COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.811   4.630   0.214  1.00  0.00           N  
HETATM    2  N   UNL     1      -2.603  -0.692  -0.525  1.00  0.00           N  
HETATM    3  C   UNL     1       1.130  -0.146  -0.563  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.258  -0.318  -1.124  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.250  -0.524   0.022  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.584  -0.893   0.550  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.978  -1.064  -0.058  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.043  -0.267   1.039  1.00  0.00           C  
HETATM    9  C   UNL     1       1.947  -1.256  -0.367  1.00  0.00           C  
HETATM   10  C   UNL     1       4.080  -2.283   0.352  1.00  0.00           C  
HETATM   11  C   UNL     1       3.717   0.184   0.485  1.00  0.00           C  
HETATM   12  C   UNL     1       0.549   5.236  -0.216  1.00  0.00           C  
HETATM   13  C   UNL     1       1.983   3.265   0.134  1.00  0.00           C  
HETATM   14  N   UNL     1       1.045   2.382  -0.323  1.00  0.00           N  
HETATM   15  C   UNL     1       1.599   1.116  -0.246  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.997  -1.400   1.046  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.959   0.319  -0.393  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.442   0.261  -0.697  1.00  0.00           C  
HETATM   19  N   UNL     1       1.522  -2.509  -0.672  1.00  0.00           N  
HETATM   20  C   UNL     1       2.279  -3.547  -0.492  1.00  0.00           C  
HETATM   21  N   UNL     1       3.541  -3.476   0.009  1.00  0.00           N  
HETATM   22  O   UNL     1       5.208  -2.205   0.802  1.00  0.00           O  
HETATM   23  C   UNL     1       3.250  -1.084   0.161  1.00  0.00           C  
HETATM   24  C   UNL     1       2.898   1.290   0.275  1.00  0.00           C  
HETATM   25  N   UNL     1       3.069   2.623   0.484  1.00  0.00           N  
HETATM   26  H   UNL     1      -2.633  -1.452  -1.189  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.535   0.573  -1.688  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.279  -1.186  -1.783  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.230   0.344   0.681  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.973  -1.415   0.586  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.323  -1.787   1.117  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.580  -0.028   1.212  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.964  -1.856  -0.806  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.040  -0.666   1.229  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.790   0.492   1.779  1.00  0.00           H  
HETATM   36  H   UNL     1       4.712   0.312   0.888  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.269   4.832   0.381  1.00  0.00           H  
HETATM   38  H   UNL     1       0.599   6.316  -0.079  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.478  -2.354   0.832  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.498  -1.441   2.014  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.518  -0.298  -1.096  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.318   1.349  -0.410  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.928   1.106  -0.238  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.269   0.247  -1.773  1.00  0.00           H  
HETATM   45  H   UNL     1       1.886  -4.519  -0.754  1.00  0.00           H  
HETATM   46  H   UNL     1       4.060  -4.287   0.122  1.00  0.00           H  
HETATM   47  H   UNL     1       0.156   2.603  -0.643  1.00  0.00           H  
HETATM   48  H   UNL     1       2.528   5.191   0.551  1.00  0.00           H  
HETATM   49  H   UNL     1       0.377   5.010  -1.268  1.00  0.00           H  
CONECT    1   13   12   48                                            
CONECT    2    6    5   26                                            
CONECT    3    9    4   15   15                                       
CONECT    4    3   27   28    5                                       
CONECT    5    2    4   29   30                                       
CONECT    6    2   31   32    7                                       
CONECT    7    6   16   33   18                                       
CONECT    8   16   34   35   17                                       
CONECT    9    3   23   23   19                                       
CONECT   10   22   22   21   23                                       
CONECT   11   23   36   24   24                                       
CONECT   12    1   37   38   49                                       
CONECT   13    1   14   25   25                                       
CONECT   14   13   15   47                                            
CONECT   15   14    3    3   24                                       
CONECT   16    7    8   39   40                                       
CONECT   17    8   18   41   42                                       
CONECT   18   17    7   43   44                                       
CONECT   19    9   20   20                                            
CONECT   20   19   19   21   45                                       
CONECT   21   10   20   46                                            
CONECT   22   10   10                                                 
CONECT   23    9    9   11   10                                       
CONECT   24   15   11   11   25                                       
CONECT   25   13   13   24                                            
CONECT   26    2                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   14                                                      
CONECT   48    1                                                      
CONECT   49   12                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
