COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       8.641   4.681  -0.026  1.00  0.00           N  
HETATM    2  C   UNL     1       7.965   3.767  -0.034  1.00  0.00           C  
HETATM    3  C   UNL     1       7.114   2.616  -0.044  1.00  0.00           C  
HETATM    4  C   UNL     1       7.512   1.446   0.609  1.00  0.00           C  
HETATM    5  C   UNL     1       6.690   0.342   0.603  1.00  0.00           C  
HETATM    6  C   UNL     1       5.882   2.662  -0.703  1.00  0.00           C  
HETATM    7  C   UNL     1       5.065   1.555  -0.711  1.00  0.00           C  
HETATM    8  C   UNL     1       5.461   0.389  -0.055  1.00  0.00           C  
HETATM    9  C   UNL     1       4.577  -0.802  -0.061  1.00  0.00           C  
HETATM   10  C   UNL     1       3.173  -0.785  -0.021  1.00  0.00           C  
HETATM   11  C   UNL     1       1.963   0.116   0.036  1.00  0.00           C  
HETATM   12  N   UNL     1       4.973  -2.057  -0.111  1.00  0.00           N  
HETATM   13  N   UNL     1       3.839  -2.878  -0.104  1.00  0.00           N  
HETATM   14  C   UNL     1       2.735  -2.075  -0.043  1.00  0.00           C  
HETATM   15  C   UNL     1       1.257  -2.109   0.001  1.00  0.00           C  
HETATM   16  C   UNL     1       0.767  -0.804   0.044  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.589  -0.568   0.090  1.00  0.00           C  
HETATM   18  C   UNL     1       0.358  -3.180  -0.008  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.002  -2.939   0.041  1.00  0.00           C  
HETATM   20  O   UNL     1      -1.876  -3.981   0.033  1.00  0.00           O  
HETATM   21  C   UNL     1      -1.319  -5.295  -0.028  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.480  -1.631   0.094  1.00  0.00           C  
HETATM   23  O   UNL     1      -2.819  -1.398   0.142  1.00  0.00           O  
HETATM   24  C   UNL     1      -3.237  -0.032   0.195  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.765   0.031   0.244  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.214   1.492   0.300  1.00  0.00           C  
HETATM   27  N   UNL     1      -6.681   1.553   0.348  1.00  0.00           N  
HETATM   28  C   UNL     1      -7.269   1.061  -0.906  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.796   1.086  -0.791  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.142   2.918   0.640  1.00  0.00           C  
HETATM   31  C   UNL     1      -8.670   2.924   0.740  1.00  0.00           C  
HETATM   32  O   UNL     1      -9.224   2.414  -0.476  1.00  0.00           O  
HETATM   33  H   UNL     1       8.464   1.408   1.118  1.00  0.00           H  
HETATM   34  H   UNL     1       6.997  -0.562   1.108  1.00  0.00           H  
HETATM   35  H   UNL     1       5.572   3.567  -1.204  1.00  0.00           H  
HETATM   36  H   UNL     1       4.113   1.590  -1.220  1.00  0.00           H  
HETATM   37  H   UNL     1       1.984   0.715   0.945  1.00  0.00           H  
HETATM   38  H   UNL     1       1.935   0.763  -0.841  1.00  0.00           H  
HETATM   39  H   UNL     1       3.838  -3.848  -0.132  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.960   0.446   0.124  1.00  0.00           H  
HETATM   41  H   UNL     1       0.726  -4.194  -0.049  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.677  -5.458   0.838  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.122  -6.031  -0.029  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.731  -5.398  -0.941  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.825   0.440   1.086  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.881   0.491  -0.692  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.177  -0.442  -0.647  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.122  -0.493   1.131  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.801   1.965   1.192  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.857   2.016  -0.586  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.956   1.702  -1.731  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.934   0.041  -1.090  1.00  0.00           H  
HETATM   53  H   UNL     1      -9.237   0.776  -1.738  1.00  0.00           H  
HETATM   54  H   UNL     1      -9.112   0.405  -0.001  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.714   3.252   1.586  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.827   3.588  -0.160  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.983   2.296   1.574  1.00  0.00           H  
HETATM   58  H   UNL     1      -9.020   3.944   0.900  1.00  0.00           H  
CONECT    1    2    2    2                                            
CONECT    2    3    1    1    1                                       
CONECT    3    4    4    6    2                                       
CONECT    4    5    3    3   33                                       
CONECT    5    8    8    4   34                                       
CONECT    6    7    7    3   35                                       
CONECT    7    8    6    6   36                                       
CONECT    8    9    5    5    7                                       
CONECT    9   12   12   10    8                                       
CONECT   10   14   14    9   11                                       
CONECT   11   10   16   37   38                                       
CONECT   12   13    9    9                                            
CONECT   13   14   12   39                                            
CONECT   14   13   15   10   10                                       
CONECT   15   18   14   16   16                                       
CONECT   16   15   15   17   11                                       
CONECT   17   22   22   16   40                                       
CONECT   18   19   19   15   41                                       
CONECT   19   20   18   18   22                                       
CONECT   20   21   19                                                 
CONECT   21   20   42   43   44                                       
CONECT   22   19   23   17   17                                       
CONECT   23   24   22                                                 
CONECT   24   23   25   45   46                                       
CONECT   25   24   26   47   48                                       
CONECT   26   25   27   49   50                                       
CONECT   27   26   28   30                                            
CONECT   28   27   29   51   52                                       
CONECT   29   28   32   53   54                                       
CONECT   30   27   31   55   56                                       
CONECT   31   30   32   57   58                                       
CONECT   32   29   31                                                 
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
