COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.804  -0.200  -0.952  1.00  0.00           N  
HETATM    2  N   UNL     1       5.095   0.737   1.382  1.00  0.00           N  
HETATM    3  C   UNL     1      -1.185  -1.383  -1.727  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.753   0.640  -0.494  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.211   0.303  -0.679  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.059   1.396  -0.083  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.453   2.479  -0.855  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.599   3.324   1.062  1.00  0.00           C  
HETATM    9  C   UNL     1       1.021  -0.039   0.620  1.00  0.00           C  
HETATM   10  C   UNL     1       3.216   0.554  -0.149  1.00  0.00           C  
HETATM   11  C   UNL     1       1.404   0.402  -1.717  1.00  0.00           C  
HETATM   12  C   UNL     1       6.838   1.416  -0.622  1.00  0.00           C  
HETATM   13  C   UNL     1       7.266   1.313   0.694  1.00  0.00           C  
HETATM   14  C   UNL     1       6.359   0.969   1.678  1.00  0.00           C  
HETATM   15  O   UNL     1      -1.435   1.667   0.067  1.00  0.00           O  
HETATM   16  C   UNL     1      -4.458   1.330   1.238  1.00  0.00           C  
HETATM   17  N   UNL     1      -5.205   2.281   1.765  1.00  0.00           N  
HETATM   18  C   UNL     1      -5.233   3.461  -0.264  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.413  -2.544  -0.793  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.647  -2.947  -0.272  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.432  -4.023   0.521  1.00  0.00           C  
HETATM   22  N   UNL     1      -0.491  -3.351  -0.333  1.00  0.00           N  
HETATM   23  N   UNL     1      -1.109  -4.290   0.502  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.439  -5.374   1.225  1.00  0.00           C  
HETATM   25  C   UNL     1       0.544   0.055  -0.682  1.00  0.00           C  
HETATM   26  C   UNL     1       2.736   0.644  -1.455  1.00  0.00           C  
HETATM   27  C   UNL     1       2.349   0.211   0.888  1.00  0.00           C  
HETATM   28  C   UNL     1       4.646   0.824   0.137  1.00  0.00           C  
HETATM   29  C   UNL     1       5.506   1.167  -0.905  1.00  0.00           C  
HETATM   30  H   UNL     1      -2.101  -1.176  -2.280  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.387  -1.632  -2.427  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.430   0.212  -1.743  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.431  -0.641  -0.181  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.160   2.555  -1.891  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.206   4.085   1.529  1.00  0.00           H  
HETATM   36  H   UNL     1       0.349  -0.305   1.423  1.00  0.00           H  
HETATM   37  H   UNL     1       1.031   0.475  -2.728  1.00  0.00           H  
HETATM   38  H   UNL     1       7.528   1.684  -1.409  1.00  0.00           H  
HETATM   39  H   UNL     1       8.300   1.500   0.947  1.00  0.00           H  
HETATM   40  H   UNL     1       6.689   0.889   2.703  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.155   0.491   1.846  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.559   4.318  -0.836  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.602  -2.483  -0.469  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.184  -4.569   1.070  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.409  -6.265   0.598  1.00  0.00           H  
HETATM   46  H   UNL     1       0.578  -5.071   1.474  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.987  -5.593   2.141  1.00  0.00           H  
HETATM   48  H   UNL     1       3.405   0.913  -2.259  1.00  0.00           H  
HETATM   49  H   UNL     1       2.718   0.142   1.901  1.00  0.00           H  
HETATM   50  H   UNL     1       5.139   1.238  -1.918  1.00  0.00           H  
CONECT    1    4    3   25                                            
CONECT    2   28   28   14                                            
CONECT    3    1   19   30   31                                       
CONECT    4    5   15   15    1                                       
CONECT    5    6    4   32   33                                       
CONECT    6   16   16    7    5                                       
CONECT    7   18   18    6   34                                       
CONECT    8   17   17   18   35                                       
CONECT    9   25   27   27   36                                       
CONECT   10   26   26   27   28                                       
CONECT   11   25   25   26   37                                       
CONECT   12   29   29   13   38                                       
CONECT   13   14   14   12   39                                       
CONECT   14    2   13   13   40                                       
CONECT   15    4    4                                                 
CONECT   16   17    6    6   41                                       
CONECT   17    8    8   16                                            
CONECT   18    8    7    7   42                                       
CONECT   19   20    3   22   22                                       
CONECT   20   21   21   19   43                                       
CONECT   21   20   20   23   44                                       
CONECT   22   19   19   23                                            
CONECT   23   21   22   24                                            
CONECT   24   23   45   46   47                                       
CONECT   25    1   11   11    9                                       
CONECT   26   11   10   10   48                                       
CONECT   27    9    9   10   49                                       
CONECT   28   10    2    2   29                                       
CONECT   29   28   12   12   50                                       
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
