COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.426  -0.750   0.180  1.00  0.00           O  
HETATM    2  C   UNL     1      -0.357   0.386  -0.246  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.484   1.082  -0.496  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.730   0.461  -0.370  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.816   1.195   0.057  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.062   0.567   0.180  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.210   1.259   0.610  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.386   0.579   0.705  1.00  0.00           C  
HETATM    9  N   UNL     1      -7.475  -0.710   0.405  1.00  0.00           N  
HETATM   10  C   UNL     1      -6.447  -1.418  -0.002  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.188  -0.812  -0.134  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.060  -1.530  -0.566  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.862  -0.897  -0.683  1.00  0.00           C  
HETATM   14  N   UNL     1       0.847   0.953  -0.462  1.00  0.00           N  
HETATM   15  C   UNL     1       2.072   0.200  -0.185  1.00  0.00           C  
HETATM   16  C   UNL     1       3.289   1.066  -0.513  1.00  0.00           C  
HETATM   17  C   UNL     1       4.569   0.289  -0.199  1.00  0.00           C  
HETATM   18  C   UNL     1       5.786   1.152  -0.536  1.00  0.00           C  
HETATM   19  N   UNL     1       5.807   2.332   0.337  1.00  0.00           N  
HETATM   20  C   UNL     1       4.605  -0.993  -1.034  1.00  0.00           C  
HETATM   21  C   UNL     1       5.885  -1.771  -0.719  1.00  0.00           C  
HETATM   22  C   UNL     1       5.911  -2.130   0.768  1.00  0.00           C  
HETATM   23  C   UNL     1       5.874  -0.848   1.603  1.00  0.00           C  
HETATM   24  C   UNL     1       4.595  -0.071   1.288  1.00  0.00           C  
HETATM   25  H   UNL     1      -1.430   2.012  -0.764  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.708   2.243   0.293  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.159   2.309   0.859  1.00  0.00           H  
HETATM   28  H   UNL     1      -8.271   1.104   1.033  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.570  -2.466  -0.234  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.145  -2.579  -0.807  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.998  -1.453  -1.016  1.00  0.00           H  
HETATM   32  H   UNL     1       0.902   1.860  -0.802  1.00  0.00           H  
HETATM   33  H   UNL     1       2.097  -0.077   0.869  1.00  0.00           H  
HETATM   34  H   UNL     1       2.091  -0.702  -0.798  1.00  0.00           H  
HETATM   35  H   UNL     1       3.274   1.328  -1.572  1.00  0.00           H  
HETATM   36  H   UNL     1       3.260   1.976   0.086  1.00  0.00           H  
HETATM   37  H   UNL     1       6.696   0.571  -0.384  1.00  0.00           H  
HETATM   38  H   UNL     1       5.728   1.470  -1.577  1.00  0.00           H  
HETATM   39  H   UNL     1       6.593   2.927   0.123  1.00  0.00           H  
HETATM   40  H   UNL     1       4.939   2.844   0.275  1.00  0.00           H  
HETATM   41  H   UNL     1       3.738  -1.608  -0.793  1.00  0.00           H  
HETATM   42  H   UNL     1       4.587  -0.737  -2.093  1.00  0.00           H  
HETATM   43  H   UNL     1       5.910  -2.684  -1.314  1.00  0.00           H  
HETATM   44  H   UNL     1       6.752  -1.156  -0.959  1.00  0.00           H  
HETATM   45  H   UNL     1       5.043  -2.745   1.009  1.00  0.00           H  
HETATM   46  H   UNL     1       6.822  -2.684   0.992  1.00  0.00           H  
HETATM   47  H   UNL     1       5.893  -1.104   2.662  1.00  0.00           H  
HETATM   48  H   UNL     1       6.742  -0.233   1.362  1.00  0.00           H  
HETATM   49  H   UNL     1       4.569   0.843   1.883  1.00  0.00           H  
HETATM   50  H   UNL     1       3.727  -0.685   1.529  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   14                                       
CONECT    3    4    2   25                                            
CONECT    4    5    5   13    3                                       
CONECT    5    6    4    4   26                                       
CONECT    6    7    7   11    5                                       
CONECT    7    8    6    6   27                                       
CONECT    8    9    9    7   28                                       
CONECT    9    8    8   10                                            
CONECT   10    9   11   11   29                                       
CONECT   11   10   10    6   12                                       
CONECT   12   11   13   13   30                                       
CONECT   13   12   12    4   31                                       
CONECT   14    2   15   32                                            
CONECT   15   14   16   33   34                                       
CONECT   16   15   17   35   36                                       
CONECT   17   16   24   20   18                                       
CONECT   18   17   19   37   38                                       
CONECT   19   18   39   40                                            
CONECT   20   17   21   41   42                                       
CONECT   21   20   22   43   44                                       
CONECT   22   23   21   45   46                                       
CONECT   23   24   22   47   48                                       
CONECT   24   17   23   49   50                                       
CONECT   25    3                                                      
CONECT   26    5                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29   10                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   16                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
