COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.547   0.080  -1.980  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.587  -0.530  -1.037  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.682   0.511  -0.720  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.988   0.252   0.779  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.585  -0.115   1.325  1.00  0.00           C  
HETATM    6  N   UNL     1      -3.951  -0.897   0.242  1.00  0.00           N  
HETATM    7  C   UNL     1      -2.591  -0.670   0.200  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.984   0.576   0.185  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.635   1.851   0.210  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.152   2.863   0.230  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.533   0.323   0.139  1.00  0.00           C  
HETATM   12  C   UNL     1       0.608   1.133   0.107  1.00  0.00           C  
HETATM   13  N   UNL     1       0.497   2.514   0.115  1.00  0.00           N  
HETATM   14  N   UNL     1       1.801   0.548   0.068  1.00  0.00           N  
HETATM   15  C   UNL     1       1.911  -0.774   0.060  1.00  0.00           C  
HETATM   16  N   UNL     1       3.175  -1.339   0.020  1.00  0.00           N  
HETATM   17  C   UNL     1       4.315  -0.513  -0.012  1.00  0.00           C  
HETATM   18  C   UNL     1       5.605  -0.932  -0.053  1.00  0.00           C  
HETATM   19  N   UNL     1       6.395   0.174  -0.074  1.00  0.00           N  
HETATM   20  C   UNL     1       7.859   0.187  -0.119  1.00  0.00           C  
HETATM   21  N   UNL     1       5.561   1.298  -0.045  1.00  0.00           N  
HETATM   22  C   UNL     1       4.318   0.889  -0.014  1.00  0.00           C  
HETATM   23  N   UNL     1       0.857  -1.573   0.090  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.377  -1.071   0.130  1.00  0.00           C  
HETATM   25  N   UNL     1      -1.629  -1.637   0.172  1.00  0.00           N  
HETATM   26  C   UNL     1      -1.893  -3.078   0.183  1.00  0.00           C  
HETATM   27  H   UNL     1      -2.678  -0.576  -2.034  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.980   0.192  -2.974  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.243   1.056  -1.603  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.032  -1.412  -1.496  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.306   1.523  -0.868  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.569   0.335  -1.330  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.371   1.151   1.260  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.683  -0.580   0.898  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.009   0.788   1.529  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.676  -0.721   2.227  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.379   2.930   0.144  1.00  0.00           H  
HETATM   38  H   UNL     1       1.294   3.065   0.092  1.00  0.00           H  
HETATM   39  H   UNL     1       3.276  -2.304   0.014  1.00  0.00           H  
HETATM   40  H   UNL     1       5.943  -1.958  -0.066  1.00  0.00           H  
HETATM   41  H   UNL     1       8.191   0.193  -1.158  1.00  0.00           H  
HETATM   42  H   UNL     1       8.230   1.079   0.386  1.00  0.00           H  
HETATM   43  H   UNL     1       8.246  -0.701   0.380  1.00  0.00           H  
HETATM   44  H   UNL     1       3.444   1.524   0.013  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.902  -3.453  -0.840  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.113  -3.586   0.750  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.861  -3.266   0.648  1.00  0.00           H  
CONECT    1    2   27   28   29                                       
CONECT    2    3    1    6   30                                       
CONECT    3    4    2   31   32                                       
CONECT    4    3    5   33   34                                       
CONECT    5    4    6   35   36                                       
CONECT    6    2    5    7                                            
CONECT    7    6   25    8    8                                       
CONECT    8    7    7    9   11                                       
CONECT    9   10   10   10    8                                       
CONECT   10    9    9    9                                            
CONECT   11    8   24   24   12                                       
CONECT   12   11   13   14   14                                       
CONECT   13   12   37   38                                            
CONECT   14   12   12   15                                            
CONECT   15   23   23   14   16                                       
CONECT   16   15   17   39                                            
CONECT   17   22   16   18   18                                       
CONECT   18   17   17   19   40                                       
CONECT   19   21   20   18                                            
CONECT   20   19   41   42   43                                       
CONECT   21   22   22   19                                            
CONECT   22   21   21   17   44                                       
CONECT   23   24   15   15                                            
CONECT   24   25   11   11   23                                       
CONECT   25    7   26   24                                            
CONECT   26   25   45   46   47                                       
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   16                                                      
CONECT   40   18                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   22                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
