COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.551   1.855   0.304  1.00  0.00           C  
HETATM    2  C   UNL     1       4.272   2.125  -0.187  1.00  0.00           C  
HETATM    3  C   UNL     1       3.853   1.641  -1.551  1.00  0.00           C  
HETATM    4  C   UNL     1       3.351   0.224  -1.449  1.00  0.00           C  
HETATM    5  C   UNL     1       4.235  -0.832  -1.594  1.00  0.00           C  
HETATM    6  C   UNL     1       3.787  -2.140  -1.497  1.00  0.00           C  
HETATM    7  C   UNL     1       6.028  -2.833  -1.889  1.00  0.00           C  
HETATM    8  C   UNL     1       2.442  -2.398  -1.253  1.00  0.00           C  
HETATM    9  C   UNL     1       2.012  -4.274   0.141  1.00  0.00           C  
HETATM   10  C   UNL     1       1.546  -1.329  -1.106  1.00  0.00           C  
HETATM   11  C   UNL     1       0.123  -1.588  -0.848  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.736  -0.556  -0.707  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.152  -0.814  -0.450  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.158   2.153  -1.591  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.438  -0.012  -0.051  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.751   0.294   1.415  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.037  -0.697   2.298  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.247   0.899  -0.942  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.644   1.914  -1.656  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.416   2.740  -2.457  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.781   2.547  -2.547  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.382   1.526  -1.836  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.614   0.703  -1.034  1.00  0.00           C  
HETATM   24  C   UNL     1       2.016  -0.014  -1.207  1.00  0.00           C  
HETATM   25  C   UNL     1       3.400   2.845   0.606  1.00  0.00           C  
HETATM   26  C   UNL     1       5.018   2.985   2.242  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.762  -0.422   2.754  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.660  -1.877   2.657  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.107  -1.330   3.565  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.005  -2.786   3.468  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.727  -2.514   3.919  1.00  0.00           C  
HETATM   32  N   UNL     1       6.461   1.142  -0.458  1.00  0.00           N  
HETATM   33  N   UNL     1      -3.010   0.216  -0.310  1.00  0.00           N  
HETATM   34  N   UNL     1      -2.581   1.516  -0.403  1.00  0.00           N  
HETATM   35  N   UNL     1       3.799   3.256   1.801  1.00  0.00           N  
HETATM   36  N   UNL     1       5.397   3.432   3.496  1.00  0.00           N  
HETATM   37  N   UNL     1       5.885   2.298   1.512  1.00  0.00           N  
HETATM   38  O   UNL     1       4.662  -3.171  -1.640  1.00  0.00           O  
HETATM   39  O   UNL     1       1.999  -3.678  -1.158  1.00  0.00           O  
HETATM   40  O   UNL     1      -2.557  -1.959  -0.363  1.00  0.00           O  
HETATM   41  H   UNL     1       3.059   2.281  -1.936  1.00  0.00           H  
HETATM   42  H   UNL     1       4.707   1.676  -2.228  1.00  0.00           H  
HETATM   43  H   UNL     1       5.280  -0.636  -1.784  1.00  0.00           H  
HETATM   44  H   UNL     1       6.617  -3.745  -1.982  1.00  0.00           H  
HETATM   45  H   UNL     1       6.097  -2.259  -2.813  1.00  0.00           H  
HETATM   46  H   UNL     1       6.411  -2.236  -1.061  1.00  0.00           H  
HETATM   47  H   UNL     1       1.634  -5.294   0.076  1.00  0.00           H  
HETATM   48  H   UNL     1       3.032  -4.288   0.524  1.00  0.00           H  
HETATM   49  H   UNL     1       1.379  -3.694   0.813  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.236  -2.603  -0.770  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.377   0.460  -0.785  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.689   1.739  -2.484  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.686  -1.051  -0.269  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.416   1.303   1.655  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.826   0.219   1.580  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.949   3.538  -3.014  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.378   3.194  -3.172  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.448   1.372  -1.906  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.082  -0.095  -0.477  1.00  0.00           H  
HETATM   60  H   UNL     1       1.332   0.814  -1.091  1.00  0.00           H  
HETATM   61  H   UNL     1       2.404   3.071   0.255  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.277   0.502   2.477  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.659  -2.090   2.305  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.110  -1.116   3.921  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.492  -3.708   3.748  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.216  -3.223   4.552  1.00  0.00           H  
HETATM   67  H   UNL     1       7.349   0.962  -0.112  1.00  0.00           H  
HETATM   68  H   UNL     1       6.210   0.822  -1.339  1.00  0.00           H  
HETATM   69  H   UNL     1       6.287   3.240   3.831  1.00  0.00           H  
HETATM   70  H   UNL     1       4.772   3.936   4.040  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.969   3.226  -1.551  1.00  0.00           H  
HETATM   72  H   UNL     1      -2.811   2.034   0.432  1.00  0.00           H  
CONECT    1    2    2   37   32                                       
CONECT    2   25    3    1    1                                       
CONECT    3    4    2   41   42                                       
CONECT    4    5    5   24    3                                       
CONECT    5    6    4    4   43                                       
CONECT    6   38    8    8    5                                       
CONECT    7   38   44   45   46                                       
CONECT    8   39    6    6   10                                       
CONECT    9   39   47   48   49                                       
CONECT   10    8   11   24   24                                       
CONECT   11   10   12   12   50                                       
CONECT   12   11   11   13   51                                       
CONECT   13   40   40   12   33                                       
CONECT   14   34   19   52   71                                       
CONECT   15   16   33   18   53                                       
CONECT   16   17   15   54   55                                       
CONECT   17   28   16   27   27                                       
CONECT   18   15   23   23   19                                       
CONECT   19   18   14   20   20                                       
CONECT   20   19   19   21   56                                       
CONECT   21   22   22   20   57                                       
CONECT   22   23   21   21   58                                       
CONECT   23   18   18   22   59                                       
CONECT   24   10   10    4   60                                       
CONECT   25   35   35    2   61                                       
CONECT   26   35   36   37   37                                       
CONECT   27   17   17   29   62                                       
CONECT   28   30   30   17   63                                       
CONECT   29   31   31   27   64                                       
CONECT   30   28   28   31   65                                       
CONECT   31   30   29   29   66                                       
CONECT   32    1   67   68                                            
CONECT   33   13   15   34                                            
CONECT   34   33   14   72                                            
CONECT   35   25   25   26                                            
CONECT   36   26   69   70                                            
CONECT   37   26   26    1                                            
CONECT   38    7    6                                                 
CONECT   39    9    8                                                 
CONECT   40   13   13                                                 
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    5                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49    9                                                      
CONECT   50   11                                                      
CONECT   51   12                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   16                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   32                                                      
CONECT   69   36                                                      
CONECT   70   36                                                      
CONECT   71   14                                                      
CONECT   72   34                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
