COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.414  -3.651  -1.027  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.860  -3.744  -1.551  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.834  -2.839  -1.178  1.00  0.00           C  
HETATM    4  C   UNL     1       2.094  -2.541   0.443  1.00  0.00           C  
HETATM    5  C   UNL     1       3.963  -3.095   1.385  1.00  0.00           C  
HETATM    6  C   UNL     1       5.207  -0.905   1.361  1.00  0.00           C  
HETATM    7  C   UNL     1       2.879  -1.403   0.487  1.00  0.00           C  
HETATM    8  C   UNL     1       2.523  -0.060  -0.010  1.00  0.00           C  
HETATM    9  C   UNL     1       2.096   0.106  -1.330  1.00  0.00           C  
HETATM   10  C   UNL     1       1.762   1.362  -1.795  1.00  0.00           C  
HETATM   11  C   UNL     1       1.850   2.460  -0.952  1.00  0.00           C  
HETATM   12  C   UNL     1       1.902   4.817  -0.695  1.00  0.00           C  
HETATM   13  C   UNL     1       2.716   4.627   0.559  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.579  -0.854   0.129  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.833  -0.097   0.062  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.138  -0.560   0.167  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.136   0.287   0.610  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.538   2.058   0.842  1.00  0.00           C  
HETATM   19  O   UNL     1      -2.317   0.031   0.921  1.00  0.00           O  
HETATM   20  N   UNL     1      -3.821  -0.952  -0.386  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.536   1.217   0.399  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.836   1.593   0.950  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.535  -1.822  -0.269  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.251  -1.723   0.263  1.00  0.00           C  
HETATM   25  C   UNL     1       0.726  -2.639  -0.117  1.00  0.00           C  
HETATM   26  C   UNL     1       1.469  -4.646  -1.435  1.00  0.00           C  
HETATM   27  N   UNL     1       4.060  -1.775   1.087  1.00  0.00           N  
HETATM   28  N   UNL     1       2.802  -3.543   0.997  1.00  0.00           N  
HETATM   29  C   UNL     1       2.606   1.046   0.840  1.00  0.00           C  
HETATM   30  C   UNL     1       2.277   2.300   0.368  1.00  0.00           C  
HETATM   31  O   UNL     1       2.360   3.389   1.179  1.00  0.00           O  
HETATM   32  O   UNL     1       1.596   5.933  -1.059  1.00  0.00           O  
HETATM   33  N   UNL     1       1.514   3.740  -1.413  1.00  0.00           N  
HETATM   34  H   UNL     1      -1.096  -4.529  -2.255  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.829  -2.918  -1.592  1.00  0.00           H  
HETATM   36  H   UNL     1       4.729  -3.684   1.869  1.00  0.00           H  
HETATM   37  H   UNL     1       5.889  -0.926   0.511  1.00  0.00           H  
HETATM   38  H   UNL     1       4.859   0.115   1.522  1.00  0.00           H  
HETATM   39  H   UNL     1       5.726  -1.257   2.252  1.00  0.00           H  
HETATM   40  H   UNL     1       2.027  -0.748  -1.987  1.00  0.00           H  
HETATM   41  H   UNL     1       1.432   1.490  -2.815  1.00  0.00           H  
HETATM   42  H   UNL     1       3.776   4.615   0.305  1.00  0.00           H  
HETATM   43  H   UNL     1       2.518   5.448   1.248  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.373  -1.580  -0.098  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.151  -0.072   0.692  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.308   3.080   1.104  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.012  -1.614  -1.068  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.523   1.581   0.315  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.618   2.253   1.296  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.014  -0.939   0.967  1.00  0.00           H  
HETATM   51  H   UNL     1       1.968  -4.297  -2.339  1.00  0.00           H  
HETATM   52  H   UNL     1       2.201  -4.749  -0.633  1.00  0.00           H  
HETATM   53  H   UNL     1       1.002  -5.612  -1.627  1.00  0.00           H  
HETATM   54  H   UNL     1       2.931   0.920   1.862  1.00  0.00           H  
HETATM   55  H   UNL     1       1.010   3.852  -2.234  1.00  0.00           H  
CONECT    1   26    2    2   25                                       
CONECT    2    1    1    3   34                                       
CONECT    3    2   23   23   35                                       
CONECT    4   25   28    7    7                                       
CONECT    5   28   28   27   36                                       
CONECT    6   27   37   38   39                                       
CONECT    7   27    4    4    8                                       
CONECT    8    7    9    9   29                                       
CONECT    9    8    8   10   40                                       
CONECT   10    9   11   11   41                                       
CONECT   11   10   10   33   30                                       
CONECT   12   33   32   32   13                                       
CONECT   13   12   31   42   43                                       
CONECT   14   23   19   19   20                                       
CONECT   15   20   16   16   21                                       
CONECT   16   15   15   17   44                                       
CONECT   17   16   22   22   45                                       
CONECT   18   22   21   21   46                                       
CONECT   19   14   14                                                 
CONECT   20   14   15   47                                            
CONECT   21   18   18   15   48                                       
CONECT   22   17   17   18   49                                       
CONECT   23    3    3   24   14                                       
CONECT   24   23   25   25   50                                       
CONECT   25   24   24    1    4                                       
CONECT   26    1   51   52   53                                       
CONECT   27    5    6    7                                            
CONECT   28    4    5    5                                            
CONECT   29   30   30    8   54                                       
CONECT   30   31   11   29   29                                       
CONECT   31   13   30                                                 
CONECT   32   12   12                                                 
CONECT   33   11   12   55                                            
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   24                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   29                                                      
CONECT   55   33                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
