COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.658   4.160  -1.473  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.593   1.886  -1.630  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.480   2.719  -1.073  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.951  -1.743   0.201  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.432  -0.401   0.595  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.563   0.750   0.243  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.728  -2.079  -0.006  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.305   2.023  -0.082  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.624   0.555  -0.936  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.777  -0.634  -1.823  1.00  0.00           O  
HETATM   11  C   UNL     1      -0.229   0.786   0.024  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.307  -0.083  -0.604  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.539  -1.259   0.352  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.280  -2.111   0.432  1.00  0.00           C  
HETATM   15  C   UNL     1       1.069  -1.411   0.284  1.00  0.00           C  
HETATM   16  C   UNL     1       1.124   0.067  -0.016  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.028   2.124  -0.694  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.999  -2.804  -0.034  1.00  0.00           C  
HETATM   19  C   UNL     1       0.651  -1.965   1.635  1.00  0.00           C  
HETATM   20  C   UNL     1       0.311  -0.988   2.756  1.00  0.00           C  
HETATM   21  C   UNL     1       1.377  -3.238   2.109  1.00  0.00           C  
HETATM   22  C   UNL     1       3.300  -1.637  -0.539  1.00  0.00           C  
HETATM   23  C   UNL     1       4.402  -2.385  -1.245  1.00  0.00           C  
HETATM   24  C   UNL     1       5.673  -1.534  -1.254  1.00  0.00           C  
HETATM   25  C   UNL     1       6.791  -2.294  -1.971  1.00  0.00           C  
HETATM   26  C   UNL     1       2.778   1.729   0.417  1.00  0.00           C  
HETATM   27  C   UNL     1       3.745   2.458   1.314  1.00  0.00           C  
HETATM   28  C   UNL     1       4.460   3.548   0.514  1.00  0.00           C  
HETATM   29  C   UNL     1       5.441   4.288   1.425  1.00  0.00           C  
HETATM   30  O   UNL     1      -2.765   1.051   1.405  1.00  0.00           O  
HETATM   31  O   UNL     1      -5.365   2.395   0.382  1.00  0.00           O  
HETATM   32  O   UNL     1      -4.362  -4.028  -0.404  1.00  0.00           O  
HETATM   33  O   UNL     1       2.086  -2.193  -0.411  1.00  0.00           O  
HETATM   34  O   UNL     1       3.511  -0.535  -0.089  1.00  0.00           O  
HETATM   35  O   UNL     1       2.034   0.724   0.907  1.00  0.00           O  
HETATM   36  O   UNL     1       2.672   2.049  -0.743  1.00  0.00           O  
HETATM   37  H   UNL     1      -4.403   4.228  -2.267  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.993   4.737  -0.611  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.709   4.559  -1.830  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.973   2.139  -2.480  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.412  -0.245   0.136  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.579  -0.400   1.678  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.544  -3.069  -0.402  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.138  -0.140  -1.633  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.513   0.031  -2.473  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.486   0.995   1.068  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.737  -0.841   1.334  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.369  -3.105  -0.019  1.00  0.00           H  
HETATM   49  H   UNL     1       1.536   0.197  -1.029  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.958   2.691  -0.674  1.00  0.00           H  
HETATM   51  H   UNL     1       0.756   2.691  -0.192  1.00  0.00           H  
HETATM   52  H   UNL     1       0.264   1.940  -1.728  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.574  -2.955   0.880  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.666  -2.485  -0.834  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.522  -0.356   2.447  1.00  0.00           H  
HETATM   56  H   UNL     1       0.033  -1.544   3.652  1.00  0.00           H  
HETATM   57  H   UNL     1       1.179  -0.364   2.970  1.00  0.00           H  
HETATM   58  H   UNL     1       2.446  -3.039   2.185  1.00  0.00           H  
HETATM   59  H   UNL     1       0.991  -3.535   3.084  1.00  0.00           H  
HETATM   60  H   UNL     1       1.207  -4.041   1.391  1.00  0.00           H  
HETATM   61  H   UNL     1       4.596  -3.322  -0.725  1.00  0.00           H  
HETATM   62  H   UNL     1       4.098  -2.595  -2.271  1.00  0.00           H  
HETATM   63  H   UNL     1       5.479  -0.596  -1.775  1.00  0.00           H  
HETATM   64  H   UNL     1       5.976  -1.324  -0.228  1.00  0.00           H  
HETATM   65  H   UNL     1       6.985  -3.231  -1.450  1.00  0.00           H  
HETATM   66  H   UNL     1       6.488  -2.504  -2.996  1.00  0.00           H  
HETATM   67  H   UNL     1       7.696  -1.687  -1.977  1.00  0.00           H  
HETATM   68  H   UNL     1       3.200   2.913   2.142  1.00  0.00           H  
HETATM   69  H   UNL     1       4.479   1.754   1.706  1.00  0.00           H  
HETATM   70  H   UNL     1       5.005   3.094  -0.313  1.00  0.00           H  
HETATM   71  H   UNL     1       3.726   4.253   0.123  1.00  0.00           H  
HETATM   72  H   UNL     1       4.897   4.743   2.253  1.00  0.00           H  
HETATM   73  H   UNL     1       6.175   3.584   1.817  1.00  0.00           H  
HETATM   74  H   UNL     1       5.951   5.065   0.855  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.282   1.275   2.190  1.00  0.00           H  
HETATM   76  H   UNL     1      -4.976  -4.756  -0.570  1.00  0.00           H  
CONECT    1    3   37   38   39                                       
CONECT    2    3    3    9   40                                       
CONECT    3    1    2    2    8                                       
CONECT    4    7    7    5   18                                       
CONECT    5    6    4   41   42                                       
CONECT    6    9    8   30    5                                       
CONECT    7   13    4    4   43                                       
CONECT    8    3    6   31   31                                       
CONECT    9    2   12    6   44                                       
CONECT   10   12   45                                                 
CONECT   11   17   16   12   46                                       
CONECT   12   11   10    9   13                                       
CONECT   13   12   14    7   47                                       
CONECT   14   15   19   13   48                                       
CONECT   15   16   33   19   14                                       
CONECT   16   35   11   15   49                                       
CONECT   17   11   50   51   52                                       
CONECT   18    4   32   53   54                                       
CONECT   19   15   20   14   21                                       
CONECT   20   19   55   56   57                                       
CONECT   21   19   58   59   60                                       
CONECT   22   23   34   34   33                                       
CONECT   23   24   22   61   62                                       
CONECT   24   25   23   63   64                                       
CONECT   25   24   65   66   67                                       
CONECT   26   27   36   36   35                                       
CONECT   27   26   28   68   69                                       
CONECT   28   27   29   70   71                                       
CONECT   29   28   72   73   74                                       
CONECT   30    6   75                                                 
CONECT   31    8    8                                                 
CONECT   32   18   76                                                 
CONECT   33   22   15                                                 
CONECT   34   22   22                                                 
CONECT   35   26   16                                                 
CONECT   36   26   26                                                 
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    7                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   21                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   25                                                      
CONECT   67   25                                                      
CONECT   68   27                                                      
CONECT   69   27                                                      
CONECT   70   28                                                      
CONECT   71   28                                                      
CONECT   72   29                                                      
CONECT   73   29                                                      
CONECT   74   29                                                      
CONECT   75   30                                                      
CONECT   76   32                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
