COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.378   0.228   0.112  1.00  0.00           N  
HETATM    2  C   UNL     1       2.162  -0.892   0.163  1.00  0.00           C  
HETATM    3  C   UNL     1       3.537  -0.745   0.151  1.00  0.00           C  
HETATM    4  C   UNL     1       4.080   0.534   0.090  1.00  0.00           C  
HETATM    5  N   UNL     1       3.291   1.589   0.043  1.00  0.00           N  
HETATM    6  C   UNL     1       1.964   1.460   0.053  1.00  0.00           C  
HETATM    7  C   UNL     1       0.920   2.405   0.012  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.293   1.678   0.050  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.010   0.399   0.103  1.00  0.00           N  
HETATM   10  C   UNL     1       1.062   3.859  -0.056  1.00  0.00           C  
HETATM   11  O   UNL     1       1.119   4.415  -1.138  1.00  0.00           O  
HETATM   12  N   UNL     1       1.132   4.583   1.078  1.00  0.00           N  
HETATM   13  N   UNL     1      -1.572   2.228   0.028  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.690   1.394  -0.049  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.915   1.826   0.443  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.024   0.997   0.366  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.910  -0.264  -0.202  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.687  -0.696  -0.693  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.579   0.134  -0.623  1.00  0.00           C  
HETATM   20  O   UNL     1      -3.576  -1.931  -1.249  1.00  0.00           O  
HETATM   21  C   UNL     1      -4.760  -2.731  -1.294  1.00  0.00           C  
HETATM   22  O   UNL     1      -6.222   1.419   0.848  1.00  0.00           O  
HETATM   23  C   UNL     1      -7.322   0.513   0.735  1.00  0.00           C  
HETATM   24  C   UNL     1       5.576   0.714   0.077  1.00  0.00           C  
HETATM   25  C   UNL     1       6.116   2.145   0.127  1.00  0.00           C  
HETATM   26  N   UNL     1       1.592  -2.144   0.223  1.00  0.00           N  
HETATM   27  C   UNL     1       2.444  -3.335   0.277  1.00  0.00           C  
HETATM   28  C   UNL     1       1.566  -4.587   0.339  1.00  0.00           C  
HETATM   29  N   UNL     1       0.639  -4.479   1.473  1.00  0.00           N  
HETATM   30  C   UNL     1       6.202   1.340  -1.171  1.00  0.00           C  
HETATM   31  C   UNL     1       0.770  -4.716  -0.961  1.00  0.00           C  
HETATM   32  C   UNL     1       2.452  -5.821   0.520  1.00  0.00           C  
HETATM   33  H   UNL     1       4.180  -1.612   0.190  1.00  0.00           H  
HETATM   34  H   UNL     1       1.087   4.140   1.940  1.00  0.00           H  
HETATM   35  H   UNL     1       1.226   5.547   1.033  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.687   3.191   0.066  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.004   2.807   0.885  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.774  -0.909  -0.262  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.628  -0.201  -1.010  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.524  -2.215  -1.875  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.534  -3.689  -1.760  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.125  -2.897  -0.280  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.216   0.973   1.157  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.494   0.280  -0.315  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.094  -0.403   1.279  1.00  0.00           H  
HETATM   46  H   UNL     1       6.148  -0.057   0.594  1.00  0.00           H  
HETATM   47  H   UNL     1       5.389   2.956   0.169  1.00  0.00           H  
HETATM   48  H   UNL     1       7.042   2.315   0.676  1.00  0.00           H  
HETATM   49  H   UNL     1       0.627  -2.237   0.231  1.00  0.00           H  
HETATM   50  H   UNL     1       3.070  -3.374  -0.615  1.00  0.00           H  
HETATM   51  H   UNL     1       3.076  -3.290   1.163  1.00  0.00           H  
HETATM   52  H   UNL     1       0.005  -5.264   1.497  1.00  0.00           H  
HETATM   53  H   UNL     1       1.141  -4.392   2.344  1.00  0.00           H  
HETATM   54  H   UNL     1       7.185   0.980  -1.476  1.00  0.00           H  
HETATM   55  H   UNL     1       5.532   1.621  -1.983  1.00  0.00           H  
HETATM   56  H   UNL     1       1.459  -4.796  -1.803  1.00  0.00           H  
HETATM   57  H   UNL     1       0.145  -5.608  -0.917  1.00  0.00           H  
HETATM   58  H   UNL     1       0.139  -3.837  -1.090  1.00  0.00           H  
HETATM   59  H   UNL     1       3.019  -5.729   1.446  1.00  0.00           H  
HETATM   60  H   UNL     1       1.827  -6.713   0.564  1.00  0.00           H  
HETATM   61  H   UNL     1       3.140  -5.901  -0.322  1.00  0.00           H  
CONECT    1    2    6    9                                            
CONECT    2    1    3    3   26                                       
CONECT    3    2    2    4   33                                       
CONECT    4    3    5    5   24                                       
CONECT    5    4    4    6                                            
CONECT    6    1    5    7    7                                       
CONECT    7    6    6    8   10                                       
CONECT    8    7    9    9   13                                       
CONECT    9    1    8    8                                            
CONECT   10    7   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   34   35                                            
CONECT   13    8   14   36                                            
CONECT   14   13   15   15   19                                       
CONECT   15   14   14   16   37                                       
CONECT   16   15   17   17   22                                       
CONECT   17   16   16   18   38                                       
CONECT   18   17   19   19   20                                       
CONECT   19   14   18   18   39                                       
CONECT   20   18   21                                                 
CONECT   21   20   40   41   42                                       
CONECT   22   16   23                                                 
CONECT   23   22   43   44   45                                       
CONECT   24    4   25   30   46                                       
CONECT   25   24   30   47   48                                       
CONECT   26    2   27   49                                            
CONECT   27   26   28   50   51                                       
CONECT   28   27   29   31   32                                       
CONECT   29   28   52   53                                            
CONECT   30   24   25   54   55                                       
CONECT   31   28   56   57   58                                       
CONECT   32   28   59   60   61                                       
CONECT   33    3                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   19                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   21                                                      
CONECT   43   23                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
CONECT   59   32                                                      
CONECT   60   32                                                      
CONECT   61   32                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
