COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.045  -2.957   1.555  1.00  0.00           C  
HETATM    2  O   UNL     1      -0.841  -3.087   2.134  1.00  0.00           O  
HETATM    3  O   UNL     1      -2.136  -2.555   0.419  1.00  0.00           O  
HETATM    4  C   UNL     1      -3.280  -3.318   2.336  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.649  -4.785   2.084  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.963  -5.102   2.805  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.080  -4.209   2.263  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.734  -2.738   2.532  1.00  0.00           C  
HETATM    9  N   UNL     1      -4.412  -2.474   1.929  1.00  0.00           N  
HETATM   10  C   UNL     1      -4.276  -1.485   1.022  1.00  0.00           C  
HETATM   11  O   UNL     1      -3.199  -1.266   0.508  1.00  0.00           O  
HETATM   12  C   UNL     1      -5.467  -0.664   0.660  1.00  0.00           C  
HETATM   13  O   UNL     1      -6.501  -0.816   1.267  1.00  0.00           O  
HETATM   14  C   UNL     1      -5.403   0.353  -0.449  1.00  0.00           C  
HETATM   15  O   UNL     1      -5.339   1.663   0.101  1.00  0.00           O  
HETATM   16  O   UNL     1      -4.246   0.112  -1.255  1.00  0.00           O  
HETATM   17  C   UNL     1      -6.657   0.216  -1.318  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.578   1.224  -2.471  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.362   2.620  -1.872  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.123   2.578  -0.971  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.872   3.974  -0.399  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.674   4.622  -1.098  1.00  0.00           C  
HETATM   23  O   UNL     1      -2.464   4.012  -0.642  1.00  0.00           O  
HETATM   24  C   UNL     1      -3.655   6.093  -0.766  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.524   6.784  -0.729  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.231   6.168  -1.034  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.100   6.844  -0.746  1.00  0.00           C  
HETATM   28  C   UNL     1       1.214   6.285  -1.062  1.00  0.00           C  
HETATM   29  C   UNL     1       2.312   6.869  -0.579  1.00  0.00           C  
HETATM   30  C   UNL     1       3.673   6.311  -0.907  1.00  0.00           C  
HETATM   31  C   UNL     1       4.186   5.484   0.273  1.00  0.00           C  
HETATM   32  C   UNL     1       4.821   4.193  -0.250  1.00  0.00           C  
HETATM   33  C   UNL     1       5.144   3.284   0.907  1.00  0.00           C  
HETATM   34  O   UNL     1       4.655   3.490   1.992  1.00  0.00           O  
HETATM   35  C   UNL     1       6.079   2.118   0.710  1.00  0.00           C  
HETATM   36  O   UNL     1       5.753   1.448  -0.510  1.00  0.00           O  
HETATM   37  C   UNL     1       5.936   1.144   1.880  1.00  0.00           C  
HETATM   38  O   UNL     1       7.232   0.787   2.365  1.00  0.00           O  
HETATM   39  C   UNL     1       5.203  -0.113   1.408  1.00  0.00           C  
HETATM   40  C   UNL     1       4.855  -0.986   2.616  1.00  0.00           C  
HETATM   41  C   UNL     1       4.088  -2.223   2.145  1.00  0.00           C  
HETATM   42  C   UNL     1       2.629  -1.878   1.989  1.00  0.00           C  
HETATM   43  O   UNL     1       2.307  -0.791   1.572  1.00  0.00           O  
HETATM   44  C   UNL     1       1.573  -2.888   2.354  1.00  0.00           C  
HETATM   45  C   UNL     1       0.371  -2.736   1.420  1.00  0.00           C  
HETATM   46  C   UNL     1       0.540  -3.663   0.214  1.00  0.00           C  
HETATM   47  C   UNL     1       1.846  -3.327  -0.508  1.00  0.00           C  
HETATM   48  C   UNL     1       1.943  -4.138  -1.774  1.00  0.00           C  
HETATM   49  C   UNL     1       2.550  -5.380  -1.752  1.00  0.00           C  
HETATM   50  C   UNL     1       2.636  -6.130  -2.914  1.00  0.00           C  
HETATM   51  O   UNL     1       3.228  -7.354  -2.893  1.00  0.00           O  
HETATM   52  C   UNL     1       2.119  -5.626  -4.104  1.00  0.00           C  
HETATM   53  O   UNL     1       2.205  -6.356  -5.248  1.00  0.00           O  
HETATM   54  C   UNL     1       1.516  -4.378  -4.120  1.00  0.00           C  
HETATM   55  C   UNL     1       1.430  -3.637  -2.956  1.00  0.00           C  
HETATM   56  C   UNL     1      -6.737  -1.204  -1.883  1.00  0.00           C  
HETATM   57  C   UNL     1      -4.961   6.789  -0.459  1.00  0.00           C  
HETATM   58  C   UNL     1       4.642   7.463  -1.182  1.00  0.00           C  
HETATM   59  C   UNL     1       6.107   4.529  -1.008  1.00  0.00           C  
HETATM   60  C   UNL     1       6.104  -0.900   0.454  1.00  0.00           C  
HETATM   61  C   UNL     1       4.240  -3.342   3.178  1.00  0.00           C  
HETATM   62  C   UNL     1       0.580  -5.116   0.690  1.00  0.00           C  
HETATM   63  C   UNL     1      -2.409   4.213   0.772  1.00  0.00           C  
HETATM   64  C   UNL     1       6.975   1.285  -1.231  1.00  0.00           C  
HETATM   65  C   UNL     1       3.651  -7.586  -1.548  1.00  0.00           C  
HETATM   66  C   UNL     1      -1.056   3.734   1.302  1.00  0.00           C  
HETATM   67  H   UNL     1      -3.088  -3.174   3.402  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.858  -5.431   2.467  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.771  -4.952   1.014  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.842  -4.924   3.874  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.223  -6.148   2.641  1.00  0.00           H  
HETATM   72  H   UNL     1      -7.018  -4.458   2.760  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.184  -4.367   1.190  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.693  -2.558   3.606  1.00  0.00           H  
HETATM   75  H   UNL     1      -6.484  -2.092   2.076  1.00  0.00           H  
HETATM   76  H   UNL     1      -3.478   0.207  -0.675  1.00  0.00           H  
HETATM   77  H   UNL     1      -7.543   0.420  -0.715  1.00  0.00           H  
HETATM   78  H   UNL     1      -7.508   1.208  -3.039  1.00  0.00           H  
HETATM   79  H   UNL     1      -5.742   0.971  -3.123  1.00  0.00           H  
HETATM   80  H   UNL     1      -7.234   2.905  -1.283  1.00  0.00           H  
HETATM   81  H   UNL     1      -6.207   3.343  -2.673  1.00  0.00           H  
HETATM   82  H   UNL     1      -4.262   2.263  -1.558  1.00  0.00           H  
HETATM   83  H   UNL     1      -4.668   3.896   0.669  1.00  0.00           H  
HETATM   84  H   UNL     1      -5.757   4.592  -0.552  1.00  0.00           H  
HETATM   85  H   UNL     1      -3.765   4.491  -2.177  1.00  0.00           H  
HETATM   86  H   UNL     1      -2.554   7.838  -0.468  1.00  0.00           H  
HETATM   87  H   UNL     1      -1.183   5.189  -1.482  1.00  0.00           H  
HETATM   88  H   UNL     1      -0.170   7.813  -0.268  1.00  0.00           H  
HETATM   89  H   UNL     1       1.296   5.409  -1.685  1.00  0.00           H  
HETATM   90  H   UNL     1       2.223   7.737   0.058  1.00  0.00           H  
HETATM   91  H   UNL     1       3.602   5.678  -1.791  1.00  0.00           H  
HETATM   92  H   UNL     1       3.355   5.238   0.934  1.00  0.00           H  
HETATM   93  H   UNL     1       4.931   6.058   0.823  1.00  0.00           H  
HETATM   94  H   UNL     1       4.124   3.692  -0.922  1.00  0.00           H  
HETATM   95  H   UNL     1       7.106   2.480   0.662  1.00  0.00           H  
HETATM   96  H   UNL     1       5.367   1.618   2.680  1.00  0.00           H  
HETATM   97  H   UNL     1       7.659   1.607   2.652  1.00  0.00           H  
HETATM   98  H   UNL     1       4.288   0.172   0.891  1.00  0.00           H  
HETATM   99  H   UNL     1       4.237  -0.416   3.310  1.00  0.00           H  
HETATM  100  H   UNL     1       5.772  -1.296   3.117  1.00  0.00           H  
HETATM  101  H   UNL     1       4.487  -2.556   1.187  1.00  0.00           H  
HETATM  102  H   UNL     1       1.255  -2.724   3.384  1.00  0.00           H  
HETATM  103  H   UNL     1       1.983  -3.893   2.257  1.00  0.00           H  
HETATM  104  H   UNL     1       0.304  -1.703   1.078  1.00  0.00           H  
HETATM  105  H   UNL     1      -0.299  -3.527  -0.469  1.00  0.00           H  
HETATM  106  H   UNL     1       1.862  -2.265  -0.755  1.00  0.00           H  
HETATM  107  H   UNL     1       2.690  -3.562   0.140  1.00  0.00           H  
HETATM  108  H   UNL     1       2.951  -5.769  -0.828  1.00  0.00           H  
HETATM  109  H   UNL     1       3.040  -6.114  -5.672  1.00  0.00           H  
HETATM  110  H   UNL     1       1.114  -3.985  -5.042  1.00  0.00           H  
HETATM  111  H   UNL     1       0.960  -2.665  -2.970  1.00  0.00           H  
HETATM  112  H   UNL     1      -5.849  -1.407  -2.481  1.00  0.00           H  
HETATM  113  H   UNL     1      -6.794  -1.919  -1.062  1.00  0.00           H  
HETATM  114  H   UNL     1      -7.626  -1.296  -2.508  1.00  0.00           H  
HETATM  115  H   UNL     1      -4.769   7.839  -0.235  1.00  0.00           H  
HETATM  116  H   UNL     1      -5.622   6.718  -1.323  1.00  0.00           H  
HETATM  117  H   UNL     1      -5.432   6.314   0.401  1.00  0.00           H  
HETATM  118  H   UNL     1       5.626   7.060  -1.421  1.00  0.00           H  
HETATM  119  H   UNL     1       4.276   8.053  -2.022  1.00  0.00           H  
HETATM  120  H   UNL     1       4.714   8.096  -0.298  1.00  0.00           H  
HETATM  121  H   UNL     1       6.493   3.629  -1.487  1.00  0.00           H  
HETATM  122  H   UNL     1       5.895   5.282  -1.767  1.00  0.00           H  
HETATM  123  H   UNL     1       6.850   4.916  -0.310  1.00  0.00           H  
HETATM  124  H   UNL     1       5.751  -1.929   0.386  1.00  0.00           H  
HETATM  125  H   UNL     1       6.077  -0.440  -0.534  1.00  0.00           H  
HETATM  126  H   UNL     1       7.127  -0.891   0.830  1.00  0.00           H  
HETATM  127  H   UNL     1       3.692  -4.223   2.843  1.00  0.00           H  
HETATM  128  H   UNL     1       5.295  -3.592   3.291  1.00  0.00           H  
HETATM  129  H   UNL     1       3.841  -3.009   4.136  1.00  0.00           H  
HETATM  130  H   UNL     1      -0.370  -5.370   1.162  1.00  0.00           H  
HETATM  131  H   UNL     1       0.749  -5.773  -0.163  1.00  0.00           H  
HETATM  132  H   UNL     1       1.388  -5.240   1.411  1.00  0.00           H  
HETATM  133  H   UNL     1      -3.208   3.648   1.251  1.00  0.00           H  
HETATM  134  H   UNL     1      -2.531   5.273   0.993  1.00  0.00           H  
HETATM  135  H   UNL     1       7.386   2.264  -1.475  1.00  0.00           H  
HETATM  136  H   UNL     1       7.688   0.734  -0.618  1.00  0.00           H  
HETATM  137  H   UNL     1       6.784   0.731  -2.150  1.00  0.00           H  
HETATM  138  H   UNL     1       4.355  -6.810  -1.250  1.00  0.00           H  
HETATM  139  H   UNL     1       2.785  -7.564  -0.887  1.00  0.00           H  
HETATM  140  H   UNL     1       4.134  -8.560  -1.482  1.00  0.00           H  
HETATM  141  H   UNL     1      -0.934   2.673   1.081  1.00  0.00           H  
HETATM  142  H   UNL     1      -0.257   4.299   0.823  1.00  0.00           H  
HETATM  143  H   UNL     1      -1.014   3.887   2.381  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    2    1   45                                                 
CONECT    3    1    1                                                 
CONECT    4    1    5    9   67                                       
CONECT    5    4    6   68   69                                       
CONECT    6    5    7   70   71                                       
CONECT    7    6    8   72   73                                       
CONECT    8    7    9   74   75                                       
CONECT    9    4    8   10                                            
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   16   17                                       
CONECT   15   14   20                                                 
CONECT   16   14   76                                                 
CONECT   17   14   18   56   77                                       
CONECT   18   17   19   78   79                                       
CONECT   19   18   20   80   81                                       
CONECT   20   15   19   21   82                                       
CONECT   21   20   22   83   84                                       
CONECT   22   21   23   24   85                                       
CONECT   23   22   63                                                 
CONECT   24   22   25   25   57                                       
CONECT   25   24   24   26   86                                       
CONECT   26   25   27   27   87                                       
CONECT   27   26   26   28   88                                       
CONECT   28   27   29   29   89                                       
CONECT   29   28   28   30   90                                       
CONECT   30   29   31   58   91                                       
CONECT   31   30   32   92   93                                       
CONECT   32   31   33   59   94                                       
CONECT   33   32   34   34   35                                       
CONECT   34   33   33                                                 
CONECT   35   33   36   37   95                                       
CONECT   36   35   64                                                 
CONECT   37   35   38   39   96                                       
CONECT   38   37   97                                                 
CONECT   39   37   40   60   98                                       
CONECT   40   39   41   99  100                                       
CONECT   41   40   42   61  101                                       
CONECT   42   41   43   43   44                                       
CONECT   43   42   42                                                 
CONECT   44   42   45  102  103                                       
CONECT   45    2   44   46  104                                       
CONECT   46   45   47   62  105                                       
CONECT   47   46   48  106  107                                       
CONECT   48   47   49   49   55                                       
CONECT   49   48   48   50  108                                       
CONECT   50   49   51   52   52                                       
CONECT   51   50   65                                                 
CONECT   52   50   50   53   54                                       
CONECT   53   52  109                                                 
CONECT   54   52   55   55  110                                       
CONECT   55   48   54   54  111                                       
CONECT   56   17  112  113  114                                       
CONECT   57   24  115  116  117                                       
CONECT   58   30  118  119  120                                       
CONECT   59   32  121  122  123                                       
CONECT   60   39  124  125  126                                       
CONECT   61   41  127  128  129                                       
CONECT   62   46  130  131  132                                       
CONECT   63   23   66  133  134                                       
CONECT   64   36  135  136  137                                       
CONECT   65   51  138  139  140                                       
CONECT   66   63  141  142  143                                       
CONECT   67    4                                                      
CONECT   68    5                                                      
CONECT   69    5                                                      
CONECT   70    6                                                      
CONECT   71    6                                                      
CONECT   72    7                                                      
CONECT   73    7                                                      
CONECT   74    8                                                      
CONECT   75    8                                                      
CONECT   76   16                                                      
CONECT   77   17                                                      
CONECT   78   18                                                      
CONECT   79   18                                                      
CONECT   80   19                                                      
CONECT   81   19                                                      
CONECT   82   20                                                      
CONECT   83   21                                                      
CONECT   84   21                                                      
CONECT   85   22                                                      
CONECT   86   25                                                      
CONECT   87   26                                                      
CONECT   88   27                                                      
CONECT   89   28                                                      
CONECT   90   29                                                      
CONECT   91   30                                                      
CONECT   92   31                                                      
CONECT   93   31                                                      
CONECT   94   32                                                      
CONECT   95   35                                                      
CONECT   96   37                                                      
CONECT   97   38                                                      
CONECT   98   39                                                      
CONECT   99   40                                                      
CONECT  100   40                                                      
CONECT  101   41                                                      
CONECT  102   44                                                      
CONECT  103   44                                                      
CONECT  104   45                                                      
CONECT  105   46                                                      
CONECT  106   47                                                      
CONECT  107   47                                                      
CONECT  108   49                                                      
CONECT  109   53                                                      
CONECT  110   54                                                      
CONECT  111   55                                                      
CONECT  112   56                                                      
CONECT  113   56                                                      
CONECT  114   56                                                      
CONECT  115   57                                                      
CONECT  116   57                                                      
CONECT  117   57                                                      
CONECT  118   58                                                      
CONECT  119   58                                                      
CONECT  120   58                                                      
CONECT  121   59                                                      
CONECT  122   59                                                      
CONECT  123   59                                                      
CONECT  124   60                                                      
CONECT  125   60                                                      
CONECT  126   60                                                      
CONECT  127   61                                                      
CONECT  128   61                                                      
CONECT  129   61                                                      
CONECT  130   62                                                      
CONECT  131   62                                                      
CONECT  132   62                                                      
CONECT  133   63                                                      
CONECT  134   63                                                      
CONECT  135   64                                                      
CONECT  136   64                                                      
CONECT  137   64                                                      
CONECT  138   65                                                      
CONECT  139   65                                                      
CONECT  140   65                                                      
CONECT  141   66                                                      
CONECT  142   66                                                      
CONECT  143   66                                                      
MASTER        0    0    0    0    0    0    0    0  143    0  143    0
END
