COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.423   0.596  -3.243  1.00  0.00           N  
HETATM    2  C   UNL     1       0.436   0.188  -2.297  1.00  0.00           C  
HETATM    3  O   UNL     1       0.084   0.131  -1.137  1.00  0.00           O  
HETATM    4  C   UNL     1       1.820  -0.239  -2.650  1.00  0.00           C  
HETATM    5  O   UNL     1       2.146  -0.344  -3.811  1.00  0.00           O  
HETATM    6  C   UNL     1       2.825  -0.569  -1.577  1.00  0.00           C  
HETATM    7  C   UNL     1       2.801   0.494  -0.479  1.00  0.00           C  
HETATM    8  O   UNL     1       2.842  -0.151   0.819  1.00  0.00           O  
HETATM    9  C   UNL     1       3.298   0.510   1.894  1.00  0.00           C  
HETATM   10  O   UNL     1       3.576   1.683   1.812  1.00  0.00           O  
HETATM   11  C   UNL     1       3.479  -0.215   3.202  1.00  0.00           C  
HETATM   12  C   UNL     1       2.717   0.516   4.308  1.00  0.00           C  
HETATM   13  C   UNL     1       1.730  -0.446   4.972  1.00  0.00           C  
HETATM   14  C   UNL     1       0.545   0.341   5.534  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.683  -0.567   5.608  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.941   0.243   5.291  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.786  -0.507   4.259  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.898   0.408   3.745  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.541  -0.215   2.505  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.106   0.551   1.255  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.234  -0.350   0.379  1.00  0.00           C  
HETATM   22  O   UNL     1      -2.826   0.372  -0.811  1.00  0.00           O  
HETATM   23  C   UNL     1      -2.217  -0.276  -1.816  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.955  -1.450  -1.697  1.00  0.00           O  
HETATM   25  C   UNL     1      -1.879   0.444  -3.092  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.410  -0.364  -4.282  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.997   0.312  -5.591  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.468   0.370  -5.670  1.00  0.00           C  
HETATM   29  C   UNL     1       0.050   1.209  -4.496  1.00  0.00           C  
HETATM   30  C   UNL     1       4.227  -0.613  -2.199  1.00  0.00           C  
HETATM   31  C   UNL     1       2.505  -1.939  -0.972  1.00  0.00           C  
HETATM   32  H   UNL     1       3.676   1.139  -0.586  1.00  0.00           H  
HETATM   33  H   UNL     1       1.902   1.099  -0.562  1.00  0.00           H  
HETATM   34  H   UNL     1       3.098  -1.232   3.108  1.00  0.00           H  
HETATM   35  H   UNL     1       4.539  -0.249   3.454  1.00  0.00           H  
HETATM   36  H   UNL     1       3.423   0.882   5.055  1.00  0.00           H  
HETATM   37  H   UNL     1       2.173   1.358   3.881  1.00  0.00           H  
HETATM   38  H   UNL     1       1.372  -1.164   4.235  1.00  0.00           H  
HETATM   39  H   UNL     1       2.230  -0.976   5.782  1.00  0.00           H  
HETATM   40  H   UNL     1       0.790   0.702   6.533  1.00  0.00           H  
HETATM   41  H   UNL     1       0.333   1.190   4.884  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.581  -1.376   4.885  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.764  -0.986   6.611  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.522   0.381   6.203  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.658   1.216   4.891  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.153  -0.813   3.426  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.227  -1.389   4.724  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.653   0.531   4.522  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.479   1.381   3.491  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.229  -1.256   2.420  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.627  -0.171   2.599  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.988   0.857   0.693  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.537   1.434   1.545  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.352  -0.658   0.940  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.806  -1.233   0.089  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.343   1.432  -3.090  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.998  -1.372  -4.248  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.498  -0.413  -4.226  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.384  -0.258  -6.435  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.400   1.325  -5.620  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.062  -0.639  -5.605  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.167   0.828  -6.610  1.00  0.00           H  
HETATM   63  H   UNL     1       1.133   1.257  -4.515  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.357   2.221  -4.571  1.00  0.00           H  
HETATM   65  H   UNL     1       4.254  -1.374  -2.978  1.00  0.00           H  
HETATM   66  H   UNL     1       4.462   0.358  -2.631  1.00  0.00           H  
HETATM   67  H   UNL     1       4.959  -0.855  -1.428  1.00  0.00           H  
HETATM   68  H   UNL     1       2.536  -2.697  -1.755  1.00  0.00           H  
HETATM   69  H   UNL     1       3.241  -2.178  -0.205  1.00  0.00           H  
HETATM   70  H   UNL     1       1.510  -1.916  -0.528  1.00  0.00           H  
CONECT    1    2   25   29                                            
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4    7   30   31                                       
CONECT    7    6    8   32   33                                       
CONECT    8    7    9                                                 
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12   34   35                                       
CONECT   12   11   13   36   37                                       
CONECT   13   12   14   38   39                                       
CONECT   14   13   15   40   41                                       
CONECT   15   14   16   42   43                                       
CONECT   16   15   17   44   45                                       
CONECT   17   16   18   46   47                                       
CONECT   18   17   19   48   49                                       
CONECT   19   18   20   50   51                                       
CONECT   20   19   21   52   53                                       
CONECT   21   20   22   54   55                                       
CONECT   22   21   23                                                 
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25    1   23   26   56                                       
CONECT   26   25   27   57   58                                       
CONECT   27   26   28   59   60                                       
CONECT   28   27   29   61   62                                       
CONECT   29    1   28   63   64                                       
CONECT   30    6   65   66   67                                       
CONECT   31    6   68   69   70                                       
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
CONECT   70   31                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
