COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.763   1.180  -0.942  1.00  0.00           C  
HETATM    2  C   UNL     1       6.059   0.723  -1.079  1.00  0.00           C  
HETATM    3  C   UNL     1       6.432  -0.485  -0.522  1.00  0.00           C  
HETATM    4  C   UNL     1       5.507  -1.247   0.178  1.00  0.00           C  
HETATM    5  C   UNL     1       4.205  -0.797   0.321  1.00  0.00           C  
HETATM    6  C   UNL     1       3.828   0.421  -0.240  1.00  0.00           C  
HETATM    7  C   UNL     1       2.437   0.913  -0.086  1.00  0.00           C  
HETATM    8  C   UNL     1       2.062   2.134  -0.644  1.00  0.00           C  
HETATM    9  C   UNL     1       0.768   2.589  -0.499  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.162   1.830   0.202  1.00  0.00           C  
HETATM   11  C   UNL     1       0.210   0.612   0.760  1.00  0.00           C  
HETATM   12  C   UNL     1       1.501   0.151   0.612  1.00  0.00           C  
HETATM   13  O   UNL     1       5.878  -2.435   0.724  1.00  0.00           O  
HETATM   14  C   UNL     1       7.237  -2.838   0.538  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.471   2.293   0.348  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.530   1.384   0.407  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.711   1.732   1.050  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.757   0.832   1.107  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.628  -0.416   0.525  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.454  -0.767  -0.115  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.407   0.131  -0.181  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.771  -1.397   0.589  1.00  0.00           C  
HETATM   23  N   UNL     1      -6.641  -1.212  -0.580  1.00  0.00           N1+
HETATM   24  C   UNL     1      -5.901  -1.557  -1.801  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.818  -2.083  -0.458  1.00  0.00           C  
HETATM   26  H   UNL     1       4.475   2.126  -1.375  1.00  0.00           H  
HETATM   27  H   UNL     1       6.782   1.312  -1.624  1.00  0.00           H  
HETATM   28  H   UNL     1       7.447  -0.838  -0.633  1.00  0.00           H  
HETATM   29  H   UNL     1       3.484  -1.388   0.865  1.00  0.00           H  
HETATM   30  H   UNL     1       2.784   2.724  -1.188  1.00  0.00           H  
HETATM   31  H   UNL     1       0.478   3.535  -0.931  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.514   0.024   1.305  1.00  0.00           H  
HETATM   33  H   UNL     1       1.788  -0.798   1.040  1.00  0.00           H  
HETATM   34  H   UNL     1       7.400  -3.801   1.022  1.00  0.00           H  
HETATM   35  H   UNL     1       7.446  -2.927  -0.528  1.00  0.00           H  
HETATM   36  H   UNL     1       7.900  -2.093   0.978  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.645   3.245   0.408  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.812   2.707   1.505  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.675   1.102   1.606  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.357  -1.742  -0.568  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.490  -0.143  -0.681  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.378  -2.413   0.592  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.345  -1.226   1.500  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.939  -0.249  -0.629  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.028  -0.911  -1.892  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.579  -2.597  -1.749  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.546  -1.420  -2.669  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.367  -1.827   0.448  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.463  -1.946  -1.325  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.496  -3.123  -0.405  1.00  0.00           H  
CONECT    1    2    6    6   26                                       
CONECT    2    3    3    1   27                                       
CONECT    3    2    2    4   28                                       
CONECT    4    3   13    5    5                                       
CONECT    5    4    4    6   29                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6   12   12    8                                       
CONECT    8    7    9    9   30                                       
CONECT    9    8    8   10   31                                       
CONECT   10   11   11    9   15                                       
CONECT   11   12   10   10   32                                       
CONECT   12    7    7   11   33                                       
CONECT   13   14    4                                                 
CONECT   14   13   34   35   36                                       
CONECT   15   10   16   37                                            
CONECT   16   21   15   17   17                                       
CONECT   17   16   16   18   38                                       
CONECT   18   19   19   17   39                                       
CONECT   19   20   22   18   18                                       
CONECT   20   21   21   19   40                                       
CONECT   21   20   20   16   41                                       
CONECT   22   19   23   42   43                                       
CONECT   23   22   25   24   44                                       
CONECT   24   23   45   46   47                                       
CONECT   25   23   48   49   50                                       
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
