COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.577  -1.100   0.749  1.00  0.00           N  
HETATM    2  C   UNL     1       2.139  -4.242  -1.060  1.00  0.00           C  
HETATM    3  C   UNL     1       1.291  -2.363   0.319  1.00  0.00           C  
HETATM    4  C   UNL     1       0.417   1.144   1.028  1.00  0.00           C  
HETATM    5  C   UNL     1       2.885  -0.661   1.244  1.00  0.00           C  
HETATM    6  C   UNL     1       3.724  -0.140   0.076  1.00  0.00           C  
HETATM    7  C   UNL     1       5.882   0.953  -0.550  1.00  0.00           C  
HETATM    8  C   UNL     1       0.786   2.007  -0.180  1.00  0.00           C  
HETATM    9  C   UNL     1      -8.751   1.958   0.936  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.692  -0.243  -0.687  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.954   0.263  -0.914  1.00  0.00           C  
HETATM   12  C   UNL     1     -10.572   2.386  -0.559  1.00  0.00           C  
HETATM   13  C   UNL     1      -8.031   1.382  -0.110  1.00  0.00           C  
HETATM   14  C   UNL     1      -9.858   1.826  -1.603  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.847   0.401   1.629  1.00  0.00           C  
HETATM   16  O   UNL     1      -2.191  -0.146  -1.232  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.911  -0.604  -0.141  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.858  -0.696   0.814  1.00  0.00           N  
HETATM   19  C   UNL     1      -4.135  -0.178   0.585  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.112   0.902   1.407  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.673   0.839   0.132  1.00  0.00           C  
HETATM   22  C   UNL     1      -8.593   1.319  -1.383  1.00  0.00           C  
HETATM   23  C   UNL     1     -10.017   2.457   0.706  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.539  -1.058   0.137  1.00  0.00           C  
HETATM   25  C   UNL     1       0.489  -0.312   0.646  1.00  0.00           C  
HETATM   26  C   UNL     1       2.243  -3.534   0.293  1.00  0.00           C  
HETATM   27  C   UNL     1       1.054  -5.313  -1.001  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.084  -4.875  -0.083  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.721  -3.595  -0.631  1.00  0.00           C  
HETATM   30  C   UNL     1       0.004  -2.401  -0.070  1.00  0.00           C  
HETATM   31  C   UNL     1       5.089   0.318   0.594  1.00  0.00           C  
HETATM   32  O   UNL     1       5.807  -0.808   1.104  1.00  0.00           O  
HETATM   33  C   UNL     1       7.194   1.522  -0.007  1.00  0.00           C  
HETATM   34  O   UNL     1       8.014   0.455   0.474  1.00  0.00           O  
HETATM   35  C   UNL     1       7.929   2.266  -1.124  1.00  0.00           C  
HETATM   36  C   UNL     1       9.159   2.930  -0.561  1.00  0.00           C  
HETATM   37  O   UNL     1       9.963   3.644  -1.365  1.00  0.00           O  
HETATM   38  O   UNL     1       9.421   2.820   0.613  1.00  0.00           O  
HETATM   39  H   UNL     1       1.888  -3.514  -1.832  1.00  0.00           H  
HETATM   40  H   UNL     1       3.095  -4.708  -1.299  1.00  0.00           H  
HETATM   41  H   UNL     1       1.114   1.342   1.842  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.596   1.385   1.351  1.00  0.00           H  
HETATM   43  H   UNL     1       2.747   0.134   1.977  1.00  0.00           H  
HETATM   44  H   UNL     1       3.396  -1.502   1.713  1.00  0.00           H  
HETATM   45  H   UNL     1       3.862  -0.936  -0.656  1.00  0.00           H  
HETATM   46  H   UNL     1       3.213   0.701  -0.392  1.00  0.00           H  
HETATM   47  H   UNL     1       6.099   0.198  -1.305  1.00  0.00           H  
HETATM   48  H   UNL     1       5.295   1.756  -0.997  1.00  0.00           H  
HETATM   49  H   UNL     1       1.799   1.766  -0.503  1.00  0.00           H  
HETATM   50  H   UNL     1       0.088   1.810  -0.994  1.00  0.00           H  
HETATM   51  H   UNL     1       0.733   3.060   0.096  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.320   2.010   1.925  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.137  -0.693  -1.497  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.387   0.213  -1.903  1.00  0.00           H  
HETATM   55  H   UNL     1     -11.561   2.782  -0.735  1.00  0.00           H  
HETATM   56  H   UNL     1     -10.297   1.773  -2.588  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.413   0.450   2.616  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.652  -1.123   1.661  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.665   1.352   2.219  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.040   0.874  -2.197  1.00  0.00           H  
HETATM   61  H   UNL     1     -10.579   2.895   1.518  1.00  0.00           H  
HETATM   62  H   UNL     1       1.984  -4.231   1.089  1.00  0.00           H  
HETATM   63  H   UNL     1       3.262  -3.177   0.439  1.00  0.00           H  
HETATM   64  H   UNL     1       0.661  -5.482  -2.004  1.00  0.00           H  
HETATM   65  H   UNL     1       1.484  -6.240  -0.623  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.836  -5.663  -0.035  1.00  0.00           H  
HETATM   67  H   UNL     1       0.308  -4.686   0.917  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.647  -3.588  -1.718  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.770  -3.555  -0.336  1.00  0.00           H  
HETATM   70  H   UNL     1       4.949   1.050   1.390  1.00  0.00           H  
HETATM   71  H   UNL     1       5.969  -1.501   0.449  1.00  0.00           H  
HETATM   72  H   UNL     1       6.981   2.212   0.810  1.00  0.00           H  
HETATM   73  H   UNL     1       8.244  -0.199  -0.201  1.00  0.00           H  
HETATM   74  H   UNL     1       8.220   1.559  -1.900  1.00  0.00           H  
HETATM   75  H   UNL     1       7.270   3.023  -1.551  1.00  0.00           H  
HETATM   76  H   UNL     1      10.740   4.052  -0.958  1.00  0.00           H  
CONECT    1   25    3    5                                            
CONECT    2   27   26   39   40                                       
CONECT    3    1   30   30   26                                       
CONECT    4    8   25   41   42                                       
CONECT    5    1    6   43   44                                       
CONECT    6    5   31   45   46                                       
CONECT    7   31   33   47   48                                       
CONECT    8    4   49   50   51                                       
CONECT    9   23   23   13   52                                       
CONECT   10   11   11   19   53                                       
CONECT   11   10   10   21   54                                       
CONECT   12   14   14   23   55                                       
CONECT   13    9   22   22   21                                       
CONECT   14   12   12   22   56                                       
CONECT   15   20   19   19   57                                       
CONECT   16   17   17                                                 
CONECT   17   16   16   18   24                                       
CONECT   18   17   19   58                                            
CONECT   19   10   15   15   18                                       
CONECT   20   15   21   21   59                                       
CONECT   21   11   13   20   20                                       
CONECT   22   13   13   14   60                                       
CONECT   23    9    9   12   61                                       
CONECT   24   17   25   25   30                                       
CONECT   25    1    4   24   24                                       
CONECT   26    2    3   62   63                                       
CONECT   27    2   28   64   65                                       
CONECT   28   27   29   66   67                                       
CONECT   29   28   30   68   69                                       
CONECT   30    3    3   24   29                                       
CONECT   31    6    7   32   70                                       
CONECT   32   31   71                                                 
CONECT   33    7   35   34   72                                       
CONECT   34   33   73                                                 
CONECT   35   33   36   74   75                                       
CONECT   36   35   38   38   37                                       
CONECT   37   36   76                                                 
CONECT   38   36   36                                                 
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    8                                                      
CONECT   51    8                                                      
CONECT   52    9                                                      
CONECT   53   10                                                      
CONECT   54   11                                                      
CONECT   55   12                                                      
CONECT   56   14                                                      
CONECT   57   15                                                      
CONECT   58   18                                                      
CONECT   59   20                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   28                                                      
CONECT   68   29                                                      
CONECT   69   29                                                      
CONECT   70   31                                                      
CONECT   71   32                                                      
CONECT   72   33                                                      
CONECT   73   34                                                      
CONECT   74   35                                                      
CONECT   75   35                                                      
CONECT   76   37                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
