COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.693  -2.695  -1.304  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.108  -4.109  -1.314  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.708  -4.893  -0.226  1.00  0.00           N  
HETATM    4  C   UNL     1      -1.227  -6.281  -0.249  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.445  -4.266   1.078  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.031  -2.852   1.088  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.431  -2.068   0.000  1.00  0.00           N  
HETATM    8  C   UNL     1      -1.886  -0.753   0.022  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.233  -0.482  -0.191  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.689   0.817  -0.170  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.797   1.868   0.065  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.284   3.259   0.087  1.00  0.00           C  
HETATM   13  O   UNL     1      -2.508   4.172   0.292  1.00  0.00           O  
HETATM   14  O   UNL     1      -4.590   3.519  -0.119  1.00  0.00           O  
HETATM   15  C   UNL     1      -5.000   4.911  -0.083  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.442   1.598   0.280  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.990   0.292   0.264  1.00  0.00           C  
HETATM   18  N   UNL     1       0.366   0.016   0.479  1.00  0.00           N  
HETATM   19  C   UNL     1       1.307   0.870   0.027  1.00  0.00           C  
HETATM   20  O   UNL     1       0.977   1.918  -0.493  1.00  0.00           O  
HETATM   21  C   UNL     1       2.740   0.532   0.166  1.00  0.00           C  
HETATM   22  C   UNL     1       3.715   1.416  -0.295  1.00  0.00           C  
HETATM   23  C   UNL     1       3.121  -0.670   0.764  1.00  0.00           C  
HETATM   24  C   UNL     1       4.459  -0.983   0.892  1.00  0.00           C  
HETATM   25  C   UNL     1       5.424  -0.108   0.429  1.00  0.00           C  
HETATM   26  C   UNL     1       5.055   1.093  -0.162  1.00  0.00           C  
HETATM   27  O   UNL     1       6.009   1.951  -0.610  1.00  0.00           O  
HETATM   28  C   UNL     1       7.371   1.553  -0.440  1.00  0.00           C  
HETATM   29  H   UNL     1      -1.228  -2.103  -2.092  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.769  -2.745  -1.473  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.327  -4.586  -2.269  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.028  -4.057  -1.172  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.143  -6.292  -0.132  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.687  -6.839   0.567  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.494  -6.742  -1.200  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.910  -4.858   1.866  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.370  -4.216   1.247  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.110  -2.905   0.946  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.812  -2.375   2.044  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.924  -1.292  -0.373  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.736   1.025  -0.336  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.768   5.333   0.895  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.465   5.467  -0.854  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.072   4.980  -0.264  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.751   2.407   0.462  1.00  0.00           H  
HETATM   46  H   UNL     1       0.629  -0.788   0.952  1.00  0.00           H  
HETATM   47  H   UNL     1       3.427   2.350  -0.755  1.00  0.00           H  
HETATM   48  H   UNL     1       2.369  -1.356   1.127  1.00  0.00           H  
HETATM   49  H   UNL     1       4.753  -1.913   1.355  1.00  0.00           H  
HETATM   50  H   UNL     1       6.470  -0.358   0.532  1.00  0.00           H  
HETATM   51  H   UNL     1       7.545   0.618  -0.972  1.00  0.00           H  
HETATM   52  H   UNL     1       8.027   2.326  -0.839  1.00  0.00           H  
HETATM   53  H   UNL     1       7.579   1.413   0.621  1.00  0.00           H  
CONECT    1    7    2   29   30                                       
CONECT    2    1    3   31   32                                       
CONECT    3    2    5    4                                            
CONECT    4    3   33   34   35                                       
CONECT    5    6    3   36   37                                       
CONECT    6    7    5   38   39                                       
CONECT    7    8    1    6                                            
CONECT    8   17   17    9    7                                       
CONECT    9   10   10    8   40                                       
CONECT   10   11    9    9   41                                       
CONECT   11   12   16   16   10                                       
CONECT   12   13   13   14   11                                       
CONECT   13   12   12                                                 
CONECT   14   15   12                                                 
CONECT   15   14   42   43   44                                       
CONECT   16   11   11   17   45                                       
CONECT   17   16   18    8    8                                       
CONECT   18   17   19   46                                            
CONECT   19   18   21   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   22   19   23   23                                       
CONECT   22   26   26   21   47                                       
CONECT   23   21   21   24   48                                       
CONECT   24   25   25   23   49                                       
CONECT   25   26   24   24   50                                       
CONECT   26   27   22   22   25                                       
CONECT   27   28   26                                                 
CONECT   28   27   51   52   53                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   18                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
