       4.464   2.796  -1.192  1.00  0.00           H  
HETATM   33  H   UNL     1       3.749   0.478  -1.704  1.00  0.00           H  
HETATM   34  H   UNL     1       2.525   1.323  -0.728  1.00  0.00           H  
HETATM   35  H   UNL     1       1.131   0.170   0.400  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.685   2.863   0.426  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.849   3.981   0.135  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.897   2.672  -0.233  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.802   0.228  -0.324  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.040  -2.904  -0.419  1.00  0.00           H  
CONECT    1   13   18   18   14                                       
CONECT    2    8    3    4   22                                       
CONECT    3    2    9   23   24                                       
CONECT    4    2    5   25   26                                       
CONECT    5    6    4   27   28                                       
CONECT    6    7    5   29   30                                       
CONECT    7    8    6   31   32                                       
CONECT    8    7    2   33   34                                       
CONECT    9    3   10   35                                            
CONECT   10   11   11    9   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   21   21   13                                       
CONECT   13   12    1                                                 
CONECT   14    1   15   15   36                                       
CONECT   15   14   14   16   37                                       
CONECT   16   17   17   15   38                                       
CONECT   17   18   16   16   39                                       
CONECT   18   19    1    1   17                                       
CONECT   19   21   20   20   18                                       
CONECT   20   19   19                                                 
CONECT   21   12   12   19   40                                       
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   21                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
