COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.408   1.761   0.721  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.157   0.574  -0.091  1.00  0.00           C  
HETATM    3  N   UNL     1       4.100   3.033  -0.224  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.789  -0.588   0.126  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.508  -1.217   0.243  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.441  -2.601   0.422  1.00  0.00           C  
HETATM    7  O   UNL     1      -4.982   1.982  -0.265  1.00  0.00           O  
HETATM    8  C   UNL     1      -5.970   0.315   1.179  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.382   0.879   1.004  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.898  -0.001  -1.299  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.029   0.147  -2.549  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.840  -0.072   0.030  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.354  -0.432   0.176  1.00  0.00           C  
HETATM   14  C   UNL     1       0.864  -1.098   0.296  1.00  0.00           C  
HETATM   15  C   UNL     1       0.919  -2.505   0.480  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.248  -3.265   0.543  1.00  0.00           C  
HETATM   17  C   UNL     1       2.243  -0.656   0.272  1.00  0.00           C  
HETATM   18  C   UNL     1       2.842   0.681   0.089  1.00  0.00           C  
HETATM   19  C   UNL     1       3.931   0.783  -0.790  1.00  0.00           C  
HETATM   20  C   UNL     1       4.571   1.996  -0.906  1.00  0.00           C  
HETATM   21  C   UNL     1       3.036   2.919   0.557  1.00  0.00           C  
HETATM   22  N   UNL     1       2.565   4.039   1.220  1.00  0.00           N  
HETATM   23  C   UNL     1       4.288  -0.397  -1.638  1.00  0.00           C  
HETATM   24  C   UNL     1       5.119  -1.455  -0.901  1.00  0.00           C  
HETATM   25  C   UNL     1       4.530  -1.690   0.493  1.00  0.00           C  
HETATM   26  C   UNL     1       3.030  -1.755   0.446  1.00  0.00           C  
HETATM   27  N   UNL     1       2.238  -2.859   0.566  1.00  0.00           N  
HETATM   28  H   UNL     1      -2.360  -3.166   0.466  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.518   2.414   0.465  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.028  -0.759   1.360  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.487   0.801   2.026  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.962   0.694   1.908  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.324   1.952   0.822  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.865   0.393   0.156  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.110  -1.056  -1.127  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.835   0.539  -1.441  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.557  -0.262  -3.410  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.818   1.203  -2.721  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.093  -0.392  -2.407  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.404   0.638   0.039  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.214  -4.336   0.681  1.00  0.00           H  
HETATM   42  H   UNL     1       5.439   2.101  -1.539  1.00  0.00           H  
HETATM   43  H   UNL     1       3.013   4.892   1.109  1.00  0.00           H  
HETATM   44  H   UNL     1       1.786   3.971   1.795  1.00  0.00           H  
HETATM   45  H   UNL     1       3.368  -0.861  -1.994  1.00  0.00           H  
HETATM   46  H   UNL     1       4.855  -0.047  -2.501  1.00  0.00           H  
HETATM   47  H   UNL     1       5.102  -2.388  -1.465  1.00  0.00           H  
HETATM   48  H   UNL     1       6.148  -1.107  -0.806  1.00  0.00           H  
HETATM   49  H   UNL     1       4.915  -2.630   0.889  1.00  0.00           H  
HETATM   50  H   UNL     1       4.832  -0.876   1.151  1.00  0.00           H  
HETATM   51  H   UNL     1       2.563  -3.764   0.693  1.00  0.00           H  
CONECT    1   18   18   21                                            
CONECT    2   12    8    7   10                                       
CONECT    3   20   21   21                                            
CONECT    4    5   12   12   12                                       
CONECT    5   13   13    6    4                                       
CONECT    6   16   16    5   28                                       
CONECT    7    2   29                                                 
CONECT    8    9    2   30   31                                       
CONECT    9    8   32   33   34                                       
CONECT   10    2   11   35   36                                       
CONECT   11   10   37   38   39                                       
CONECT   12    4    4    4    2                                       
CONECT   13   14    5    5   40                                       
CONECT   14   17   15   15   13                                       
CONECT   15   27   14   14   16                                       
CONECT   16   15    6    6   41                                       
CONECT   17   26   26   18   14                                       
CONECT   18   19   17    1    1                                       
CONECT   19   23   20   20   18                                       
CONECT   20   19   19    3   42                                       
CONECT   21    3    3    1   22                                       
CONECT   22   21   43   44                                            
CONECT   23   24   19   45   46                                       
CONECT   24   23   25   47   48                                       
CONECT   25   24   26   49   50                                       
CONECT   26   25   27   17   17                                       
CONECT   27   26   15   51                                            
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   13                                                      
CONECT   41   16                                                      
CONECT   42   20                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
