COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.696  -3.453   1.905  1.00  0.00           C  
HETATM    2  O   UNL     1      -0.522  -2.748   0.674  1.00  0.00           O  
HETATM    3  C   UNL     1       0.754  -2.542   0.256  1.00  0.00           C  
HETATM    4  C   UNL     1       1.818  -3.023   1.025  1.00  0.00           C  
HETATM    5  C   UNL     1       3.106  -2.833   0.633  1.00  0.00           C  
HETATM    6  C   UNL     1       3.377  -2.145  -0.563  1.00  0.00           C  
HETATM    7  C   UNL     1       4.695  -1.932  -0.998  1.00  0.00           C  
HETATM    8  C   UNL     1       4.921  -1.262  -2.161  1.00  0.00           C  
HETATM    9  C   UNL     1       3.862  -0.782  -2.930  1.00  0.00           C  
HETATM   10  C   UNL     1       2.572  -0.970  -2.540  1.00  0.00           C  
HETATM   11  C   UNL     1       2.300  -1.657  -1.345  1.00  0.00           C  
HETATM   12  C   UNL     1       0.981  -1.874  -0.914  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.178  -1.368  -1.734  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.771  -0.203  -1.073  1.00  0.00           N  
HETATM   15  C   UNL     1      -1.870  -0.355  -0.303  1.00  0.00           C  
HETATM   16  O   UNL     1      -2.309  -1.466  -0.093  1.00  0.00           O  
HETATM   17  C   UNL     1      -2.552   0.845   0.298  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.743   1.372   1.484  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.891   0.465   0.755  1.00  0.00           N  
HETATM   20  C   UNL     1      -4.922   0.457  -0.113  1.00  0.00           C  
HETATM   21  O   UNL     1      -4.742   0.765  -1.272  1.00  0.00           O  
HETATM   22  C   UNL     1      -6.300   0.065   0.357  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.265  -1.364   0.903  1.00  0.00           C  
HETATM   24  N   UNL     1      -7.240   0.137  -0.769  1.00  0.00           N  
HETATM   25  C   UNL     1      -8.614   0.352  -0.296  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.193   1.061  -1.241  1.00  0.00           C  
HETATM   27  C   UNL     1       0.133   1.531  -2.502  1.00  0.00           C  
HETATM   28  C   UNL     1       0.729   2.772  -2.640  1.00  0.00           C  
HETATM   29  C   UNL     1       1.000   3.543  -1.525  1.00  0.00           C  
HETATM   30  C   UNL     1       0.671   3.084  -0.263  1.00  0.00           C  
HETATM   31  C   UNL     1       0.066   1.847  -0.116  1.00  0.00           C  
HETATM   32  N   UNL     1      -0.319   1.393   1.144  1.00  0.00           N  
HETATM   33  C   UNL     1       0.606   0.981   2.034  1.00  0.00           C  
HETATM   34  O   UNL     1       0.257   0.468   3.079  1.00  0.00           O  
HETATM   35  C   UNL     1       2.041   1.152   1.739  1.00  0.00           C  
HETATM   36  C   UNL     1       2.471   1.307   0.418  1.00  0.00           C  
HETATM   37  C   UNL     1       3.810   1.467   0.146  1.00  0.00           C  
HETATM   38  C   UNL     1       4.737   1.474   1.186  1.00  0.00           C  
HETATM   39  N   UNL     1       6.090   1.635   0.908  1.00  0.00           N  
HETATM   40  C   UNL     1       4.312   1.321   2.502  1.00  0.00           C  
HETATM   41  C   UNL     1       2.973   1.166   2.781  1.00  0.00           C  
HETATM   42  H   UNL     1      -0.252  -4.445   1.821  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.209  -2.903   2.710  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.760  -3.548   2.122  1.00  0.00           H  
HETATM   45  H   UNL     1       1.614  -3.552   1.944  1.00  0.00           H  
HETATM   46  H   UNL     1       3.918  -3.209   1.238  1.00  0.00           H  
HETATM   47  H   UNL     1       5.526  -2.297  -0.413  1.00  0.00           H  
HETATM   48  H   UNL     1       5.936  -1.099  -2.493  1.00  0.00           H  
HETATM   49  H   UNL     1       4.069  -0.253  -3.849  1.00  0.00           H  
HETATM   50  H   UNL     1       1.761  -0.592  -3.146  1.00  0.00           H  
HETATM   51  H   UNL     1       0.176  -1.083  -2.725  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.928  -2.154  -1.827  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.639   1.627  -0.456  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.072   2.382   1.728  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.899   0.723   2.346  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.036   0.218   1.682  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.623   0.747   1.144  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.942  -2.046   0.116  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.568  -1.416   1.739  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.261  -1.647   1.243  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.181  -0.692  -1.343  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.664   1.288   0.261  1.00  0.00           H  
HETATM   63  H   UNL     1      -9.289   0.401  -1.150  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.908  -0.473   0.353  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.078   0.931  -3.374  1.00  0.00           H  
HETATM   66  H   UNL     1       0.983   3.140  -3.624  1.00  0.00           H  
HETATM   67  H   UNL     1       1.472   4.508  -1.641  1.00  0.00           H  
HETATM   68  H   UNL     1       0.886   3.688   0.606  1.00  0.00           H  
HETATM   69  H   UNL     1       1.753   1.300  -0.389  1.00  0.00           H  
HETATM   70  H   UNL     1       4.143   1.586  -0.874  1.00  0.00           H  
HETATM   71  H   UNL     1       6.387   1.743  -0.009  1.00  0.00           H  
HETATM   72  H   UNL     1       6.736   1.641   1.631  1.00  0.00           H  
HETATM   73  H   UNL     1       5.033   1.327   3.306  1.00  0.00           H  
HETATM   74  H   UNL     1       2.643   1.050   3.803  1.00  0.00           H  
CONECT    1    2   42   43   44                                       
CONECT    2    1    3                                                 
CONECT    3    2   12   12    4                                       
CONECT    4    3    5    5   45                                       
CONECT    5    4    4    6   46                                       
CONECT    6   11    5    7    7                                       
CONECT    7    6    6    8   47                                       
CONECT    8    9    9    7   48                                       
CONECT    9   10    8    8   49                                       
CONECT   10   11   11    9   50                                       
CONECT   11   12   10   10    6                                       
CONECT   12   13    3    3   11                                       
CONECT   13   14   12   51   52                                       
CONECT   14   26   15   13                                            
CONECT   15   17   14   16   16                                       
CONECT   16   15   15                                                 
CONECT   17   19   18   15   53                                       
CONECT   18   17   32   54   55                                       
CONECT   19   20   17   56                                            
CONECT   20   21   21   22   19                                       
CONECT   21   20   20                                                 
CONECT   22   24   20   23   57                                       
CONECT   23   22   58   59   60                                       
CONECT   24   25   22   61                                            
CONECT   25   24   62   63   64                                       
CONECT   26   27   27   31   14                                       
CONECT   27   28   26   26   65                                       
CONECT   28   29   29   27   66                                       
CONECT   29   28   28   30   67                                       
CONECT   30   29   31   31   68                                       
CONECT   31   30   30   26   32                                       
CONECT   32   18   31   33                                            
CONECT   33   32   34   34   35                                       
CONECT   34   33   33                                                 
CONECT   35   33   36   36   41                                       
CONECT   36   35   35   37   69                                       
CONECT   37   36   38   38   70                                       
CONECT   38   37   37   40   39                                       
CONECT   39   38   71   72                                            
CONECT   40   41   41   38   73                                       
CONECT   41   35   40   40   74                                       
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    1                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   25                                                      
CONECT   64   25                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   36                                                      
CONECT   70   37                                                      
CONECT   71   39                                                      
CONECT   72   39                                                      
CONECT   73   40                                                      
CONECT   74   41                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
