COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.759   6.187  -1.194  1.00  0.00           C  
HETATM    2  C   UNL     1       7.626   6.743   0.911  1.00  0.00           C  
HETATM    3  C   UNL     1       7.892   5.226  -1.194  1.00  0.00           C  
HETATM    4  C   UNL     1       4.416   7.879   1.132  1.00  0.00           C  
HETATM    5  C   UNL     1       8.546   3.999  -0.510  1.00  0.00           C  
HETATM    6  C   UNL     1       5.401   2.150  -0.507  1.00  0.00           C  
HETATM    7  C   UNL     1       5.177   1.686   0.771  1.00  0.00           C  
HETATM    8  C   UNL     1       1.893   1.926  -1.863  1.00  0.00           C  
HETATM    9  C   UNL     1       2.938   1.396   0.348  1.00  0.00           C  
HETATM   10  C   UNL     1       1.945   2.997  -2.897  1.00  0.00           C  
HETATM   11  C   UNL     1       0.891   3.054  -3.693  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.220   2.143  -3.575  1.00  0.00           C  
HETATM   13  C   UNL     1       5.825   6.490  -0.271  1.00  0.00           C  
HETATM   14  C   UNL     1       7.098   6.083  -0.294  1.00  0.00           C  
HETATM   15  C   UNL     1       5.616   7.341   0.883  1.00  0.00           C  
HETATM   16  N   UNL     1       6.783   7.464   1.588  1.00  0.00           N  
HETATM   17  C   UNL     1       3.545   6.717  -0.965  1.00  0.00           C  
HETATM   18  C   UNL     1       3.236   7.618   0.218  1.00  0.00           C  
HETATM   19  C   UNL     1       7.522   3.035   0.102  1.00  0.00           C  
HETATM   20  N   UNL     1       9.335   3.262  -1.501  1.00  0.00           N  
HETATM   21  O   UNL     1       6.659   2.522  -0.904  1.00  0.00           O  
HETATM   22  C   UNL     1       4.335   2.235  -1.384  1.00  0.00           C  
HETATM   23  C   UNL     1       3.069   1.850  -0.954  1.00  0.00           C  
HETATM   24  N   UNL     1       3.963   1.304   1.225  1.00  0.00           N  
HETATM   25  N   UNL     1       0.943   1.071  -1.703  1.00  0.00           N  
HETATM   26  C   UNL     1      -0.253   1.072  -2.549  1.00  0.00           C  
HETATM   27  C   UNL     1       0.497   3.889  -4.805  1.00  0.00           C  
HETATM   28  N   UNL     1      -1.135   2.397  -4.472  1.00  0.00           N  
HETATM   29  N   UNL     1      -0.666   3.531  -5.267  1.00  0.00           N  
HETATM   30  H   UNL     1       4.940   5.549  -2.050  1.00  0.00           H  
HETATM   31  H   UNL     1       8.682   6.607   1.183  1.00  0.00           H  
HETATM   32  H   UNL     1       7.231   4.875  -2.004  1.00  0.00           H  
HETATM   33  H   UNL     1       8.677   5.828  -1.682  1.00  0.00           H  
HETATM   34  H   UNL     1       4.265   8.517   1.997  1.00  0.00           H  
HETATM   35  H   UNL     1       9.219   4.358   0.278  1.00  0.00           H  
HETATM   36  H   UNL     1       5.983   1.603   1.494  1.00  0.00           H  
HETATM   37  H   UNL     1       1.975   1.082   0.741  1.00  0.00           H  
HETATM   38  H   UNL     1       2.791   3.667  -2.968  1.00  0.00           H  
HETATM   39  H   UNL     1       2.732   6.499  -1.651  1.00  0.00           H  
HETATM   40  H   UNL     1       2.867   8.577  -0.161  1.00  0.00           H  
HETATM   41  H   UNL     1       2.432   7.160   0.806  1.00  0.00           H  
HETATM   42  H   UNL     1       6.914   3.532   0.867  1.00  0.00           H  
HETATM   43  H   UNL     1       8.026   2.179   0.565  1.00  0.00           H  
HETATM   44  H   UNL     1       9.303   3.575  -2.445  1.00  0.00           H  
HETATM   45  H   UNL     1       9.699   2.376  -1.238  1.00  0.00           H  
HETATM   46  H   UNL     1       4.484   2.597  -2.399  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.140   1.213  -1.923  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.341   0.105  -3.055  1.00  0.00           H  
HETATM   49  H   UNL     1       1.129   4.707  -5.173  1.00  0.00           H  
CONECT    1   17   17   13   30                                       
CONECT    2   16   16   14   31                                       
CONECT    3   14    5   32   33                                       
CONECT    4   18   15   15   34                                       
CONECT    5    3   19   20   35                                       
CONECT    6    7    7   22   21                                       
CONECT    7    6    6   24   36                                       
CONECT    8   25   25   23   10                                       
CONECT    9   24   24   23   37                                       
CONECT   10    8   11   11   38                                       
CONECT   11   10   10   12   27                                       
CONECT   12   11   26   28   28                                       
CONECT   13    1   15   14   14                                       
CONECT   14    2    3   13   13                                       
CONECT   15    4    4   13   16                                       
CONECT   16    2    2   15                                            
CONECT   17    1    1   18   39                                       
CONECT   18    4   17   40   41                                       
CONECT   19    5   21   42   43                                       
CONECT   20    5   44   45                                            
CONECT   21    6   19                                                 
CONECT   22    6   23   23   46                                       
CONECT   23    8    9   22   22                                       
CONECT   24    7    9    9                                            
CONECT   25    8    8   26                                            
CONECT   26   12   25   47   48                                       
CONECT   27   11   29   29   49                                       
CONECT   28   12   12   29                                            
CONECT   29   27   27   28                                            
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    7                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   22                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
