COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.543  -2.146  -0.307  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.865  -1.627  -0.170  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.536  -1.153  -1.283  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.826  -0.675  -1.163  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.452  -0.672   0.083  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.771  -1.152   1.201  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.484  -1.631   1.068  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.834  -0.155   0.219  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.801  -0.907   0.881  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.087  -0.422   1.006  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.426   0.812   0.476  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.483   1.572  -0.184  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.176   1.100  -0.315  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.192   1.885  -0.999  1.00  0.00           C  
HETATM   15  C   UNL     1       3.518   3.462   0.753  1.00  0.00           C  
HETATM   16  C   UNL     1       4.121   2.111   0.467  1.00  0.00           C  
HETATM   17  C   UNL     1       5.464   1.991   0.411  1.00  0.00           C  
HETATM   18  C   UNL     1       6.033   0.722   0.143  1.00  0.00           C  
HETATM   19  O   UNL     1       7.242   0.571   0.084  1.00  0.00           O  
HETATM   20  C   UNL     1       5.111  -0.410  -0.064  1.00  0.00           C  
HETATM   21  O   UNL     1       5.583  -1.654  -0.325  1.00  0.00           O  
HETATM   22  C   UNL     1       3.770  -0.171   0.015  1.00  0.00           C  
HETATM   23  O   UNL     1       3.311   1.066   0.280  1.00  0.00           O  
HETATM   24  C   UNL     1       2.816  -1.277  -0.185  1.00  0.00           C  
HETATM   25  O   UNL     1       3.225  -2.398  -0.420  1.00  0.00           O  
HETATM   26  N   UNL     1       1.490  -1.047  -0.108  1.00  0.00           N  
HETATM   27  N   UNL     1      -3.412   2.507  -1.542  1.00  0.00           N  
HETATM   28  H   UNL     1       0.720  -2.918   0.441  1.00  0.00           H  
HETATM   29  H   UNL     1       0.679  -2.567  -1.303  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.050  -1.156  -2.247  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.348  -0.305  -2.033  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.251  -1.151   2.168  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.955  -2.003   1.933  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.544  -1.870   1.297  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.834  -1.008   1.521  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.436   1.181   0.579  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.755   2.533  -0.595  1.00  0.00           H  
HETATM   38  H   UNL     1       3.349   3.991  -0.185  1.00  0.00           H  
HETATM   39  H   UNL     1       2.569   3.333   1.274  1.00  0.00           H  
HETATM   40  H   UNL     1       4.199   4.039   1.378  1.00  0.00           H  
HETATM   41  H   UNL     1       6.097   2.851   0.570  1.00  0.00           H  
HETATM   42  H   UNL     1       6.547  -1.710  -0.358  1.00  0.00           H  
HETATM   43  H   UNL     1       1.164  -0.153   0.080  1.00  0.00           H  
CONECT    1    2   26   28   29                                       
CONECT    2    7    7    3    1                                       
CONECT    3    4    4    2   30                                       
CONECT    4    5    3    3   31                                       
CONECT    5    8    6    6    4                                       
CONECT    6    5    5    7   32                                       
CONECT    7    6    2    2   33                                       
CONECT    8   13   13    9    5                                       
CONECT    9   10   10    8   34                                       
CONECT   10   11    9    9   35                                       
CONECT   11   12   12   10   36                                       
CONECT   12   11   11   13   37                                       
CONECT   13   12   14    8    8                                       
CONECT   14   27   27   27   13                                       
CONECT   15   16   38   39   40                                       
CONECT   16   15   23   17   17                                       
CONECT   17   16   16   18   41                                       
CONECT   18   17   20   19   19                                       
CONECT   19   18   18                                                 
CONECT   20   22   22   18   21                                       
CONECT   21   20   42                                                 
CONECT   22   23   24   20   20                                       
CONECT   23   16   22                                                 
CONECT   24   25   25   22   26                                       
CONECT   25   24   24                                                 
CONECT   26   24    1   43                                            
CONECT   27   14   14   14                                            
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   21                                                      
CONECT   43   26                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
