COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1     -16.416   1.923   0.598  1.00  0.00           C  
HETATM    2  C   UNL     1     -14.896   2.022   0.452  1.00  0.00           C  
HETATM    3  C   UNL     1     -14.352   0.712  -0.123  1.00  0.00           C  
HETATM    4  C   UNL     1     -14.884   0.519  -1.544  1.00  0.00           C  
HETATM    5  C   UNL     1     -12.824   0.764  -0.152  1.00  0.00           C  
HETATM    6  C   UNL     1     -12.276  -0.590  -0.609  1.00  0.00           C  
HETATM    7  C   UNL     1     -10.771  -0.539  -0.639  1.00  0.00           C  
HETATM    8  C   UNL     1     -10.073  -1.354   0.114  1.00  0.00           C  
HETATM    9  C   UNL     1     -10.773  -2.267   1.086  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.570  -1.376   0.007  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.969  -0.460   1.075  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.465  -0.483   0.968  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.810   0.623   0.718  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.562   1.897   0.432  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.303   0.622   0.716  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.795   0.428  -0.714  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.288   0.426  -0.716  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.634  -0.649  -1.081  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.389  -1.891  -1.480  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.127  -0.644  -1.102  1.00  0.00           C  
HETATM   21  C   UNL     1       0.403  -1.212   0.215  1.00  0.00           C  
HETATM   22  C   UNL     1       1.910  -1.207   0.194  1.00  0.00           C  
HETATM   23  C   UNL     1       2.575  -0.475   1.053  1.00  0.00           C  
HETATM   24  C   UNL     1       1.833   0.373   2.053  1.00  0.00           C  
HETATM   25  C   UNL     1       4.082  -0.482   1.042  1.00  0.00           C  
HETATM   26  C   UNL     1       4.591   0.692   0.203  1.00  0.00           C  
HETATM   27  C   UNL     1       6.097   0.685   0.191  1.00  0.00           C  
HETATM   28  C   UNL     1       6.743   0.524  -0.937  1.00  0.00           C  
HETATM   29  C   UNL     1       5.983   0.238  -2.206  1.00  0.00           C  
HETATM   30  C   UNL     1       8.247   0.625  -0.966  1.00  0.00           C  
HETATM   31  C   UNL     1       8.854  -0.774  -0.841  1.00  0.00           C  
HETATM   32  C   UNL     1      10.357  -0.674  -0.870  1.00  0.00           C  
HETATM   33  C   UNL     1      11.061  -1.092   0.152  1.00  0.00           C  
HETATM   34  C   UNL     1      10.366  -1.575   1.399  1.00  0.00           C  
HETATM   35  C   UNL     1      12.567  -1.090   0.082  1.00  0.00           C  
HETATM   36  C   UNL     1      13.105   0.200   0.705  1.00  0.00           C  
HETATM   37  C   UNL     1      14.610   0.202   0.635  1.00  0.00           C  
HETATM   38  C   UNL     1      15.241   1.241   0.148  1.00  0.00           C  
HETATM   39  C   UNL     1      16.730   1.179  -0.082  1.00  0.00           C  
HETATM   40  C   UNL     1      14.480   2.499  -0.181  1.00  0.00           C  
HETATM   41  H   UNL     1     -16.864   1.741  -0.379  1.00  0.00           H  
HETATM   42  H   UNL     1     -16.663   1.100   1.270  1.00  0.00           H  
HETATM   43  H   UNL     1     -16.803   2.855   1.008  1.00  0.00           H  
HETATM   44  H   UNL     1     -14.648   2.843  -0.220  1.00  0.00           H  
HETATM   45  H   UNL     1     -14.448   2.203   1.429  1.00  0.00           H  
HETATM   46  H   UNL     1     -14.676  -0.121   0.502  1.00  0.00           H  
HETATM   47  H   UNL     1     -15.973   0.482  -1.523  1.00  0.00           H  
HETATM   48  H   UNL     1     -14.561   1.352  -2.169  1.00  0.00           H  
HETATM   49  H   UNL     1     -14.497  -0.414  -1.954  1.00  0.00           H  
HETATM   50  H   UNL     1     -12.500   1.539  -0.846  1.00  0.00           H  
HETATM   51  H   UNL     1     -12.448   0.989   0.846  1.00  0.00           H  
HETATM   52  H   UNL     1     -12.600  -1.366   0.085  1.00  0.00           H  
HETATM   53  H   UNL     1     -12.652  -0.816  -1.607  1.00  0.00           H  
HETATM   54  H   UNL     1     -10.267   0.169  -1.280  1.00  0.00           H  
HETATM   55  H   UNL     1     -11.091  -3.173   0.569  1.00  0.00           H  
HETATM   56  H   UNL     1     -10.090  -2.530   1.894  1.00  0.00           H  
HETATM   57  H   UNL     1     -11.645  -1.760   1.498  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.210  -2.394   0.158  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.270  -1.028  -0.981  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.328   0.558   0.924  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.268  -0.809   2.063  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.929  -1.411   1.098  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.827   2.381   1.372  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.934   2.566  -0.157  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.470   1.666  -0.126  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.938   1.572   1.105  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.939  -0.192   1.344  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.160  -0.523  -1.104  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.158   1.241  -1.342  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.747   1.311  -0.417  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.689  -1.814  -2.525  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.750  -2.763  -1.348  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.276  -1.993  -0.854  1.00  0.00           H  
HETATM   74  H   UNL     1       0.226  -1.257  -1.931  1.00  0.00           H  
HETATM   75  H   UNL     1       0.231   0.378  -1.228  1.00  0.00           H  
HETATM   76  H   UNL     1       0.049  -0.599   1.044  1.00  0.00           H  
HETATM   77  H   UNL     1       0.045  -2.234   0.341  1.00  0.00           H  
HETATM   78  H   UNL     1       2.442  -1.807  -0.530  1.00  0.00           H  
HETATM   79  H   UNL     1       1.593  -0.226   2.931  1.00  0.00           H  
HETATM   80  H   UNL     1       2.457   1.217   2.348  1.00  0.00           H  
HETATM   81  H   UNL     1       0.911   0.743   1.603  1.00  0.00           H  
HETATM   82  H   UNL     1       4.453  -0.387   2.062  1.00  0.00           H  
HETATM   83  H   UNL     1       4.438  -1.418   0.611  1.00  0.00           H  
HETATM   84  H   UNL     1       4.219   0.597  -0.818  1.00  0.00           H  
HETATM   85  H   UNL     1       4.235   1.628   0.634  1.00  0.00           H  
HETATM   86  H   UNL     1       6.645   0.813   1.113  1.00  0.00           H  
HETATM   87  H   UNL     1       5.650   1.177  -2.650  1.00  0.00           H  
HETATM   88  H   UNL     1       6.631  -0.286  -2.908  1.00  0.00           H  
HETATM   89  H   UNL     1       5.116  -0.383  -1.979  1.00  0.00           H  
HETATM   90  H   UNL     1       8.563   1.075  -1.907  1.00  0.00           H  
HETATM   91  H   UNL     1       8.585   1.243  -0.135  1.00  0.00           H  
HETATM   92  H   UNL     1       8.538  -1.225   0.100  1.00  0.00           H  
HETATM   93  H   UNL     1       8.515  -1.393  -1.672  1.00  0.00           H  
HETATM   94  H   UNL     1      10.854  -0.256  -1.734  1.00  0.00           H  
HETATM   95  H   UNL     1      10.095  -2.625   1.280  1.00  0.00           H  
HETATM   96  H   UNL     1      11.035  -1.467   2.253  1.00  0.00           H  
HETATM   97  H   UNL     1       9.466  -0.984   1.565  1.00  0.00           H  
HETATM   98  H   UNL     1      12.957  -1.948   0.628  1.00  0.00           H  
HETATM   99  H   UNL     1      12.882  -1.148  -0.960  1.00  0.00           H  
HETATM  100  H   UNL     1      12.714   1.058   0.159  1.00  0.00           H  
HETATM  101  H   UNL     1      12.790   0.258   1.747  1.00  0.00           H  
HETATM  102  H   UNL     1      15.168  -0.654   0.985  1.00  0.00           H  
HETATM  103  H   UNL     1      16.926   0.817  -1.091  1.00  0.00           H  
HETATM  104  H   UNL     1      17.157   2.175   0.036  1.00  0.00           H  
HETATM  105  H   UNL     1      17.181   0.502   0.642  1.00  0.00           H  
HETATM  106  H   UNL     1      13.423   2.352   0.040  1.00  0.00           H  
HETATM  107  H   UNL     1      14.865   3.325   0.417  1.00  0.00           H  
HETATM  108  H   UNL     1      14.601   2.731  -1.240  1.00  0.00           H  
CONECT    1    2   41   42   43                                       
CONECT    2    1    3   44   45                                       
CONECT    3    2    4    5   46                                       
CONECT    4    3   47   48   49                                       
CONECT    5    3    6   50   51                                       
CONECT    6    5    7   52   53                                       
CONECT    7    6    8    8   54                                       
CONECT    8    7    7    9   10                                       
CONECT    9    8   55   56   57                                       
CONECT   10    8   11   58   59                                       
CONECT   11   10   12   60   61                                       
CONECT   12   11   13   13   62                                       
CONECT   13   12   12   15   14                                       
CONECT   14   13   63   64   65                                       
CONECT   15   16   13   66   67                                       
CONECT   16   17   15   68   69                                       
CONECT   17   18   18   16   70                                       
CONECT   18   20   17   17   19                                       
CONECT   19   18   71   72   73                                       
CONECT   20   18   21   74   75                                       
CONECT   21   20   22   76   77                                       
CONECT   22   21   23   23   78                                       
CONECT   23   24   22   22   25                                       
CONECT   24   23   79   80   81                                       
CONECT   25   23   26   82   83                                       
CONECT   26   25   27   84   85                                       
CONECT   27   26   28   28   86                                       
CONECT   28   27   27   29   30                                       
CONECT   29   28   87   88   89                                       
CONECT   30   28   31   90   91                                       
CONECT   31   30   32   92   93                                       
CONECT   32   31   33   33   94                                       
CONECT   33   34   32   32   35                                       
CONECT   34   33   95   96   97                                       
CONECT   35   33   36   98   99                                       
CONECT   36   35   37  100  101                                       
CONECT   37   36   38   38  102                                       
CONECT   38   39   37   37   40                                       
CONECT   39   38  103  104  105                                       
CONECT   40   38  106  107  108                                       
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    1                                                      
CONECT   44    2                                                      
CONECT   45    2                                                      
CONECT   46    3                                                      
CONECT   47    4                                                      
CONECT   48    4                                                      
CONECT   49    4                                                      
CONECT   50    5                                                      
CONECT   51    5                                                      
CONECT   52    6                                                      
CONECT   53    6                                                      
CONECT   54    7                                                      
CONECT   55    9                                                      
CONECT   56    9                                                      
CONECT   57    9                                                      
CONECT   58   10                                                      
CONECT   59   10                                                      
CONECT   60   11                                                      
CONECT   61   11                                                      
CONECT   62   12                                                      
CONECT   63   14                                                      
CONECT   64   14                                                      
CONECT   65   14                                                      
CONECT   66   15                                                      
CONECT   67   15                                                      
CONECT   68   16                                                      
CONECT   69   16                                                      
CONECT   70   17                                                      
CONECT   71   19                                                      
CONECT   72   19                                                      
CONECT   73   19                                                      
CONECT   74   20                                                      
CONECT   75   20                                                      
CONECT   76   21                                                      
CONECT   77   21                                                      
CONECT   78   22                                                      
CONECT   79   24                                                      
CONECT   80   24                                                      
CONECT   81   24                                                      
CONECT   82   25                                                      
CONECT   83   25                                                      
CONECT   84   26                                                      
CONECT   85   26                                                      
CONECT   86   27                                                      
CONECT   87   29                                                      
CONECT   88   29                                                      
CONECT   89   29                                                      
CONECT   90   30                                                      
CONECT   91   30                                                      
CONECT   92   31                                                      
CONECT   93   31                                                      
CONECT   94   32                                                      
CONECT   95   34                                                      
CONECT   96   34                                                      
CONECT   97   34                                                      
CONECT   98   35                                                      
CONECT   99   35                                                      
CONECT  100   36                                                      
CONECT  101   36                                                      
CONECT  102   37                                                      
CONECT  103   39                                                      
CONECT  104   39                                                      
CONECT  105   39                                                      
CONECT  106   40                                                      
CONECT  107   40                                                      
CONECT  108   40                                                      
MASTER        0    0    0    0    0    0    0    0  108    0  108    0
END
