COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.996   0.525  -0.619  1.00  0.00           C  
HETATM    2  N   UNL     1      -8.458  -1.817   0.308  1.00  0.00           N  
HETATM    3  C   UNL     1       0.324   1.283  -0.513  1.00  0.00           C  
HETATM    4  N   UNL     1      -3.514   1.017   1.098  1.00  0.00           N  
HETATM    5  C   UNL     1      -6.886  -0.128   0.993  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.517   0.380   0.470  1.00  0.00           C  
HETATM    7  O   UNL     1      -7.663   0.028   1.912  1.00  0.00           O  
HETATM    8  C   UNL     1      -2.302   1.109   0.614  1.00  0.00           C  
HETATM    9  C   UNL     1       1.669   1.383  -1.078  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.286  -0.985  -1.549  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.278  -0.228  -0.749  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.012  -0.153  -1.300  1.00  0.00           C  
HETATM   13  C   UNL     1       2.311   2.752   0.833  1.00  0.00           C  
HETATM   14  C   UNL     1       4.009   2.044  -0.915  1.00  0.00           C  
HETATM   15  C   UNL     1       4.723   0.805  -0.442  1.00  0.00           C  
HETATM   16  C   UNL     1       5.340   0.679   0.741  1.00  0.00           C  
HETATM   17  C   UNL     1       5.447   1.725   1.821  1.00  0.00           C  
HETATM   18  C   UNL     1       5.889  -0.681   0.774  1.00  0.00           C  
HETATM   19  C   UNL     1       6.623  -1.413   1.706  1.00  0.00           C  
HETATM   20  C   UNL     1       6.992  -2.709   1.416  1.00  0.00           C  
HETATM   21  C   UNL     1       6.636  -3.282   0.204  1.00  0.00           C  
HETATM   22  C   UNL     1       5.910  -2.569  -0.726  1.00  0.00           C  
HETATM   23  C   UNL     1       5.528  -1.262  -0.454  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.643   0.625  -1.186  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.377  -0.936  -0.155  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.279  -1.780  -0.759  1.00  0.00           C  
HETATM   27  N   UNL     1      -5.718   0.431   1.124  1.00  0.00           N  
HETATM   28  N   UNL     1       2.635   2.041  -0.406  1.00  0.00           N  
HETATM   29  O   UNL     1       1.917   0.873  -2.155  1.00  0.00           O  
HETATM   30  O   UNL     1       4.829  -0.338  -1.143  1.00  0.00           O  
HETATM   31  H   UNL     1      -9.226  -1.281   0.683  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.770  -2.426  -0.434  1.00  0.00           H  
HETATM   33  H   UNL     1       0.104   1.736   0.442  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.538   1.636   1.168  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.832  -0.274  -2.168  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.750  -1.668  -2.208  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.809  -0.615  -2.255  1.00  0.00           H  
HETATM   38  H   UNL     1       2.433   2.078   1.681  1.00  0.00           H  
HETATM   39  H   UNL     1       2.980   3.605   0.948  1.00  0.00           H  
HETATM   40  H   UNL     1       1.280   3.101   0.792  1.00  0.00           H  
HETATM   41  H   UNL     1       4.531   2.928  -0.546  1.00  0.00           H  
HETATM   42  H   UNL     1       3.993   2.060  -2.005  1.00  0.00           H  
HETATM   43  H   UNL     1       4.556   1.692   2.448  1.00  0.00           H  
HETATM   44  H   UNL     1       6.328   1.528   2.432  1.00  0.00           H  
HETATM   45  H   UNL     1       5.534   2.711   1.365  1.00  0.00           H  
HETATM   46  H   UNL     1       6.901  -0.968   2.650  1.00  0.00           H  
HETATM   47  H   UNL     1       7.561  -3.280   2.134  1.00  0.00           H  
HETATM   48  H   UNL     1       6.931  -4.298  -0.014  1.00  0.00           H  
HETATM   49  H   UNL     1       5.639  -3.026  -1.666  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.424   0.172  -2.142  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.769  -0.265  -0.919  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.732  -2.524  -1.414  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.754  -2.297   0.044  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.692   1.040   1.878  1.00  0.00           H  
CONECT    1   24    8    8   12                                       
CONECT    2   25   31   32                                            
CONECT    3    9   24   24   33                                       
CONECT    4    8    6    6                                            
CONECT    5   27   25    7    7                                       
CONECT    6    4    4   11   27                                       
CONECT    7    5    5                                                 
CONECT    8    1    1    4   34                                       
CONECT    9   29   29   28    3                                       
CONECT   10   11   26   35   36                                       
CONECT   11   12   12    6   10                                       
CONECT   12    1   11   11   37                                       
CONECT   13   28   38   39   40                                       
CONECT   14   28   15   41   42                                       
CONECT   15   14   16   16   30                                       
CONECT   16   17   15   15   18                                       
CONECT   17   16   43   44   45                                       
CONECT   18   16   19   19   23                                       
CONECT   19   18   18   20   46                                       
CONECT   20   19   21   21   47                                       
CONECT   21   20   20   22   48                                       
CONECT   22   23   23   21   49                                       
CONECT   23   18   30   22   22                                       
CONECT   24    3    3    1   50                                       
CONECT   25    2    5   26   51                                       
CONECT   26   10   25   52   53                                       
CONECT   27    6    5   54                                            
CONECT   28   13    9   14                                            
CONECT   29    9    9                                                 
CONECT   30   15   23                                                 
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
