COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      14.982   2.914   1.053  1.00  0.00           O  
HETATM    2  C   UNL     1      15.899   1.861   0.751  1.00  0.00           C  
HETATM    3  C   UNL     1      17.229   2.459   0.287  1.00  0.00           C  
HETATM    4  C   UNL     1      16.131   1.012   2.003  1.00  0.00           C  
HETATM    5  C   UNL     1      15.320   0.983  -0.360  1.00  0.00           C  
HETATM    6  C   UNL     1      13.990   0.385   0.103  1.00  0.00           C  
HETATM    7  C   UNL     1      13.410  -0.492  -1.008  1.00  0.00           C  
HETATM    8  C   UNL     1      12.101  -1.082  -0.552  1.00  0.00           C  
HETATM    9  C   UNL     1      12.088  -2.352   0.260  1.00  0.00           C  
HETATM   10  C   UNL     1      10.950  -0.478  -0.866  1.00  0.00           C  
HETATM   11  C   UNL     1       9.719  -1.032  -0.437  1.00  0.00           C  
HETATM   12  C   UNL     1       8.549  -0.418  -0.757  1.00  0.00           C  
HETATM   13  C   UNL     1       7.327  -0.968  -0.331  1.00  0.00           C  
HETATM   14  C   UNL     1       7.314  -2.238   0.481  1.00  0.00           C  
HETATM   15  C   UNL     1       6.152  -0.351  -0.652  1.00  0.00           C  
HETATM   16  C   UNL     1       4.935  -0.899  -0.228  1.00  0.00           C  
HETATM   17  C   UNL     1       3.749  -0.276  -0.552  1.00  0.00           C  
HETATM   18  C   UNL     1       2.533  -0.823  -0.128  1.00  0.00           C  
HETATM   19  C   UNL     1       2.520  -2.093   0.683  1.00  0.00           C  
HETATM   20  C   UNL     1       1.346  -0.200  -0.452  1.00  0.00           C  
HETATM   21  C   UNL     1       0.131  -0.747  -0.029  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.057  -0.123  -0.354  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.271  -0.670   0.070  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.459  -0.046  -0.255  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.446   1.224  -1.066  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.674  -0.592   0.168  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.861   0.031  -0.157  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.076  -0.516   0.267  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.263   0.107  -0.058  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.250   1.377  -0.869  1.00  0.00           C  
HETATM   31  C   UNL     1      -9.479  -0.440   0.366  1.00  0.00           C  
HETATM   32  C   UNL     1     -10.665   0.183   0.042  1.00  0.00           C  
HETATM   33  C   UNL     1     -11.882  -0.365   0.466  1.00  0.00           C  
HETATM   34  C   UNL     1     -13.058   0.252   0.145  1.00  0.00           C  
HETATM   35  C   UNL     1     -13.045   1.522  -0.666  1.00  0.00           C  
HETATM   36  C   UNL     1     -14.279  -0.298   0.571  1.00  0.00           C  
HETATM   37  C   UNL     1     -15.449   0.316   0.251  1.00  0.00           C  
HETATM   38  C   UNL     1     -16.681  -0.238   0.680  1.00  0.00           C  
HETATM   39  C   UNL     1     -17.831   0.366   0.366  1.00  0.00           C  
HETATM   40  C   UNL     1     -17.818   1.636  -0.445  1.00  0.00           C  
HETATM   41  C   UNL     1     -19.141  -0.223   0.822  1.00  0.00           C  
HETATM   42  H   UNL     1      14.788   3.494   0.304  1.00  0.00           H  
HETATM   43  H   UNL     1      17.642   3.084   1.079  1.00  0.00           H  
HETATM   44  H   UNL     1      17.928   1.655   0.057  1.00  0.00           H  
HETATM   45  H   UNL     1      17.064   3.064  -0.604  1.00  0.00           H  
HETATM   46  H   UNL     1      15.183   0.586   2.333  1.00  0.00           H  
HETATM   47  H   UNL     1      16.830   0.208   1.772  1.00  0.00           H  
HETATM   48  H   UNL     1      16.543   1.637   2.795  1.00  0.00           H  
HETATM   49  H   UNL     1      15.155   1.588  -1.252  1.00  0.00           H  
HETATM   50  H   UNL     1      16.019   0.180  -0.591  1.00  0.00           H  
HETATM   51  H   UNL     1      14.155  -0.220   0.995  1.00  0.00           H  
HETATM   52  H   UNL     1      13.290   1.189   0.334  1.00  0.00           H  
HETATM   53  H   UNL     1      13.245   0.112  -1.900  1.00  0.00           H  
HETATM   54  H   UNL     1      14.110  -1.296  -1.238  1.00  0.00           H  
HETATM   55  H   UNL     1      12.138  -2.106   1.320  1.00  0.00           H  
HETATM   56  H   UNL     1      11.169  -2.903   0.058  1.00  0.00           H  
HETATM   57  H   UNL     1      12.947  -2.965  -0.012  1.00  0.00           H  
HETATM   58  H   UNL     1      10.960   0.432  -1.447  1.00  0.00           H  
HETATM   59  H   UNL     1       9.709  -1.942   0.145  1.00  0.00           H  
HETATM   60  H   UNL     1       8.558   0.492  -1.338  1.00  0.00           H  
HETATM   61  H   UNL     1       7.365  -1.992   1.541  1.00  0.00           H  
HETATM   62  H   UNL     1       6.396  -2.789   0.278  1.00  0.00           H  
HETATM   63  H   UNL     1       8.174  -2.851   0.209  1.00  0.00           H  
HETATM   64  H   UNL     1       6.161   0.559  -1.233  1.00  0.00           H  
HETATM   65  H   UNL     1       4.925  -1.809   0.354  1.00  0.00           H  
HETATM   66  H   UNL     1       3.758   0.634  -1.133  1.00  0.00           H  
HETATM   67  H   UNL     1       2.570  -1.847   1.744  1.00  0.00           H  
HETATM   68  H   UNL     1       1.602  -2.644   0.481  1.00  0.00           H  
HETATM   69  H   UNL     1       3.379  -2.707   0.412  1.00  0.00           H  
HETATM   70  H   UNL     1       1.355   0.710  -1.034  1.00  0.00           H  
HETATM   71  H   UNL     1       0.122  -1.657   0.552  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.048   0.787  -0.935  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.280  -1.580   0.651  1.00  0.00           H  
HETATM   74  H   UNL     1      -3.497   0.978  -2.127  1.00  0.00           H  
HETATM   75  H   UNL     1      -4.305   1.837  -0.795  1.00  0.00           H  
HETATM   76  H   UNL     1      -2.528   1.775  -0.864  1.00  0.00           H  
HETATM   77  H   UNL     1      -4.683  -1.503   0.750  1.00  0.00           H  
HETATM   78  H   UNL     1      -5.852   0.941  -0.738  1.00  0.00           H  
HETATM   79  H   UNL     1      -7.085  -1.426   0.848  1.00  0.00           H  
HETATM   80  H   UNL     1      -8.301   1.131  -1.930  1.00  0.00           H  
HETATM   81  H   UNL     1      -9.109   1.991  -0.597  1.00  0.00           H  
HETATM   82  H   UNL     1      -7.332   1.928  -0.667  1.00  0.00           H  
HETATM   83  H   UNL     1      -9.488  -1.350   0.948  1.00  0.00           H  
HETATM   84  H   UNL     1     -10.656   1.093  -0.539  1.00  0.00           H  
HETATM   85  H   UNL     1     -11.892  -1.275   1.048  1.00  0.00           H  
HETATM   86  H   UNL     1     -13.095   1.276  -1.727  1.00  0.00           H  
HETATM   87  H   UNL     1     -13.904   2.135  -0.394  1.00  0.00           H  
HETATM   88  H   UNL     1     -12.126   2.073  -0.464  1.00  0.00           H  
HETATM   89  H   UNL     1     -14.288  -1.208   1.152  1.00  0.00           H  
HETATM   90  H   UNL     1     -15.440   1.227  -0.330  1.00  0.00           H  
HETATM   91  H   UNL     1     -16.690  -1.148   1.262  1.00  0.00           H  
HETATM   92  H   UNL     1     -17.868   1.390  -1.506  1.00  0.00           H  
HETATM   93  H   UNL     1     -18.677   2.249  -0.174  1.00  0.00           H  
HETATM   94  H   UNL     1     -16.900   2.187  -0.243  1.00  0.00           H  
HETATM   95  H   UNL     1     -18.951  -1.133   1.392  1.00  0.00           H  
HETATM   96  H   UNL     1     -19.663   0.497   1.452  1.00  0.00           H  
HETATM   97  H   UNL     1     -19.756  -0.460  -0.046  1.00  0.00           H  
CONECT    1    2   42                                                 
CONECT    2    1    3    4    5                                       
CONECT    3    2   43   44   45                                       
CONECT    4    2   46   47   48                                       
CONECT    5    2    6   49   50                                       
CONECT    6    5    7   51   52                                       
CONECT    7    6    8   53   54                                       
CONECT    8    7    9   10   10                                       
CONECT    9    8   55   56   57                                       
CONECT   10    8    8   11   58                                       
CONECT   11   10   12   12   59                                       
CONECT   12   11   11   13   60                                       
CONECT   13   12   14   15   15                                       
CONECT   14   13   61   62   63                                       
CONECT   15   13   13   16   64                                       
CONECT   16   15   17   17   65                                       
CONECT   17   16   16   18   66                                       
CONECT   18   17   19   20   20                                       
CONECT   19   18   67   68   69                                       
CONECT   20   18   18   21   70                                       
CONECT   21   20   22   22   71                                       
CONECT   22   21   21   23   72                                       
CONECT   23   22   24   24   73                                       
CONECT   24   23   23   25   26                                       
CONECT   25   24   74   75   76                                       
CONECT   26   24   27   27   77                                       
CONECT   27   26   26   28   78                                       
CONECT   28   27   29   29   79                                       
CONECT   29   28   28   30   31                                       
CONECT   30   29   80   81   82                                       
CONECT   31   29   32   32   83                                       
CONECT   32   31   31   33   84                                       
CONECT   33   32   34   34   85                                       
CONECT   34   33   33   35   36                                       
CONECT   35   34   86   87   88                                       
CONECT   36   34   37   37   89                                       
CONECT   37   36   36   38   90                                       
CONECT   38   37   39   39   91                                       
CONECT   39   38   38   40   41                                       
CONECT   40   39   92   93   94                                       
CONECT   41   39   95   96   97                                       
CONECT   42    1                                                      
CONECT   43    3                                                      
CONECT   44    3                                                      
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    4                                                      
CONECT   48    4                                                      
CONECT   49    5                                                      
CONECT   50    5                                                      
CONECT   51    6                                                      
CONECT   52    6                                                      
CONECT   53    7                                                      
CONECT   54    7                                                      
CONECT   55    9                                                      
CONECT   56    9                                                      
CONECT   57    9                                                      
CONECT   58   10                                                      
CONECT   59   11                                                      
CONECT   60   12                                                      
CONECT   61   14                                                      
CONECT   62   14                                                      
CONECT   63   14                                                      
CONECT   64   15                                                      
CONECT   65   16                                                      
CONECT   66   17                                                      
CONECT   67   19                                                      
CONECT   68   19                                                      
CONECT   69   19                                                      
CONECT   70   20                                                      
CONECT   71   21                                                      
CONECT   72   22                                                      
CONECT   73   23                                                      
CONECT   74   25                                                      
CONECT   75   25                                                      
CONECT   76   25                                                      
CONECT   77   26                                                      
CONECT   78   27                                                      
CONECT   79   28                                                      
CONECT   80   30                                                      
CONECT   81   30                                                      
CONECT   82   30                                                      
CONECT   83   31                                                      
CONECT   84   32                                                      
CONECT   85   33                                                      
CONECT   86   35                                                      
CONECT   87   35                                                      
CONECT   88   35                                                      
CONECT   89   36                                                      
CONECT   90   37                                                      
CONECT   91   38                                                      
CONECT   92   40                                                      
CONECT   93   40                                                      
CONECT   94   40                                                      
CONECT   95   41                                                      
CONECT   96   41                                                      
CONECT   97   41                                                      
MASTER        0    0    0    0    0    0    0    0   97    0   97    0
END
