COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.222   0.065  -0.167  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.192  -0.613   0.580  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.436   0.021   0.809  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.457  -1.905   0.456  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.000  -0.794   0.573  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.947   0.305   0.030  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.874  -0.494  -0.911  1.00  0.00           C  
HETATM    8  C   UNL     1       7.608   1.213   0.652  1.00  0.00           C  
HETATM    9  C   UNL     1       6.841   0.451  -0.248  1.00  0.00           C  
HETATM   10  O   UNL     1      -1.255   2.276   1.385  1.00  0.00           O  
HETATM   11  N   UNL     1      -7.875   3.119  -0.934  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.580  -3.170  -0.146  1.00  0.00           C  
HETATM   13  O   UNL     1      -2.205   1.260  -0.724  1.00  0.00           O  
HETATM   14  N   UNL     1      -8.632   1.255   0.296  1.00  0.00           N  
HETATM   15  C   UNL     1      -7.648   1.865  -0.424  1.00  0.00           C  
HETATM   16  O   UNL     1      -9.310  -0.534   1.454  1.00  0.00           O  
HETATM   17  C   UNL     1       8.737  -0.724  -0.813  1.00  0.00           C  
HETATM   18  C   UNL     1       8.979   0.938   0.769  1.00  0.00           C  
HETATM   19  C   UNL     1       5.474   1.928   0.745  1.00  0.00           C  
HETATM   20  C   UNL     1       2.344  -0.506  -0.050  1.00  0.00           C  
HETATM   21  C   UNL     1       3.836  -0.837  -0.241  1.00  0.00           C  
HETATM   22  C   UNL     1       4.429   0.390  -0.950  1.00  0.00           C  
HETATM   23  C   UNL     1       2.131   0.825  -0.788  1.00  0.00           C  
HETATM   24  C   UNL     1       1.322   1.793   0.079  1.00  0.00           C  
HETATM   25  C   UNL     1       6.685   2.159   1.276  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.926  -1.765  -0.627  1.00  0.00           C  
HETATM   27  N   UNL     1      -6.486   1.289  -0.640  1.00  0.00           N  
HETATM   28  N   UNL     1      -5.140  -0.769  -0.231  1.00  0.00           N  
HETATM   29  N   UNL     1      -6.664  -1.811   0.931  1.00  0.00           N  
HETATM   30  N   UNL     1       9.494  -0.033   0.020  1.00  0.00           N  
HETATM   31  N   UNL     1       7.448  -0.502  -0.954  1.00  0.00           N  
HETATM   32  N   UNL     1       5.555   0.912  -0.172  1.00  0.00           N  
HETATM   33  N   UNL     1       9.776   1.660   1.639  1.00  0.00           N  
HETATM   34  O   UNL     1      -3.223  -1.729  -1.235  1.00  0.00           O  
HETATM   35  O   UNL     1      -0.717  -0.266   0.879  1.00  0.00           O  
HETATM   36  O   UNL     1       0.727  -2.478   1.582  1.00  0.00           O  
HETATM   37  O   UNL     1      -0.236  -3.483  -0.524  1.00  0.00           O  
HETATM   38  O   UNL     1       2.251  -3.927   0.192  1.00  0.00           O  
HETATM   39  O   UNL     1      -1.888   3.854  -0.476  1.00  0.00           O  
HETATM   40  O   UNL     1       3.416   1.388  -1.061  1.00  0.00           O  
HETATM   41  O   UNL     1       3.991  -2.000  -1.056  1.00  0.00           O  
HETATM   42  O   UNL     1       1.527  -1.532  -0.618  1.00  0.00           O  
HETATM   43  O   UNL     1       0.213   2.290  -0.670  1.00  0.00           O  
HETATM   44  P   UNL     1       1.059  -2.844   0.187  1.00  0.00           P  
HETATM   45  P   UNL     1      -1.282   2.412  -0.087  1.00  0.00           P  
HETATM   46  H   UNL     1      -4.804  -2.756   0.584  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.444  -1.285   1.436  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.509   0.764   0.831  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.052   0.077  -1.818  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.726   3.558  -0.779  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.184   3.566  -1.448  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.673  -3.223   0.939  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.260  -3.891  -0.601  1.00  0.00           H  
HETATM   54  H   UNL     1      -9.476   1.710   0.440  1.00  0.00           H  
HETATM   55  H   UNL     1       9.195  -1.505  -1.402  1.00  0.00           H  
HETATM   56  H   UNL     1       4.571   2.464   0.999  1.00  0.00           H  
HETATM   57  H   UNL     1       2.121  -0.391   1.011  1.00  0.00           H  
HETATM   58  H   UNL     1       4.319  -0.985   0.726  1.00  0.00           H  
HETATM   59  H   UNL     1       4.774   0.105  -1.945  1.00  0.00           H  
HETATM   60  H   UNL     1       1.605   0.645  -1.726  1.00  0.00           H  
HETATM   61  H   UNL     1       0.973   1.285   0.974  1.00  0.00           H  
HETATM   62  H   UNL     1       1.962   2.630   0.370  1.00  0.00           H  
HETATM   63  H   UNL     1       6.929   2.900   2.024  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.178  -1.409  -1.334  1.00  0.00           H  
HETATM   65  H   UNL     1       9.388   2.366   2.179  1.00  0.00           H  
HETATM   66  H   UNL     1      10.723   1.460   1.710  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.691   0.258   1.692  1.00  0.00           H  
HETATM   68  H   UNL     1       2.037  -4.745   0.660  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.382   4.600  -0.127  1.00  0.00           H  
HETATM   70  H   UNL     1       4.912  -2.254  -1.209  1.00  0.00           H  
CONECT    1   27    2    2   28                                       
CONECT    2    3    1    1   29                                       
CONECT    3   14   16   16    2                                       
CONECT    4   28   29   29   46                                       
CONECT    5    6   35   26   47                                       
CONECT    6   13    5    7   48                                       
CONECT    7    6   28   34   49                                       
CONECT    8   25    9    9   18                                       
CONECT    9   32    8    8   31                                       
CONECT   10   45   45                                                 
CONECT   11   15   50   51                                            
CONECT   12   37   26   52   53                                       
CONECT   13   45    6                                                 
CONECT   14   15    3   54                                            
CONECT   15   11   14   27   27                                       
CONECT   16    3    3                                                 
CONECT   17   31   31   30   55                                       
CONECT   18    8   33   30   30                                       
CONECT   19   25   25   32   56                                       
CONECT   20   23   21   42   57                                       
CONECT   21   22   20   41   58                                       
CONECT   22   40   32   21   59                                       
CONECT   23   40   24   20   60                                       
CONECT   24   43   23   61   62                                       
CONECT   25   19   19    8   63                                       
CONECT   26    5   34   12   64                                       
CONECT   27   15   15    1                                            
CONECT   28    1    7    4                                            
CONECT   29    2    4    4                                            
CONECT   30   18   18   17                                            
CONECT   31    9   17   17                                            
CONECT   32   19   22    9                                            
CONECT   33   18   65   66                                            
CONECT   34    7   26                                                 
CONECT   35    5   67                                                 
CONECT   36   44   44                                                 
CONECT   37   44   12                                                 
CONECT   38   44   68                                                 
CONECT   39   45   69                                                 
CONECT   40   22   23                                                 
CONECT   41   21   70                                                 
CONECT   42   20   44                                                 
CONECT   43   45   24                                                 
CONECT   44   42   37   36   36                                       
CONECT   44   38                                                      
CONECT   45   39   10   10   43                                       
CONECT   45   13                                                      
CONECT   46    4                                                      
CONECT   47    5                                                      
CONECT   48    6                                                      
CONECT   49    7                                                      
CONECT   50   11                                                      
CONECT   51   11                                                      
CONECT   52   12                                                      
CONECT   53   12                                                      
CONECT   54   14                                                      
CONECT   55   17                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   24                                                      
CONECT   63   25                                                      
CONECT   64   26                                                      
CONECT   65   33                                                      
CONECT   66   33                                                      
CONECT   67   35                                                      
CONECT   68   38                                                      
CONECT   69   39                                                      
CONECT   70   41                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
