COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.204   0.437  -0.247  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.717   2.696   0.525  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.134   3.519   1.741  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.646   4.959   1.541  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.123   4.972   1.652  1.00  0.00           C  
HETATM    6  C   UNL     1       0.451   3.105  -0.373  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.292   2.042  -0.885  1.00  0.00           C  
HETATM    8  C   UNL     1       1.891   3.236  -0.700  1.00  0.00           C  
HETATM    9  C   UNL     1       2.416   4.443  -1.169  1.00  0.00           C  
HETATM   10  C   UNL     1       3.764   4.525  -1.463  1.00  0.00           C  
HETATM   11  C   UNL     1       4.126   2.321  -0.858  1.00  0.00           C  
HETATM   12  C   UNL     1       3.858   0.274  -0.162  1.00  0.00           C  
HETATM   13  N   UNL     1       2.621   0.856  -0.105  1.00  0.00           N  
HETATM   14  C   UNL     1       2.766   2.157  -0.543  1.00  0.00           C  
HETATM   15  C   UNL     1       4.157  -1.124   0.210  1.00  0.00           C  
HETATM   16  C   UNL     1       5.911  -5.216  -0.229  1.00  0.00           C  
HETATM   17  C   UNL     1       5.387  -1.743   0.139  1.00  0.00           C  
HETATM   18  C   UNL     1       6.674  -1.117  -0.332  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.481  -0.996   0.014  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.908  -3.060  -0.193  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.213  -4.418  -0.772  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.362  -5.434   0.361  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.516  -4.350  -1.571  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.071  -4.847  -1.695  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.712  -1.929  -0.887  1.00  0.00           N  
HETATM   26  N   UNL     1      -4.786  -2.774   1.070  1.00  0.00           N  
HETATM   27  O   UNL     1      -4.539  -1.595   1.214  1.00  0.00           O  
HETATM   28  O   UNL     1      -4.174   0.851  -1.388  1.00  0.00           O  
HETATM   29  N   UNL     1      -3.990   1.280   0.783  1.00  0.00           N  
HETATM   30  C   UNL     1      -1.517   3.925   0.754  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.170   4.042   0.447  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.247   2.875   0.243  1.00  0.00           C  
HETATM   33  C   UNL     1      -1.629   1.934  -0.574  1.00  0.00           C  
HETATM   34  N   UNL     1       4.567   3.493  -1.312  1.00  0.00           N  
HETATM   35  N   UNL     1       4.733   1.139  -0.619  1.00  0.00           N  
HETATM   36  C   UNL     1       3.239  -2.073   0.709  1.00  0.00           C  
HETATM   37  N   UNL     1       3.883  -3.189   0.917  1.00  0.00           N  
HETATM   38  N   UNL     1       5.226  -3.008   0.569  1.00  0.00           N  
HETATM   39  C   UNL     1       6.279  -4.023   0.656  1.00  0.00           C  
HETATM   40  C   UNL     1       6.420  -4.489   2.106  1.00  0.00           C  
HETATM   41  H   UNL     1      -4.291   3.021  -0.343  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.219   3.509   1.837  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.682   3.100   2.641  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.945   5.314   0.554  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.076   5.603   2.308  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.750   5.954   1.361  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.836   4.770   2.684  1.00  0.00           H  
HETATM   48  H   UNL     1       0.178   1.308  -1.521  1.00  0.00           H  
HETATM   49  H   UNL     1       1.775   5.302  -1.300  1.00  0.00           H  
HETATM   50  H   UNL     1       4.168   5.459  -1.826  1.00  0.00           H  
HETATM   51  H   UNL     1       1.800   0.437   0.196  1.00  0.00           H  
HETATM   52  H   UNL     1       4.966  -5.642   0.109  1.00  0.00           H  
HETATM   53  H   UNL     1       5.811  -4.885  -1.263  1.00  0.00           H  
HETATM   54  H   UNL     1       6.694  -5.972  -0.164  1.00  0.00           H  
HETATM   55  H   UNL     1       7.191  -0.666   0.515  1.00  0.00           H  
HETATM   56  H   UNL     1       7.309  -1.884  -0.778  1.00  0.00           H  
HETATM   57  H   UNL     1       6.455  -0.350  -1.074  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.176  -5.128   1.019  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.583  -6.416  -0.057  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.434  -5.482   0.930  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.410  -3.626  -2.379  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.737  -5.332  -1.990  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.330  -4.044  -0.914  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.142  -4.895  -1.126  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.292  -5.829  -2.114  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.965  -4.123  -2.503  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.018   0.950   1.694  1.00  0.00           H  
HETATM   68  H   UNL     1       0.402   4.867   0.847  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.205   1.111  -0.971  1.00  0.00           H  
HETATM   70  H   UNL     1       2.188  -1.904   0.888  1.00  0.00           H  
HETATM   71  H   UNL     1       7.223  -3.598   0.317  1.00  0.00           H  
HETATM   72  H   UNL     1       7.203  -5.244   2.171  1.00  0.00           H  
HETATM   73  H   UNL     1       6.682  -3.639   2.737  1.00  0.00           H  
HETATM   74  H   UNL     1       5.475  -4.915   2.445  1.00  0.00           H  
CONECT    1   29   28   28   19                                       
CONECT    2   32    3   29   41                                       
CONECT    3    4    2   42   43                                       
CONECT    4    5    3   44   45                                       
CONECT    5   30    4   46   47                                       
CONECT    6    8   31   31    7                                       
CONECT    7    6   33   33   48                                       
CONECT    8   14   14    9    6                                       
CONECT    9   10   10    8   49                                       
CONECT   10   34    9    9   50                                       
CONECT   11   35   34   34   14                                       
CONECT   12   15   35   35   13                                       
CONECT   13   12   14   51                                            
CONECT   14   13   11    8    8                                       
CONECT   15   36   17   17   12                                       
CONECT   16   39   52   53   54                                       
CONECT   17   38   15   15   18                                       
CONECT   18   17   55   56   57                                       
CONECT   19    1   25   25   27                                       
CONECT   20   25   26   26   21                                       
CONECT   21   23   20   22   24                                       
CONECT   22   21   58   59   60                                       
CONECT   23   21   61   62   63                                       
CONECT   24   21   64   65   66                                       
CONECT   25   19   19   20                                            
CONECT   26   27   20   20                                            
CONECT   27   19   26                                                 
CONECT   28    1    1                                                 
CONECT   29    2    1   67                                            
CONECT   30   31    5   32   32                                       
CONECT   31    6    6   30   68                                       
CONECT   32   30   30   33    2                                       
CONECT   33    7    7   32   69                                       
CONECT   34   11   11   10                                            
CONECT   35   12   12   11                                            
CONECT   36   37   37   15   70                                       
CONECT   37   38   36   36                                            
CONECT   38   39   37   17                                            
CONECT   39   16   40   38   71                                       
CONECT   40   39   72   73   74                                       
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    5                                                      
CONECT   48    7                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   13                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   24                                                      
CONECT   66   24                                                      
CONECT   67   29                                                      
CONECT   68   31                                                      
CONECT   69   33                                                      
CONECT   70   36                                                      
CONECT   71   39                                                      
CONECT   72   40                                                      
CONECT   73   40                                                      
CONECT   74   40                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
