COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.721  -4.736   0.402  1.00  0.00           N  
HETATM    2  C   UNL     1      -1.460  -3.874   0.397  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.392  -2.786   0.391  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.092  -1.426   0.185  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.948  -0.783  -0.050  1.00  0.00           N  
HETATM    6  C   UNL     1      -0.926   0.532  -0.213  1.00  0.00           C  
HETATM    7  N   UNL     1       0.274   1.179  -0.456  1.00  0.00           N  
HETATM    8  C   UNL     1       1.443   0.435  -0.645  1.00  0.00           C  
HETATM    9  C   UNL     1       1.398  -0.768  -1.339  1.00  0.00           C  
HETATM   10  C   UNL     1       2.553  -1.502  -1.526  1.00  0.00           C  
HETATM   11  C   UNL     1       3.756  -1.043  -1.025  1.00  0.00           C  
HETATM   12  C   UNL     1       3.807   0.158  -0.330  1.00  0.00           C  
HETATM   13  N   UNL     1       5.029   0.623   0.178  1.00  0.00           N  
HETATM   14  C   UNL     1       6.246   0.017   0.076  1.00  0.00           C  
HETATM   15  N   UNL     1       7.111   0.783   0.684  1.00  0.00           N  
HETATM   16  N   UNL     1       6.519   1.822   1.156  1.00  0.00           N  
HETATM   17  C   UNL     1       5.246   1.776   0.871  1.00  0.00           C  
HETATM   18  C   UNL     1       2.651   0.901  -0.145  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.116   1.268  -0.141  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.292   0.614   0.099  1.00  0.00           C  
HETATM   21  N   UNL     1      -4.477   1.314   0.175  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.482   2.768  -0.001  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.628   3.553   0.640  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.582   3.369  -0.878  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.276  -0.747   0.263  1.00  0.00           N  
HETATM   26  N   UNL     1      -4.293  -1.673   0.514  1.00  0.00           N  
HETATM   27  C   UNL     1      -3.784  -2.874   0.585  1.00  0.00           C  
HETATM   28  H   UNL     1       0.304   2.147  -0.494  1.00  0.00           H  
HETATM   29  H   UNL     1       0.459  -1.129  -1.732  1.00  0.00           H  
HETATM   30  H   UNL     1       2.515  -2.437  -2.066  1.00  0.00           H  
HETATM   31  H   UNL     1       4.657  -1.620  -1.172  1.00  0.00           H  
HETATM   32  H   UNL     1       6.455  -0.921  -0.415  1.00  0.00           H  
HETATM   33  H   UNL     1       4.503   2.514   1.136  1.00  0.00           H  
HETATM   34  H   UNL     1       2.690   1.838   0.391  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.104   2.340  -0.273  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.307   0.843   0.346  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.501   3.242  -0.029  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.378   2.988   1.194  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.400   4.544   1.035  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.325   4.239  -1.483  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.302   2.683  -1.324  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.338  -3.782   0.770  1.00  0.00           H  
CONECT    1    2    2    2                                            
CONECT    2    3    1    1    1                                       
CONECT    3    4    4   27    2                                       
CONECT    4   25    5    3    3                                       
CONECT    5    6    6    4                                            
CONECT    6   19    7    5    5                                       
CONECT    7    8    6   28                                            
CONECT    8    9    7   18   18                                       
CONECT    9   10   10    8   29                                       
CONECT   10    9    9   11   30                                       
CONECT   11   10   12   12   31                                       
CONECT   12   11   11   18   13                                       
CONECT   13   12   14   17                                            
CONECT   14   13   15   15   32                                       
CONECT   15   14   14   16                                            
CONECT   16   17   17   15                                            
CONECT   17   13   16   16   33                                       
CONECT   18    8    8   12   34                                       
CONECT   19   20   20    6   35                                       
CONECT   20   21   19   19   25                                       
CONECT   21   22   20   36                                            
CONECT   22   23   24   21   37                                       
CONECT   23   24   22   38   39                                       
CONECT   24   23   22   40   41                                       
CONECT   25   20    4   26                                            
CONECT   26   25   27   27                                            
CONECT   27   26   26    3   42                                       
CONECT   28    7                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   14                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   19                                                      
CONECT   36   21                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   23                                                      
CONECT   40   24                                                      
CONECT   41   24                                                      
CONECT   42   27                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
