COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.587   0.521  -0.675  1.00  0.00           N  
HETATM    2  N   UNL     1       0.051   3.659  -0.067  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.188  -0.356   0.907  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.763  -0.191  -0.405  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.503  -0.732  -1.448  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.662  -1.432  -1.181  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.628   1.699  -1.546  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.086   3.501  -0.483  1.00  0.00           C  
HETATM    9  C   UNL     1       1.829   0.942  -0.349  1.00  0.00           C  
HETATM   10  C   UNL     1       5.728  -1.886   0.612  1.00  0.00           C  
HETATM   11  C   UNL     1       4.919  -2.191  -1.620  1.00  0.00           C  
HETATM   12  O   UNL     1       0.627  -0.887   0.535  1.00  0.00           O  
HETATM   13  C   UNL     1       0.581   0.126  -0.131  1.00  0.00           C  
HETATM   14  N   UNL     1       2.955   0.307   0.340  1.00  0.00           N  
HETATM   15  C   UNL     1       3.811  -0.635  -0.178  1.00  0.00           C  
HETATM   16  C   UNL     1       3.919  -1.267  -1.412  1.00  0.00           C  
HETATM   17  C   UNL     1       5.818  -2.495  -0.606  1.00  0.00           C  
HETATM   18  C   UNL     1       4.721  -0.942   0.849  1.00  0.00           C  
HETATM   19  N   UNL     1       4.392  -0.196   1.922  1.00  0.00           N  
HETATM   20  N   UNL     1       3.371   0.540   1.659  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.882   2.929  -0.714  1.00  0.00           C  
HETATM   22  N   UNL     1      -0.603   4.710   0.589  1.00  0.00           N  
HETATM   23  C   UNL     1      -1.884   4.613   0.341  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.347  -1.057   1.174  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.088  -1.597   0.131  1.00  0.00           C  
HETATM   26  N   UNL     1      -5.263  -2.307   0.401  1.00  0.00           N  
HETATM   27  C   UNL     1      -5.773  -2.384   1.772  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.982  -2.975  -0.687  1.00  0.00           C  
HETATM   29  H   UNL     1       1.004   3.483  -0.053  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.610   0.060   1.718  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.172  -0.603  -2.468  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.239  -1.852  -1.992  1.00  0.00           H  
HETATM   33  H   UNL     1       0.326   1.801  -2.064  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.428   1.582  -2.277  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.037   3.156  -0.863  1.00  0.00           H  
HETATM   36  H   UNL     1       2.042   1.000  -1.416  1.00  0.00           H  
HETATM   37  H   UNL     1       1.680   1.946   0.047  1.00  0.00           H  
HETATM   38  H   UNL     1       6.431  -2.134   1.393  1.00  0.00           H  
HETATM   39  H   UNL     1       5.004  -2.683  -2.577  1.00  0.00           H  
HETATM   40  H   UNL     1       3.222  -1.035  -2.204  1.00  0.00           H  
HETATM   41  H   UNL     1       6.596  -3.222  -0.783  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.652   5.279   0.706  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.678  -1.186   2.194  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.452  -1.550   1.954  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.308  -3.323   1.909  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.941  -2.333   2.473  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.508  -2.733  -1.638  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.955  -4.054  -0.531  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.017  -2.635  -0.700  1.00  0.00           H  
CONECT    1   13    4    7                                            
CONECT    2   22   21   29                                            
CONECT    3    4    4   24   30                                       
CONECT    4    1    3    3    5                                       
CONECT    5    4    6    6   31                                       
CONECT    6    5    5   25   32                                       
CONECT    7    1   21   33   34                                       
CONECT    8   23   21   21   35                                       
CONECT    9   14   13   36   37                                       
CONECT   10   18   18   17   38                                       
CONECT   11   17   17   16   39                                       
CONECT   12   13   13                                                 
CONECT   13    9   12   12    1                                       
CONECT   14   20   15    9                                            
CONECT   15   18   14   16   16                                       
CONECT   16   15   15   11   40                                       
CONECT   17   10   11   11   41                                       
CONECT   18   19   10   10   15                                       
CONECT   19   20   20   18                                            
CONECT   20   19   19   14                                            
CONECT   21    2    8    8    7                                       
CONECT   22   23   23    2                                            
CONECT   23   22   22    8   42                                       
CONECT   24    3   25   25   43                                       
CONECT   25   24   24    6   26                                       
CONECT   26   25   28   27                                            
CONECT   27   26   44   45   46                                       
CONECT   28   26   47   48   49                                       
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   27                                                      
CONECT   45   27                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
