COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.467   4.843  -1.176  1.00  0.00           C  
HETATM    2  C   UNL     1       2.207   3.019  -0.201  1.00  0.00           C  
HETATM    3  C   UNL     1       2.044   1.497  -0.191  1.00  0.00           C  
HETATM    4  C   UNL     1       4.414   1.240  -0.614  1.00  0.00           C  
HETATM    5  C   UNL     1       4.577   2.762  -0.624  1.00  0.00           C  
HETATM    6  C   UNL     1       4.099  -2.649   0.860  1.00  0.00           C  
HETATM    7  C   UNL     1       2.876  -3.211   0.531  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.873  -4.456  -0.877  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.585  -3.221  -0.571  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.923  -2.823  -0.611  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.366  -0.702   0.137  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.604  -2.295  -0.151  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.818   0.657   0.516  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.800   2.507   2.052  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.698   1.361  -0.312  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.037   1.580  -2.264  1.00  0.00           C  
HETATM   17  N   UNL     1       3.326   3.383  -1.081  1.00  0.00           N  
HETATM   18  N   UNL     1       3.295   0.876   0.266  1.00  0.00           N  
HETATM   19  C   UNL     1       3.162  -0.505   0.356  1.00  0.00           C  
HETATM   20  C   UNL     1       4.242  -1.275   0.774  1.00  0.00           C  
HETATM   21  C   UNL     1       1.836  -2.385   0.127  1.00  0.00           C  
HETATM   22  N   UNL     1       2.004  -1.073   0.054  1.00  0.00           N  
HETATM   23  N   UNL     1       0.601  -2.942  -0.207  1.00  0.00           N  
HETATM   24  N   UNL     1       0.395  -4.252  -0.653  1.00  0.00           N  
HETATM   25  N   UNL     1      -3.263  -1.602  -0.263  1.00  0.00           N  
HETATM   26  C   UNL     1      -1.015  -1.015   0.208  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.374   1.239   1.704  1.00  0.00           C  
HETATM   28  F   UNL     1      -1.528   0.564   2.514  1.00  0.00           F  
HETATM   29  C   UNL     1      -3.665   3.202   1.225  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.116   2.632   0.050  1.00  0.00           C  
HETATM   31  O   UNL     1      -4.141   0.802  -1.468  1.00  0.00           O  
HETATM   32  H   UNL     1       3.653   5.255  -0.185  1.00  0.00           H  
HETATM   33  H   UNL     1       4.301   5.085  -1.834  1.00  0.00           H  
HETATM   34  H   UNL     1       2.549   5.271  -1.581  1.00  0.00           H  
HETATM   35  H   UNL     1       1.290   3.480  -0.567  1.00  0.00           H  
HETATM   36  H   UNL     1       2.411   3.369   0.811  1.00  0.00           H  
HETATM   37  H   UNL     1       1.234   1.222   0.484  1.00  0.00           H  
HETATM   38  H   UNL     1       1.813   1.150  -1.198  1.00  0.00           H  
HETATM   39  H   UNL     1       4.209   0.890  -1.626  1.00  0.00           H  
HETATM   40  H   UNL     1       5.331   0.779  -0.248  1.00  0.00           H  
HETATM   41  H   UNL     1       4.808   3.109   0.383  1.00  0.00           H  
HETATM   42  H   UNL     1       5.387   3.037  -1.298  1.00  0.00           H  
HETATM   43  H   UNL     1       4.923  -3.270   1.182  1.00  0.00           H  
HETATM   44  H   UNL     1       2.733  -4.280   0.588  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.317  -5.377  -1.224  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.683  -3.522  -0.930  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.456   2.958   2.971  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.313   1.017  -3.156  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.933   1.806  -1.686  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.550   2.510  -2.556  1.00  0.00           H  
HETATM   51  H   UNL     1       5.181  -0.806   1.028  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.296  -0.277   0.533  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.994   4.192   1.503  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.795   3.178  -0.588  1.00  0.00           H  
CONECT    1   17   32   33   34                                       
CONECT    2    3   17   35   36                                       
CONECT    3    2   18   37   38                                       
CONECT    4   18    5   39   40                                       
CONECT    5   17    4   41   42                                       
CONECT    6    7   20   20   43                                       
CONECT    7   21   21    6   44                                       
CONECT    8    9   24   24   45                                       
CONECT    9   10    8   12   12                                       
CONECT   10   25   25    9   46                                       
CONECT   11   25   13   26   26                                       
CONECT   12    9    9   23   26                                       
CONECT   13   11   15   15   27                                       
CONECT   14   27   27   29   47                                       
CONECT   15   31   13   13   30                                       
CONECT   16   31   48   49   50                                       
CONECT   17    2    1    5                                            
CONECT   18    3   19    4                                            
CONECT   19   22   22   18   20                                       
CONECT   20    6    6   19   51                                       
CONECT   21   23    7    7   22                                       
CONECT   22   21   19   19                                            
CONECT   23   24   12   21                                            
CONECT   24    8    8   23                                            
CONECT   25   10   10   11                                            
CONECT   26   11   11   12   52                                       
CONECT   27   13   28   14   14                                       
CONECT   28   27                                                      
CONECT   29   30   30   14   53                                       
CONECT   30   15   29   29   54                                       
CONECT   31   16   15                                                 
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46   10                                                      
CONECT   47   14                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   20                                                      
CONECT   52   26                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
