COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.717   1.589  -0.438  1.00  0.00           C  
HETATM    2  N   UNL     1       6.813   0.458  -0.193  1.00  0.00           N  
HETATM    3  C   UNL     1       7.173  -0.246   1.045  1.00  0.00           C  
HETATM    4  C   UNL     1       5.413   0.901  -0.159  1.00  0.00           C  
HETATM    5  C   UNL     1       4.491  -0.321  -0.152  1.00  0.00           C  
HETATM    6  C   UNL     1       3.033   0.141  -0.116  1.00  0.00           C  
HETATM    7  N   UNL     1       2.150  -1.028  -0.110  1.00  0.00           N  
HETATM    8  C   UNL     1       0.777  -0.859  -0.079  1.00  0.00           C  
HETATM    9  N   UNL     1       0.002  -1.939  -0.068  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.319  -1.842  -0.033  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.112  -2.971  -0.023  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.917  -3.762  -1.245  1.00  0.00           C  
HETATM   13  N   UNL     1       0.292   0.368  -0.055  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.034   0.573  -0.024  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.898  -0.550  -0.007  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.580   1.862   0.002  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.948   2.020   0.034  1.00  0.00           C  
HETATM   18  O   UNL     1      -3.481   3.269   0.059  1.00  0.00           O  
HETATM   19  C   UNL     1      -2.564   4.365   0.051  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.797   0.904   0.040  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.286  -0.362   0.031  1.00  0.00           C  
HETATM   22  O   UNL     1      -5.145   1.085   0.071  1.00  0.00           O  
HETATM   23  C   UNL     1      -5.957  -0.091   0.075  1.00  0.00           C  
HETATM   24  H   UNL     1       8.747   1.233  -0.459  1.00  0.00           H  
HETATM   25  H   UNL     1       7.472   2.049  -1.396  1.00  0.00           H  
HETATM   26  H   UNL     1       7.603   2.324   0.358  1.00  0.00           H  
HETATM   27  H   UNL     1       7.107   0.444   1.887  1.00  0.00           H  
HETATM   28  H   UNL     1       6.488  -1.079   1.203  1.00  0.00           H  
HETATM   29  H   UNL     1       8.192  -0.624   0.965  1.00  0.00           H  
HETATM   30  H   UNL     1       5.240   1.490   0.742  1.00  0.00           H  
HETATM   31  H   UNL     1       5.202   1.510  -1.038  1.00  0.00           H  
HETATM   32  H   UNL     1       4.663  -0.910  -1.052  1.00  0.00           H  
HETATM   33  H   UNL     1       4.701  -0.930   0.727  1.00  0.00           H  
HETATM   34  H   UNL     1       2.861   0.731   0.784  1.00  0.00           H  
HETATM   35  H   UNL     1       2.823   0.750  -0.995  1.00  0.00           H  
HETATM   36  H   UNL     1       2.529  -1.921  -0.128  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.895  -4.140  -1.274  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.615  -4.599  -1.251  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.097  -3.133  -2.117  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.933   2.727  -0.002  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.917   4.305   0.926  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.956   4.324  -0.853  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.118   5.303   0.073  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.948  -1.215   0.035  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.009   0.194   0.101  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.760  -0.672  -0.825  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.722  -0.692   0.954  1.00  0.00           H  
HETATM   48  C   UNL     1      -1.856  -3.782   1.175  1.00  0.00           C  
HETATM   49  H   UNL     1      -2.007  -3.172   2.066  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.542  -4.628   1.194  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.829  -4.147   1.155  1.00  0.00           H  
CONECT    1    2   24   25   26                                       
CONECT    2    1    3    4                                            
CONECT    3    2   27   28   29                                       
CONECT    4    5    2   30   31                                       
CONECT    5    6    4   32   33                                       
CONECT    6    5    7   34   35                                       
CONECT    7    8    6   36                                            
CONECT    8    9    9   13    7                                       
CONECT    9   10    8    8                                            
CONECT   10   11   15   15    9                                       
CONECT   11   12   10   48                                            
CONECT   12   11   37   38   39                                       
CONECT   13   14   14    8                                            
CONECT   14   15   16   13   13                                       
CONECT   15   21   10   10   14                                       
CONECT   16   17   17   14   40                                       
CONECT   17   20   18   16   16                                       
CONECT   18   17   19                                                 
CONECT   19   18   41   42   43                                       
CONECT   20   22   21   21   17                                       
CONECT   21   20   20   15   44                                       
CONECT   22   23   20                                                 
CONECT   23   22   45   46   47                                       
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   16                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   11   49   50   51                                       
CONECT   49   48                                                      
CONECT   50   48                                                      
CONECT   51   48                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
