COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.446   0.547   0.486  1.00  0.00           O  
HETATM    2  O   UNL     1      -7.014  -1.000  -0.785  1.00  0.00           O  
HETATM    3  C   UNL     1      -2.846  -0.354   1.387  1.00  0.00           C  
HETATM    4  C   UNL     1       3.632   1.339   0.585  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.195   0.517  -0.834  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.387  -0.174  -0.911  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.037  -1.046   1.296  1.00  0.00           C  
HETATM    8  C   UNL     1       1.260   1.210   0.494  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.740   1.369  -1.990  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.806  -0.956   0.150  1.00  0.00           C  
HETATM   11  C   UNL     1       0.071   0.503   0.406  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.142   1.186   0.415  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.155   2.576   0.511  1.00  0.00           C  
HETATM   14  C   UNL     1       0.034   3.272   0.598  1.00  0.00           C  
HETATM   15  C   UNL     1       1.239   2.594   0.595  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.782   0.564  -2.870  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.320   1.429  -4.045  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.106  -1.713   0.058  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.713  -1.857   1.455  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.847  -3.101  -0.531  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.005   3.385   1.950  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.169  -3.862  -0.646  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.019  -0.470   2.024  1.00  0.00           C  
HETATM   24  C   UNL     1       6.462  -0.888   1.720  1.00  0.00           C  
HETATM   25  C   UNL     1       7.057  -1.213   0.516  1.00  0.00           C  
HETATM   26  C   UNL     1       6.545  -0.712  -0.666  1.00  0.00           C  
HETATM   27  C   UNL     1       5.436   0.113  -0.643  1.00  0.00           C  
HETATM   28  C   UNL     1       4.840   0.438   0.561  1.00  0.00           C  
HETATM   29  C   UNL     1       5.350  -0.067   1.742  1.00  0.00           C  
HETATM   30  C   UNL     1       7.194  -1.066  -1.979  1.00  0.00           C  
HETATM   31  O   UNL     1       6.487  -0.431  -3.046  1.00  0.00           O  
HETATM   32  C   UNL     1       8.266  -2.113   0.491  1.00  0.00           C  
HETATM   33  O   UNL     1       8.601  -2.497   1.827  1.00  0.00           O  
HETATM   34  C   UNL     1      -2.466   3.319   0.520  1.00  0.00           C  
HETATM   35  C   UNL     1      -2.419   0.435   0.321  1.00  0.00           C  
HETATM   36  H   UNL     1      -6.694  -0.871  -1.688  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.248  -0.421   2.283  1.00  0.00           H  
HETATM   38  H   UNL     1       3.678   2.031  -0.255  1.00  0.00           H  
HETATM   39  H   UNL     1       3.617   1.901   1.519  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.994  -0.104  -1.801  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.369  -1.658   2.122  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.605   1.674  -2.579  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.229   2.254  -1.611  1.00  0.00           H  
HETATM   44  H   UNL     1       0.086  -0.574   0.332  1.00  0.00           H  
HETATM   45  H   UNL     1       0.023   4.350   0.672  1.00  0.00           H  
HETATM   46  H   UNL     1       2.166   3.143   0.668  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.917   0.259  -2.281  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.293  -0.320  -3.250  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.808   2.314  -3.665  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.637   0.856  -4.672  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.185   1.734  -4.634  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.635  -2.436   1.393  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.006  -2.369   2.107  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.400  -2.998  -1.520  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.167  -3.651   0.119  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.953   3.923   1.956  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.158   2.374   2.328  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.288   3.906   2.585  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.642  -3.918   0.335  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.830  -3.340  -1.338  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.978  -4.869  -1.015  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.113   0.135   2.012  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.786   0.010   1.416  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.377  -0.569   3.049  1.00  0.00           H  
HETATM   65  H   UNL     1       6.862  -1.279   2.644  1.00  0.00           H  
HETATM   66  H   UNL     1       5.036   0.505  -1.567  1.00  0.00           H  
HETATM   67  H   UNL     1       4.885   0.187   2.684  1.00  0.00           H  
HETATM   68  H   UNL     1       8.229  -0.725  -1.975  1.00  0.00           H  
HETATM   69  H   UNL     1       7.168  -2.147  -2.118  1.00  0.00           H  
HETATM   70  H   UNL     1       6.851  -0.615  -3.923  1.00  0.00           H  
HETATM   71  H   UNL     1       8.044  -3.003  -0.097  1.00  0.00           H  
HETATM   72  H   UNL     1       9.106  -1.582   0.044  1.00  0.00           H  
HETATM   73  H   UNL     1       9.371  -3.078   1.887  1.00  0.00           H  
HETATM   74  H   UNL     1      -2.313   4.330   0.142  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.183   2.799  -0.115  1.00  0.00           H  
CONECT    1    8    4                                                 
CONECT    2   18   36                                                 
CONECT    3    7   35   35   37                                       
CONECT    4    1   28   38   39                                       
CONECT    5    6    6   35    9                                       
CONECT    6   10    5    5   40                                       
CONECT    7   10   10    3   41                                       
CONECT    8   11    1   15   15                                       
CONECT    9    5   16   42   43                                       
CONECT   10   18    7    7    6                                       
CONECT   11   12   12    8   44                                       
CONECT   12   35   11   11   13                                       
CONECT   13   12   34   14   14                                       
CONECT   14   13   13   15   45                                       
CONECT   15    8    8   14   46                                       
CONECT   16    9   17   47   48                                       
CONECT   17   16   49   50   51                                       
CONECT   18   20   19   10    2                                       
CONECT   19   23   18   52   53                                       
CONECT   20   22   18   54   55                                       
CONECT   21   34   56   57   58                                       
CONECT   22   20   59   60   61                                       
CONECT   23   19   62   63   64                                       
CONECT   24   29   29   25   65                                       
CONECT   25   24   32   26   26                                       
CONECT   26   25   25   27   30                                       
CONECT   27   28   28   26   66                                       
CONECT   28   29   27   27    4                                       
CONECT   29   24   24   28   67                                       
CONECT   30   26   31   68   69                                       
CONECT   31   30   70                                                 
CONECT   32   33   25   71   72                                       
CONECT   33   32   73                                                 
CONECT   34   21   13   74   75                                       
CONECT   35    3    3    5   12                                       
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   11                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   27                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   30                                                      
CONECT   70   31                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
CONECT   73   33                                                      
CONECT   74   34                                                      
CONECT   75   34                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
