COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.186   3.480  -0.018  1.00  0.00           N  
HETATM    2  C   UNL     1       2.357   2.747   0.043  1.00  0.00           C  
HETATM    3  N   UNL     1       3.537   3.355   0.130  1.00  0.00           N  
HETATM    4  C   UNL     1       4.658   2.658   0.189  1.00  0.00           C  
HETATM    5  N   UNL     1       4.680   1.343   0.166  1.00  0.00           N  
HETATM    6  C   UNL     1       3.547   0.645   0.080  1.00  0.00           C  
HETATM    7  C   UNL     1       2.330   1.346   0.021  1.00  0.00           C  
HETATM    8  N   UNL     1       3.253  -0.691   0.035  1.00  0.00           N  
HETATM    9  C   UNL     1       4.244  -1.768   0.079  1.00  0.00           C  
HETATM   10  C   UNL     1       3.947  -2.712   1.262  1.00  0.00           C  
HETATM   11  C   UNL     1       3.122  -3.863   0.633  1.00  0.00           C  
HETATM   12  C   UNL     1       3.800  -4.055  -0.746  1.00  0.00           C  
HETATM   13  C   UNL     1       4.151  -2.622  -1.198  1.00  0.00           C  
HETATM   14  C   UNL     1       1.900  -0.875  -0.055  1.00  0.00           C  
HETATM   15  C   UNL     1       1.275   0.328  -0.060  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.185   0.569  -0.147  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.941  -0.069  -1.130  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.300   0.158  -1.208  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.914   1.020  -0.309  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.164   1.657   0.670  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.806   1.430   0.757  1.00  0.00           C  
HETATM   22  O   UNL     1      -4.253   1.241  -0.389  1.00  0.00           O  
HETATM   23  C   UNL     1      -5.088   0.210  -0.097  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.575  -0.981   0.397  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.427  -2.028   0.693  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.789  -1.889   0.499  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.302  -0.703   0.007  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.456   0.349  -0.286  1.00  0.00           C  
HETATM   29  H   UNL     1       0.331   3.024  -0.078  1.00  0.00           H  
HETATM   30  H   UNL     1       1.218   4.449   0.002  1.00  0.00           H  
HETATM   31  H   UNL     1       5.595   3.190   0.260  1.00  0.00           H  
HETATM   32  H   UNL     1       5.246  -1.350   0.176  1.00  0.00           H  
HETATM   33  H   UNL     1       4.874  -3.096   1.687  1.00  0.00           H  
HETATM   34  H   UNL     1       3.364  -2.196   2.025  1.00  0.00           H  
HETATM   35  H   UNL     1       3.203  -4.769   1.233  1.00  0.00           H  
HETATM   36  H   UNL     1       2.079  -3.569   0.513  1.00  0.00           H  
HETATM   37  H   UNL     1       4.705  -4.655  -0.646  1.00  0.00           H  
HETATM   38  H   UNL     1       3.109  -4.518  -1.450  1.00  0.00           H  
HETATM   39  H   UNL     1       3.368  -2.234  -1.850  1.00  0.00           H  
HETATM   40  H   UNL     1       5.108  -2.619  -1.720  1.00  0.00           H  
HETATM   41  H   UNL     1       1.404  -1.834  -0.105  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.464  -0.739  -1.829  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.886  -0.336  -1.969  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.645   2.327   1.367  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.224   1.922   1.522  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.512  -1.090   0.549  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.028  -2.955   1.077  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.453  -2.709   0.731  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.366  -0.597  -0.144  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.858   1.276  -0.665  1.00  0.00           H  
CONECT    1    2   29   30                                            
CONECT    2    1    3    3    7                                       
CONECT    3    2    2    4                                            
CONECT    4    3    5    5   31                                       
CONECT    5    4    4    6                                            
CONECT    6    5    8    7    7                                       
CONECT    7    2    6    6   15                                       
CONECT    8    6    9   14                                            
CONECT    9    8   10   13   32                                       
CONECT   10    9   11   33   34                                       
CONECT   11   10   12   35   36                                       
CONECT   12   11   13   37   38                                       
CONECT   13    9   12   39   40                                       
CONECT   14    8   15   15   41                                       
CONECT   15    7   14   14   16                                       
CONECT   16   15   17   17   21                                       
CONECT   17   16   16   18   42                                       
CONECT   18   17   19   19   43                                       
CONECT   19   18   18   20   22                                       
CONECT   20   19   21   21   44                                       
CONECT   21   16   20   20   45                                       
CONECT   22   19   23                                                 
CONECT   23   22   24   24   28                                       
CONECT   24   23   23   25   46                                       
CONECT   25   24   26   26   47                                       
CONECT   26   25   25   27   48                                       
CONECT   27   26   28   28   49                                       
CONECT   28   23   27   27   50                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
