COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.981  -0.226   1.981  1.00  0.00           C  
HETATM    2  O   UNL     1       9.083   0.086   0.914  1.00  0.00           O  
HETATM    3  C   UNL     1       8.674   1.454   0.879  1.00  0.00           C  
HETATM    4  C   UNL     1       7.719   1.671  -0.297  1.00  0.00           C  
HETATM    5  N   UNL     1       6.487   0.904  -0.076  1.00  0.00           N  
HETATM    6  C   UNL     1       5.544   1.088  -1.187  1.00  0.00           C  
HETATM    7  C   UNL     1       4.295   0.287  -0.925  1.00  0.00           C  
HETATM    8  C   UNL     1       3.240   0.860  -0.239  1.00  0.00           C  
HETATM    9  C   UNL     1       2.094   0.128   0.003  1.00  0.00           C  
HETATM   10  C   UNL     1       2.002  -1.184  -0.443  1.00  0.00           C  
HETATM   11  C   UNL     1       3.063  -1.756  -1.133  1.00  0.00           C  
HETATM   12  C   UNL     1       4.205  -1.017  -1.376  1.00  0.00           C  
HETATM   13  N   UNL     1       0.843  -1.927  -0.199  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.391  -1.301  -0.188  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.453  -2.002   0.159  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.662  -1.429   0.181  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.813  -2.145   0.545  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.023  -1.525   0.555  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.143  -0.171   0.206  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.027   0.563  -0.158  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.773  -0.059  -0.174  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.602   0.636  -0.535  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.458  -0.013  -0.521  1.00  0.00           N  
HETATM   24  C   UNL     1      -6.476   0.479   0.226  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.620  -0.240   0.588  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.840   0.403   0.594  1.00  0.00           C  
HETATM   27  N   UNL     1      -8.936   1.677   0.263  1.00  0.00           N  
HETATM   28  C   UNL     1      -7.883   2.390  -0.086  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.623   1.827  -0.113  1.00  0.00           C  
HETATM   30  H   UNL     1      10.243  -1.283   1.939  1.00  0.00           H  
HETATM   31  H   UNL     1      10.884   0.377   1.883  1.00  0.00           H  
HETATM   32  H   UNL     1       9.500  -0.009   2.935  1.00  0.00           H  
HETATM   33  H   UNL     1       8.166   1.706   1.810  1.00  0.00           H  
HETATM   34  H   UNL     1       9.550   2.092   0.758  1.00  0.00           H  
HETATM   35  H   UNL     1       7.478   2.731  -0.378  1.00  0.00           H  
HETATM   36  H   UNL     1       8.196   1.336  -1.219  1.00  0.00           H  
HETATM   37  H   UNL     1       6.060   1.151   0.805  1.00  0.00           H  
HETATM   38  H   UNL     1       5.288   2.144  -1.274  1.00  0.00           H  
HETATM   39  H   UNL     1       6.006   0.749  -2.115  1.00  0.00           H  
HETATM   40  H   UNL     1       3.312   1.880   0.108  1.00  0.00           H  
HETATM   41  H   UNL     1       1.270   0.576   0.539  1.00  0.00           H  
HETATM   42  H   UNL     1       2.995  -2.776  -1.481  1.00  0.00           H  
HETATM   43  H   UNL     1       5.029  -1.460  -1.916  1.00  0.00           H  
HETATM   44  H   UNL     1       0.904  -2.882  -0.038  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.738  -3.188   0.817  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.905  -2.082   0.836  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.123   1.605  -0.427  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.642   1.679  -0.812  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.549  -1.282   0.860  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.729  -0.143   0.873  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.007   3.430  -0.349  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.765   2.418  -0.395  1.00  0.00           H  
CONECT    1    2   30   31   32                                       
CONECT    2    3    1                                                 
CONECT    3    4    2   33   34                                       
CONECT    4    3    5   35   36                                       
CONECT    5    6    4   37                                            
CONECT    6    7    5   38   39                                       
CONECT    7    6    8    8   12                                       
CONECT    8    7    7    9   40                                       
CONECT    9    8   10   10   41                                       
CONECT   10    9    9   11   13                                       
CONECT   11   12   12   10   42                                       
CONECT   12    7   11   11   43                                       
CONECT   13   10   14   44                                            
CONECT   14   13   15   15   23                                       
CONECT   15   14   14   16                                            
CONECT   16   15   17   17   21                                       
CONECT   17   16   16   18   45                                       
CONECT   18   17   19   19   46                                       
CONECT   19   18   18   20   24                                       
CONECT   20   21   21   19   47                                       
CONECT   21   16   22   20   20                                       
CONECT   22   23   23   21   48                                       
CONECT   23   14   22   22                                            
CONECT   24   19   29   29   25                                       
CONECT   25   24   26   26   49                                       
CONECT   26   25   25   27   50                                       
CONECT   27   28   28   26                                            
CONECT   28   29   27   27   51                                       
CONECT   29   24   24   28   52                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
