COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.149  -2.153  -1.254  1.00  0.00           C  
HETATM    2  O   UNL     1       1.475  -1.117   1.920  1.00  0.00           O  
HETATM    3  O   UNL     1       1.504   2.453  -0.203  1.00  0.00           O  
HETATM    4  C   UNL     1       1.413   3.765  -0.760  1.00  0.00           C  
HETATM    5  C   UNL     1       4.588  -0.213   0.257  1.00  0.00           C  
HETATM    6  C   UNL     1       3.634  -1.370  -0.045  1.00  0.00           C  
HETATM    7  C   UNL     1       2.241  -0.815  -0.352  1.00  0.00           C  
HETATM    8  C   UNL     1       1.675  -0.139   0.898  1.00  0.00           C  
HETATM    9  C   UNL     1       0.358   0.514   0.563  1.00  0.00           C  
HETATM   10  C   UNL     1       0.338   1.796   0.021  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.869   2.405  -0.291  1.00  0.00           C  
HETATM   12  O   UNL     1      -2.480  -3.489  -0.735  1.00  0.00           O  
HETATM   13  O   UNL     1      -1.535  -1.487  -0.938  1.00  0.00           O  
HETATM   14  C   UNL     1      -2.431  -2.166  -0.474  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.818  -0.162   0.788  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.043   0.443   0.478  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.060   1.740  -0.064  1.00  0.00           C  
HETATM   18  O   UNL     1      -3.241   2.335  -0.369  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.423  -1.567   0.340  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.300  -0.274   0.716  1.00  0.00           C  
HETATM   21  H   UNL     1       5.141  -2.548  -1.035  1.00  0.00           H  
HETATM   22  H   UNL     1       3.469  -2.978  -1.469  1.00  0.00           H  
HETATM   23  H   UNL     1       4.204  -1.492  -2.119  1.00  0.00           H  
HETATM   24  H   UNL     1       0.861  -1.823   1.674  1.00  0.00           H  
HETATM   25  H   UNL     1       2.414   4.177  -0.888  1.00  0.00           H  
HETATM   26  H   UNL     1       0.915   3.715  -1.729  1.00  0.00           H  
HETATM   27  H   UNL     1       0.840   4.406  -0.090  1.00  0.00           H  
HETATM   28  H   UNL     1       4.222   0.346   1.118  1.00  0.00           H  
HETATM   29  H   UNL     1       5.581  -0.608   0.476  1.00  0.00           H  
HETATM   30  H   UNL     1       4.643   0.448  -0.608  1.00  0.00           H  
HETATM   31  H   UNL     1       3.579  -2.031   0.820  1.00  0.00           H  
HETATM   32  H   UNL     1       2.310  -0.086  -1.160  1.00  0.00           H  
HETATM   33  H   UNL     1       1.584  -1.630  -0.653  1.00  0.00           H  
HETATM   34  H   UNL     1       2.376   0.618   1.251  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.878   3.401  -0.711  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.798  -1.159   1.204  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.547   2.164  -1.270  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.278  -2.144   0.661  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.128   0.232   1.191  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.761  -3.805  -1.299  1.00  0.00           H  
CONECT    1    6   21   22   23                                       
CONECT    2    8   24                                                 
CONECT    3    4   10                                                 
CONECT    4    3   25   26   27                                       
CONECT    5    6   28   29   30                                       
CONECT    6    1    5    7   31                                       
CONECT    7    6    8   32   33                                       
CONECT    8    2    7    9   34                                       
CONECT    9    8   10   10   15                                       
CONECT   10    3    9    9   11                                       
CONECT   11   10   17   17   35                                       
CONECT   12   14   40                                                 
CONECT   13   14   14                                                 
CONECT   14   12   13   13   19                                       
CONECT   15    9   16   16   36                                       
CONECT   16   15   15   17   20                                       
CONECT   17   11   11   16   18                                       
CONECT   18   17   37                                                 
CONECT   19   14   20   20   38                                       
CONECT   20   16   19   19   39                                       
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   11                                                      
CONECT   36   15                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   12                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
