COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.255   0.423   1.245  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.407   1.431   1.210  1.00  0.00           C  
HETATM    3  N   UNL     1      -8.203   1.224  -0.007  1.00  0.00           N  
HETATM    4  C   UNL     1      -7.396   1.446  -1.213  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.244   0.440  -1.250  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.381   0.612   0.002  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.279  -0.416   0.001  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.960  -0.012   0.006  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.593  -1.764   0.000  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.587  -2.713  -0.002  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.264  -2.320  -0.002  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.942  -0.964   0.005  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.522  -0.536   0.004  1.00  0.00           C  
HETATM   14  C   UNL     1       0.495  -1.489  -0.003  1.00  0.00           C  
HETATM   15  C   UNL     1       1.814  -1.088  -0.004  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.201   0.821   0.005  1.00  0.00           C  
HETATM   17  C   UNL     1       1.120   1.216   0.004  1.00  0.00           C  
HETATM   18  C   UNL     1       2.131   0.264   0.002  1.00  0.00           C  
HETATM   19  O   UNL     1       3.431   0.656   0.002  1.00  0.00           O  
HETATM   20  C   UNL     1       4.420  -0.376   0.000  1.00  0.00           C  
HETATM   21  C   UNL     1       5.793   0.245   0.000  1.00  0.00           C  
HETATM   22  C   UNL     1       5.941   1.623   0.006  1.00  0.00           C  
HETATM   23  C   UNL     1       7.223   2.150   0.005  1.00  0.00           C  
HETATM   24  C   UNL     1       8.305   1.289  -0.002  1.00  0.00           C  
HETATM   25  N   UNL     1       8.127  -0.018  -0.009  1.00  0.00           N  
HETATM   26  C   UNL     1       6.922  -0.553  -0.002  1.00  0.00           C  
HETATM   27  C   UNL     1       6.773  -2.053  -0.002  1.00  0.00           C  
HETATM   28  H   UNL     1      -5.656   0.587   2.141  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.658  -0.590   1.257  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.040   1.289   2.086  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.004   2.443   1.213  1.00  0.00           H  
HETATM   32  H   UNL     1      -9.023   1.812  -0.007  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.020   1.317  -2.097  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.993   2.459  -1.199  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.646  -0.573  -1.279  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.636   0.615  -2.138  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.947   1.612   0.011  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.716   1.040   0.011  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.627  -2.075   0.000  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.837  -3.763  -0.002  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.479  -3.062  -0.003  1.00  0.00           H  
HETATM   42  H   UNL     1       0.250  -2.541  -0.007  1.00  0.00           H  
HETATM   43  H   UNL     1       2.603  -1.826  -0.010  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.987   1.561   0.006  1.00  0.00           H  
HETATM   45  H   UNL     1       1.369   2.267   0.004  1.00  0.00           H  
HETATM   46  H   UNL     1       4.301  -0.994   0.890  1.00  0.00           H  
HETATM   47  H   UNL     1       4.300  -0.993  -0.890  1.00  0.00           H  
HETATM   48  H   UNL     1       5.077   2.272   0.012  1.00  0.00           H  
HETATM   49  H   UNL     1       7.376   3.219   0.010  1.00  0.00           H  
HETATM   50  H   UNL     1       9.307   1.691  -0.003  1.00  0.00           H  
HETATM   51  H   UNL     1       6.736  -2.414  -1.030  1.00  0.00           H  
HETATM   52  H   UNL     1       7.623  -2.502   0.511  1.00  0.00           H  
HETATM   53  H   UNL     1       5.852  -2.327   0.512  1.00  0.00           H  
CONECT    1    6    2   28   29                                       
CONECT    2    1    3   30   31                                       
CONECT    3    4    2   32                                            
CONECT    4    5    3   33   34                                       
CONECT    5    6    4   35   36                                       
CONECT    6    7    5    1   37                                       
CONECT    7    8    8    9    6                                       
CONECT    8   12    7    7   38                                       
CONECT    9   10   10    7   39                                       
CONECT   10   11    9    9   40                                       
CONECT   11   12   12   10   41                                       
CONECT   12   13   11   11    8                                       
CONECT   13   16   16   14   12                                       
CONECT   14   15   15   13   42                                       
CONECT   15   18   14   14   43                                       
CONECT   16   17   13   13   44                                       
CONECT   17   18   18   16   45                                       
CONECT   18   19   17   17   15                                       
CONECT   19   20   18                                                 
CONECT   20   19   21   46   47                                       
CONECT   21   20   26   26   22                                       
CONECT   22   21   23   23   48                                       
CONECT   23   22   22   24   49                                       
CONECT   24   25   25   23   50                                       
CONECT   25   26   24   24                                            
CONECT   26   27   21   21   25                                       
CONECT   27   26   51   52   53                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
