COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.985   0.339  -1.622  1.00  0.00           O  
HETATM    2  O   UNL     1       8.625   0.006  -1.832  1.00  0.00           O  
HETATM    3  O   UNL     1       2.071  -0.780   1.439  1.00  0.00           O  
HETATM    4  O   UNL     1       3.906  -1.816   2.104  1.00  0.00           O  
HETATM    5  O   UNL     1      -1.896   1.082  -0.112  1.00  0.00           O  
HETATM    6  C   UNL     1       5.784  -0.269   0.649  1.00  0.00           C  
HETATM    7  C   UNL     1       4.273  -0.034   0.608  1.00  0.00           C  
HETATM    8  C   UNL     1       5.180   0.950   1.350  1.00  0.00           C  
HETATM    9  C   UNL     1       3.404  -0.942   1.439  1.00  0.00           C  
HETATM   10  C   UNL     1       3.666   0.428  -0.719  1.00  0.00           C  
HETATM   11  C   UNL     1       6.561  -0.028  -0.619  1.00  0.00           C  
HETATM   12  N   UNL     1       7.894  -0.220  -0.640  1.00  0.00           N  
HETATM   13  C   UNL     1       1.297  -1.692   2.263  1.00  0.00           C  
HETATM   14  C   UNL     1       2.178   0.603  -0.557  1.00  0.00           C  
HETATM   15  C   UNL     1       1.665   1.825  -0.162  1.00  0.00           C  
HETATM   16  C   UNL     1       0.302   1.988  -0.012  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.554   0.924  -0.259  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.037  -0.301  -0.655  1.00  0.00           C  
HETATM   19  C   UNL     1       1.327  -0.457  -0.808  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.716  -0.056  -0.383  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.163   0.305  -0.169  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.522   1.563   0.225  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.866   1.874   0.417  1.00  0.00           C  
HETATM   24  N   UNL     1      -6.813   0.988   0.229  1.00  0.00           N  
HETATM   25  C   UNL     1      -5.184  -0.642  -0.375  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.530  -0.261  -0.156  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.550  -1.207  -0.356  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.232  -2.471  -0.748  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.906  -2.846  -0.957  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.892  -1.953  -0.786  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.241   3.267   0.852  1.00  0.00           C  
HETATM   32  H   UNL     1       9.574  -0.157  -1.748  1.00  0.00           H  
HETATM   33  H   UNL     1       6.149  -1.081   1.278  1.00  0.00           H  
HETATM   34  H   UNL     1       5.148   0.939   2.440  1.00  0.00           H  
HETATM   35  H   UNL     1       5.344   1.926   0.894  1.00  0.00           H  
HETATM   36  H   UNL     1       4.113   1.378  -1.012  1.00  0.00           H  
HETATM   37  H   UNL     1       3.862  -0.318  -1.488  1.00  0.00           H  
HETATM   38  H   UNL     1       8.354  -0.513   0.163  1.00  0.00           H  
HETATM   39  H   UNL     1       1.467  -2.716   1.931  1.00  0.00           H  
HETATM   40  H   UNL     1       1.605  -1.591   3.304  1.00  0.00           H  
HETATM   41  H   UNL     1       0.237  -1.452   2.173  1.00  0.00           H  
HETATM   42  H   UNL     1       2.332   2.653   0.030  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.098   2.943   0.296  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.701  -1.131  -0.847  1.00  0.00           H  
HETATM   45  H   UNL     1       1.729  -1.409  -1.121  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.569  -0.372  -1.416  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.441  -0.870   0.288  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.764   2.315   0.388  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.583  -0.933  -0.198  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.019  -3.194  -0.900  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.680  -3.855  -1.268  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.869  -2.256  -0.952  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.405   3.891  -0.026  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.154   3.229   1.446  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.435   3.690   1.452  1.00  0.00           H  
CONECT    1   11   11                                                 
CONECT    2   12   32                                                 
CONECT    3    9   13                                                 
CONECT    4    9    9                                                 
CONECT    5   17   20                                                 
CONECT    6    7    8   11   33                                       
CONECT    7    6    8    9   10                                       
CONECT    8    6    7   34   35                                       
CONECT    9    3    4    4    7                                       
CONECT   10    7   14   36   37                                       
CONECT   11    1    1    6   12                                       
CONECT   12    2   11   38                                            
CONECT   13    3   39   40   41                                       
CONECT   14   10   15   15   19                                       
CONECT   15   14   14   16   42                                       
CONECT   16   15   17   17   43                                       
CONECT   17    5   16   16   18                                       
CONECT   18   17   19   19   44                                       
CONECT   19   14   18   18   45                                       
CONECT   20    5   21   46   47                                       
CONECT   21   20   22   22   25                                       
CONECT   22   21   21   23   48                                       
CONECT   23   22   24   24   31                                       
CONECT   24   23   23   26                                            
CONECT   25   21   26   26   30                                       
CONECT   26   24   25   25   27                                       
CONECT   27   26   28   28   49                                       
CONECT   28   27   27   29   50                                       
CONECT   29   28   30   30   51                                       
CONECT   30   25   29   29   52                                       
CONECT   31   23   53   54   55                                       
CONECT   32    2                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53   31                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
