COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.504  -0.690   0.899  1.00  0.00           C  
HETATM    2  N   UNL     1      -1.294  -0.258   2.288  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.540   0.351   2.787  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.967  -0.361   0.533  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.662  -0.270   1.917  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.567   0.044  -0.024  1.00  0.00           C  
HETATM    7  O   UNL     1       0.213   0.849   0.423  1.00  0.00           O  
HETATM    8  O   UNL     1      -0.601  -0.194  -1.344  1.00  0.00           O  
HETATM    9  C   UNL     1       0.300   0.514  -2.234  1.00  0.00           C  
HETATM   10  C   UNL     1       0.057   0.059  -3.675  1.00  0.00           C  
HETATM   11  C   UNL     1       1.009   0.805  -4.612  1.00  0.00           C  
HETATM   12  N   UNL     1       1.265  -1.110  -7.795  1.00  0.00           N  
HETATM   13  C   UNL     1       0.394  -0.509  -8.581  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.342   0.568  -8.127  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.155   1.015  -6.828  1.00  0.00           C  
HETATM   16  C   UNL     1       0.769   0.358  -6.031  1.00  0.00           C  
HETATM   17  C   UNL     1       1.473  -0.708  -6.556  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.150  -0.391   2.988  1.00  0.00           C  
HETATM   19  O   UNL     1       0.818  -0.910   2.473  1.00  0.00           O  
HETATM   20  C   UNL     1      -0.074   0.099   4.393  1.00  0.00           C  
HETATM   21  O   UNL     1      -1.038   0.616   4.905  1.00  0.00           O  
HETATM   22  C   UNL     1       1.205  -0.049   5.176  1.00  0.00           C  
HETATM   23  C   UNL     1       2.330   0.701   4.461  1.00  0.00           C  
HETATM   24  C   UNL     1       1.568  -1.531   5.282  1.00  0.00           C  
HETATM   25  C   UNL     1       1.015   0.530   6.579  1.00  0.00           C  
HETATM   26  C   UNL     1       2.314   0.379   7.373  1.00  0.00           C  
HETATM   27  H   UNL     1      -1.335  -1.764   0.820  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.691   0.099   3.837  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.513   1.432   2.655  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.406  -1.159  -0.066  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.025   0.592   0.009  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.936  -1.259   2.283  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.532   0.384   1.876  1.00  0.00           H  
HETATM   34  H   UNL     1       0.120   1.586  -2.156  1.00  0.00           H  
HETATM   35  H   UNL     1       1.331   0.297  -1.954  1.00  0.00           H  
HETATM   36  H   UNL     1       0.238  -1.012  -3.753  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.972   0.275  -3.955  1.00  0.00           H  
HETATM   38  H   UNL     1       0.828   1.878  -4.534  1.00  0.00           H  
HETATM   39  H   UNL     1       2.039   0.589  -4.332  1.00  0.00           H  
HETATM   40  H   UNL     1       0.254  -0.863  -9.592  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.054   1.056  -8.776  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.716   1.855  -6.446  1.00  0.00           H  
HETATM   43  H   UNL     1       2.195  -1.225  -5.942  1.00  0.00           H  
HETATM   44  H   UNL     1       2.071   1.757   4.385  1.00  0.00           H  
HETATM   45  H   UNL     1       3.255   0.593   5.026  1.00  0.00           H  
HETATM   46  H   UNL     1       2.465   0.288   3.461  1.00  0.00           H  
HETATM   47  H   UNL     1       0.766  -2.066   5.791  1.00  0.00           H  
HETATM   48  H   UNL     1       1.703  -1.945   4.282  1.00  0.00           H  
HETATM   49  H   UNL     1       2.493  -1.639   5.847  1.00  0.00           H  
HETATM   50  H   UNL     1       0.213  -0.004   7.088  1.00  0.00           H  
HETATM   51  H   UNL     1       0.756   1.586   6.503  1.00  0.00           H  
HETATM   52  H   UNL     1       2.179   0.792   8.372  1.00  0.00           H  
HETATM   53  H   UNL     1       2.573  -0.676   7.448  1.00  0.00           H  
HETATM   54  H   UNL     1       3.116   0.914   6.863  1.00  0.00           H  
CONECT    1    2    4    6   27                                       
CONECT    2    1    3   18                                            
CONECT    3    2    5   28   29                                       
CONECT    4    1    5   30   31                                       
CONECT    5    3    4   32   33                                       
CONECT    6    1    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6    9                                                 
CONECT    9    8   10   34   35                                       
CONECT   10    9   11   36   37                                       
CONECT   11   10   16   38   39                                       
CONECT   12   13   13   17                                            
CONECT   13   12   12   14   40                                       
CONECT   14   13   15   15   41                                       
CONECT   15   14   14   16   42                                       
CONECT   16   11   15   17   17                                       
CONECT   17   12   16   16   43                                       
CONECT   18    2   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23   24   25                                       
CONECT   23   22   44   45   46                                       
CONECT   24   22   47   48   49                                       
CONECT   25   22   26   50   51                                       
CONECT   26   25   52   53   54                                       
CONECT   27    1                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
