COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.088  -0.500   0.893  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.035   1.972   0.651  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.508   0.730   0.509  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.291  -0.066  -2.751  1.00  0.00           C  
HETATM    5  N   UNL     1      -5.310  -0.797  -0.417  1.00  0.00           N  
HETATM    6  C   UNL     1      -4.255  -0.541   0.408  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.017  -1.690   1.129  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.949  -2.646   0.724  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.910   0.143  -1.367  1.00  0.00           C  
HETATM   10  C   UNL     1       5.248  -0.054   0.135  1.00  0.00           C  
HETATM   11  N   UNL     1       5.560   0.961  -0.694  1.00  0.00           N  
HETATM   12  C   UNL     1       6.936   1.461  -0.756  1.00  0.00           C  
HETATM   13  C   UNL     1       4.523   1.566  -1.534  1.00  0.00           C  
HETATM   14  C   UNL     1       3.888  -0.624   0.125  1.00  0.00           C  
HETATM   15  C   UNL     1       3.705  -2.010  -0.006  1.00  0.00           C  
HETATM   16  N   UNL     1       4.805  -2.848  -0.126  1.00  0.00           N  
HETATM   17  C   UNL     1       2.420  -2.541  -0.016  1.00  0.00           C  
HETATM   18  C   UNL     1       1.327  -1.712   0.104  1.00  0.00           C  
HETATM   19  C   UNL     1       2.777   0.212   0.250  1.00  0.00           C  
HETATM   20  C   UNL     1       1.499  -0.332   0.234  1.00  0.00           C  
HETATM   21  C   UNL     1       0.315   0.553   0.362  1.00  0.00           C  
HETATM   22  C   UNL     1       0.476   1.935   0.493  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.560   2.736   0.608  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.972   0.018   0.352  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.046   0.896   0.475  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.805   2.277   0.604  1.00  0.00           C  
HETATM   27  N   UNL     1      -3.030   2.896   0.708  1.00  0.00           N  
HETATM   28  N   UNL     1      -5.714  -2.120  -0.198  1.00  0.00           N  
HETATM   29  H   UNL     1      -5.089   2.198   0.705  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.738   0.633  -3.458  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.216   0.107  -2.698  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.479  -1.087  -3.082  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.247  -1.827   1.874  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.023  -3.654   1.104  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.722   1.164  -1.036  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.985  -0.030  -1.420  1.00  0.00           H  
HETATM   37  H   UNL     1       7.488   0.910  -1.517  1.00  0.00           H  
HETATM   38  H   UNL     1       6.926   2.521  -1.009  1.00  0.00           H  
HETATM   39  H   UNL     1       7.416   1.322   0.213  1.00  0.00           H  
HETATM   40  H   UNL     1       4.095   2.427  -1.020  1.00  0.00           H  
HETATM   41  H   UNL     1       4.962   1.888  -2.478  1.00  0.00           H  
HETATM   42  H   UNL     1       3.740   0.833  -1.729  1.00  0.00           H  
HETATM   43  H   UNL     1       5.701  -2.486  -0.047  1.00  0.00           H  
HETATM   44  H   UNL     1       4.677  -3.796  -0.289  1.00  0.00           H  
HETATM   45  H   UNL     1       2.279  -3.607  -0.117  1.00  0.00           H  
HETATM   46  H   UNL     1       0.331  -2.131   0.096  1.00  0.00           H  
HETATM   47  H   UNL     1       2.911   1.278   0.356  1.00  0.00           H  
HETATM   48  H   UNL     1       1.472   2.353   0.501  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.132  -1.045   0.252  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.161   3.852   0.807  1.00  0.00           H  
CONECT    1   10   10                                                 
CONECT    2    3    3   27   29                                       
CONECT    3    2    2    6   25                                       
CONECT    4    9   30   31   32                                       
CONECT    5    6    9   28                                            
CONECT    6    3    5    7    7                                       
CONECT    7    6    6    8   33                                       
CONECT    8    7   28   28   34                                       
CONECT    9    4    5   35   36                                       
CONECT   10    1    1   11   14                                       
CONECT   11   10   12   13                                            
CONECT   12   11   37   38   39                                       
CONECT   13   11   40   41   42                                       
CONECT   14   10   15   15   19                                       
CONECT   15   14   14   16   17                                       
CONECT   16   15   43   44                                            
CONECT   17   15   18   18   45                                       
CONECT   18   17   17   20   46                                       
CONECT   19   14   20   20   47                                       
CONECT   20   18   19   19   21                                       
CONECT   21   20   22   22   24                                       
CONECT   22   21   21   23   48                                       
CONECT   23   22   26   26                                            
CONECT   24   21   25   25   49                                       
CONECT   25    3   24   24   26                                       
CONECT   26   23   23   25   27                                       
CONECT   27    2   26   50                                            
CONECT   28    5    8    8                                            
CONECT   29    2                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   22                                                      
CONECT   49   24                                                      
CONECT   50   27                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
