COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.228   1.319  -0.152  1.00  0.00           C  
HETATM    2  C   UNL     1       4.181   0.046   0.974  1.00  0.00           C  
HETATM    3  C   UNL     1       0.061   2.671  -0.330  1.00  0.00           C  
HETATM    4  C   UNL     1       4.539  -1.879  -0.995  1.00  0.00           C  
HETATM    5  C   UNL     1       2.333   2.258  -0.350  1.00  0.00           C  
HETATM    6  C   UNL     1       2.127   0.882  -0.166  1.00  0.00           C  
HETATM    7  C   UNL     1       3.280  -0.047  -0.086  1.00  0.00           C  
HETATM    8  C   UNL     1       3.466  -1.016  -1.072  1.00  0.00           C  
HETATM    9  C   UNL     1       5.438  -1.779   0.059  1.00  0.00           C  
HETATM   10  C   UNL     1       5.255  -0.816   1.042  1.00  0.00           C  
HETATM   11  C   UNL     1       0.825   0.402  -0.065  1.00  0.00           C  
HETATM   12  C   UNL     1       0.507  -1.379   1.631  1.00  0.00           C  
HETATM   13  C   UNL     1       0.555  -1.067   0.134  1.00  0.00           C  
HETATM   14  N   UNL     1       1.307   3.091  -0.422  1.00  0.00           N  
HETATM   15  O   UNL     1       6.494  -2.631   0.132  1.00  0.00           O  
HETATM   16  N   UNL     1       3.625   2.751  -0.453  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.633   0.860  -0.049  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.520   1.485   0.832  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.821   1.022   0.894  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.203  -0.045   0.080  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.333  -0.616  -0.745  1.00  0.00           N  
HETATM   22  C   UNL     1      -2.091  -0.200  -0.836  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.593  -0.548   0.139  1.00  0.00           C  
HETATM   24  O   UNL     1      -6.395  -0.031   0.892  1.00  0.00           O  
HETATM   25  N   UNL     1      -5.970  -1.579  -0.643  1.00  0.00           N  
HETATM   26  C   UNL     1      -7.347  -2.076  -0.585  1.00  0.00           C  
HETATM   27  H   UNL     1       4.040   0.795   1.738  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.747   3.384  -0.394  1.00  0.00           H  
HETATM   29  H   UNL     1       4.683  -2.630  -1.758  1.00  0.00           H  
HETATM   30  H   UNL     1       2.770  -1.091  -1.894  1.00  0.00           H  
HETATM   31  H   UNL     1       5.956  -0.741   1.860  1.00  0.00           H  
HETATM   32  H   UNL     1       1.463  -1.119   2.087  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.288  -0.797   2.098  1.00  0.00           H  
HETATM   34  H   UNL     1       0.312  -2.441   1.775  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.400  -1.326  -0.322  1.00  0.00           H  
HETATM   36  H   UNL     1       1.350  -1.649  -0.333  1.00  0.00           H  
HETATM   37  H   UNL     1       7.288  -2.312  -0.317  1.00  0.00           H  
HETATM   38  H   UNL     1       3.773   3.702  -0.576  1.00  0.00           H  
HETATM   39  H   UNL     1       4.381   2.145  -0.401  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.197   2.310   1.450  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.534   1.481   1.563  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.414  -0.687  -1.523  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.331  -1.991  -1.244  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.568  -2.418   0.426  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.035  -1.275  -0.855  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.463  -2.906  -1.283  1.00  0.00           H  
CONECT    1    3    3   11   17                                       
CONECT    2    7    7   10   27                                       
CONECT    3   14    1    1   28                                       
CONECT    4    8    8    9   29                                       
CONECT    5   16   14   14    6                                       
CONECT    6    7    5   11   11                                       
CONECT    7    8    6    2    2                                       
CONECT    8    4    4    7   30                                       
CONECT    9    4   15   10   10                                       
CONECT   10    9    9    2   31                                       
CONECT   11    6    6    1   13                                       
CONECT   12   13   32   33   34                                       
CONECT   13   11   12   35   36                                       
CONECT   14    5    5    3                                            
CONECT   15    9   37                                                 
CONECT   16    5   38   39                                            
CONECT   17    1   22   22   18                                       
CONECT   18   17   19   19   40                                       
CONECT   19   18   18   20   41                                       
CONECT   20   21   21   19   23                                       
CONECT   21   22   20   20                                            
CONECT   22   17   17   21   42                                       
CONECT   23   20   25   24   24                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   43                                            
CONECT   26   25   44   45   46                                       
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    8                                                      
CONECT   31   10                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   22                                                      
CONECT   43   25                                                      
CONECT   44   26                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
