COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -7.886   0.425   0.652  1.00  0.00           O  
HETATM    2  C   UNL     1      -6.797   0.692   0.177  1.00  0.00           C  
HETATM    3  N   UNL     1      -6.011   1.621   0.757  1.00  0.00           N  
HETATM    4  C   UNL     1      -4.808   1.916   0.231  1.00  0.00           C  
HETATM    5  O   UNL     1      -4.109   2.756   0.766  1.00  0.00           O  
HETATM    6  C   UNL     1      -6.343   0.027  -0.987  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.132   0.343  -1.494  1.00  0.00           C  
HETATM    8  N   UNL     1      -4.367   1.295  -0.878  1.00  0.00           N  
HETATM    9  C   UNL     1      -3.053   1.638  -1.428  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.970   0.844  -0.693  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.155  -0.627  -0.964  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.923  -1.526   0.012  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.997  -2.960  -0.280  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.819  -3.754   1.016  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.901  -3.466   1.904  1.00  0.00           O  
HETATM   16  O   UNL     1      -2.512  -1.001  -2.061  1.00  0.00           O  
HETATM   17  C   UNL     1      -0.591   1.285  -1.188  1.00  0.00           C  
HETATM   18  C   UNL     1       0.493   0.577  -0.373  1.00  0.00           C  
HETATM   19  O   UNL     1       1.777   1.080  -0.749  1.00  0.00           O  
HETATM   20  C   UNL     1       2.871   0.410  -0.120  1.00  0.00           C  
HETATM   21  C   UNL     1       2.841   0.682   1.362  1.00  0.00           C  
HETATM   22  C   UNL     1       2.166   1.785   1.849  1.00  0.00           C  
HETATM   23  C   UNL     1       2.139   2.035   3.208  1.00  0.00           C  
HETATM   24  C   UNL     1       2.787   1.181   4.080  1.00  0.00           C  
HETATM   25  C   UNL     1       3.461   0.076   3.594  1.00  0.00           C  
HETATM   26  C   UNL     1       3.485  -0.176   2.235  1.00  0.00           C  
HETATM   27  C   UNL     1       2.757  -1.074  -0.361  1.00  0.00           C  
HETATM   28  C   UNL     1       1.975  -1.851   0.473  1.00  0.00           C  
HETATM   29  C   UNL     1       1.871  -3.212   0.252  1.00  0.00           C  
HETATM   30  C   UNL     1       2.547  -3.795  -0.803  1.00  0.00           C  
HETATM   31  C   UNL     1       3.328  -3.017  -1.638  1.00  0.00           C  
HETATM   32  C   UNL     1       3.429  -1.656  -1.419  1.00  0.00           C  
HETATM   33  C   UNL     1       4.168   0.914  -0.698  1.00  0.00           C  
HETATM   34  C   UNL     1       4.174   1.573  -1.913  1.00  0.00           C  
HETATM   35  C   UNL     1       5.364   2.035  -2.443  1.00  0.00           C  
HETATM   36  C   UNL     1       6.548   1.840  -1.758  1.00  0.00           C  
HETATM   37  C   UNL     1       6.542   1.182  -0.542  1.00  0.00           C  
HETATM   38  C   UNL     1       5.352   0.723  -0.010  1.00  0.00           C  
HETATM   39  H   UNL     1      -6.314   2.079   1.557  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.957  -0.723  -1.464  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.769  -0.154  -2.382  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.027   1.391  -2.489  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.872   2.705  -1.298  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.048   1.029   0.378  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.482   1.024  -2.241  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.490   2.363  -1.068  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.708  -1.224   0.909  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.968  -3.192  -0.718  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.208  -3.229  -0.982  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.808  -4.820   0.790  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.877  -3.473   1.488  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.853  -3.936   2.747  1.00  0.00           H  
HETATM   53  H   UNL     1       0.328   0.761   0.688  1.00  0.00           H  
HETATM   54  H   UNL     1       0.452  -0.495  -0.567  1.00  0.00           H  
HETATM   55  H   UNL     1       1.660   2.453   1.167  1.00  0.00           H  
HETATM   56  H   UNL     1       4.009  -1.040   1.855  1.00  0.00           H  
HETATM   57  H   UNL     1       1.612   2.897   3.588  1.00  0.00           H  
HETATM   58  H   UNL     1       2.766   1.376   5.142  1.00  0.00           H  
HETATM   59  H   UNL     1       3.968  -0.591   4.275  1.00  0.00           H  
HETATM   60  H   UNL     1       1.447  -1.396   1.298  1.00  0.00           H  
HETATM   61  H   UNL     1       4.036  -1.048  -2.074  1.00  0.00           H  
HETATM   62  H   UNL     1       1.261  -3.820   0.904  1.00  0.00           H  
HETATM   63  H   UNL     1       2.466  -4.858  -0.975  1.00  0.00           H  
HETATM   64  H   UNL     1       3.857  -3.473  -2.462  1.00  0.00           H  
HETATM   65  H   UNL     1       3.248   1.725  -2.449  1.00  0.00           H  
HETATM   66  H   UNL     1       5.347   0.212   0.942  1.00  0.00           H  
HETATM   67  H   UNL     1       5.368   2.549  -3.393  1.00  0.00           H  
HETATM   68  H   UNL     1       7.477   2.201  -2.172  1.00  0.00           H  
HETATM   69  H   UNL     1       7.467   1.029  -0.006  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    6                                       
CONECT    3    2    4   39                                            
CONECT    4    3    5    5    8                                       
CONECT    5    4    4                                                 
CONECT    6    2    7    7   40                                       
CONECT    7    6    6    8   41                                       
CONECT    8    4    7    9                                            
CONECT    9    8   10   42   43                                       
CONECT   10    9   11   17   44                                       
CONECT   11   10   12   16   16                                       
CONECT   12   11   13   47                                            
CONECT   13   12   14   48   49                                       
CONECT   14   13   15   50   51                                       
CONECT   15   14   52                                                 
CONECT   16   11   11                                                 
CONECT   17   10   18   45   46                                       
CONECT   18   17   19   53   54                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   27   33                                       
CONECT   21   20   22   26   26                                       
CONECT   22   21   23   23   55                                       
CONECT   23   22   22   24   57                                       
CONECT   24   23   25   25   58                                       
CONECT   25   24   24   26   59                                       
CONECT   26   21   21   25   56                                       
CONECT   27   20   28   32   32                                       
CONECT   28   27   29   29   60                                       
CONECT   29   28   28   30   62                                       
CONECT   30   29   31   31   63                                       
CONECT   31   30   30   32   64                                       
CONECT   32   27   27   31   61                                       
CONECT   33   20   34   38   38                                       
CONECT   34   33   35   35   65                                       
CONECT   35   34   34   36   67                                       
CONECT   36   35   37   37   68                                       
CONECT   37   36   36   38   69                                       
CONECT   38   33   33   37   66                                       
CONECT   39    3                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   22                                                      
CONECT   56   26                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   28                                                      
CONECT   61   32                                                      
CONECT   62   29                                                      
CONECT   63   30                                                      
CONECT   64   31                                                      
CONECT   65   34                                                      
CONECT   66   38                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   37                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
