COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1    -113.905  26.570   8.720  1.00  0.00           C  
HETATM    2  C   UNL     1    -112.654  26.321   7.961  1.00  0.00           C  
HETATM    3  C   UNL     1    -111.435  26.693   8.490  1.00  0.00           C  
HETATM    4  C   UNL     1    -111.363  27.359   9.850  1.00  0.00           C  
HETATM    5  C   UNL     1    -112.768  28.221  11.899  1.00  0.00           C  
HETATM    6  C   UNL     1    -113.993  28.408  12.519  1.00  0.00           C  
HETATM    7  C   UNL     1    -115.248  28.019  11.964  1.00  0.00           C  
HETATM    8  C   UNL     1    -115.141  27.415  10.698  1.00  0.00           C  
HETATM    9  C   UNL     1    -113.865  27.224  10.057  1.00  0.00           C  
HETATM   10  C   UNL     1    -112.624  27.620  10.631  1.00  0.00           C  
HETATM   11  C   UNL     1    -111.902  28.763  12.868  1.00  0.00           C  
HETATM   12  C   UNL     1    -112.535  29.589  13.785  1.00  0.00           C  
HETATM   13  C   UNL     1    -111.867  29.461  15.145  1.00  0.00           C  
HETATM   14  C   UNL     1    -116.603  28.245  12.691  1.00  0.00           C  
HETATM   15  C   UNL     1    -113.272  26.419   5.531  1.00  0.00           C  
HETATM   16  C   UNL     1    -113.387  25.768   4.186  1.00  0.00           C  
HETATM   17  C   UNL     1    -113.743  26.575   3.120  1.00  0.00           C  
HETATM   18  C   UNL     1    -112.641  27.299   2.404  1.00  0.00           C  
HETATM   19  C   UNL     1    -111.630  27.873   3.198  1.00  0.00           C  
HETATM   20  C   UNL     1    -111.152  29.294   2.973  1.00  0.00           C  
HETATM   21  C   UNL     1    -111.460  30.067   4.238  1.00  0.00           C  
HETATM   22  C   UNL     1    -110.462  31.143   4.668  1.00  0.00           C  
HETATM   23  C   UNL     1    -111.047  31.924   5.845  1.00  0.00           C  
HETATM   24  C   UNL     1    -110.273  31.899   7.145  1.00  0.00           C  
HETATM   25  C   UNL     1    -110.855  32.949   8.104  1.00  0.00           C  
HETATM   26  C   UNL     1    -111.481  32.367   9.371  1.00  0.00           C  
HETATM   27  C   UNL     1    -111.265  33.262  10.582  1.00  0.00           C  
HETATM   28  C   UNL     1    -111.958  32.733  11.820  1.00  0.00           C  
HETATM   29  C   UNL     1    -112.003  31.364  12.109  1.00  0.00           C  
HETATM   30  C   UNL     1    -112.636  24.511   3.913  1.00  0.00           C  
HETATM   31  C   UNL     1    -109.726  29.187   2.561  1.00  0.00           C  
HETATM   32  C   UNL     1    -110.164  32.091   3.576  1.00  0.00           C  
HETATM   33  C   UNL     1    -108.811  32.128   6.864  1.00  0.00           C  
HETATM   34  C   UNL     1    -112.957  32.162   9.148  1.00  0.00           C  
HETATM   35  C   UNL     1    -109.743  35.058   7.693  1.00  0.00           C  
HETATM   36  C   UNL     1    -108.378  35.704   7.619  1.00  0.00           C  
HETATM   37  C   UNL     1    -111.706  35.532  11.267  1.00  0.00           C  
HETATM   38  N   UNL     1    -112.754  25.673   6.664  1.00  0.00           N  
HETATM   39  O   UNL     1    -110.258  26.445   7.755  1.00  0.00           O  
HETATM   40  C   UNL     1    -109.054  26.839   8.332  1.00  0.00           C  
HETATM   41  C   UNL     1    -109.002  27.455   9.589  1.00  0.00           C  
HETATM   42  N   UNL     1    -110.208  27.700  10.327  1.00  0.00           N  
HETATM   43  O   UNL     1    -114.980  26.235   8.237  1.00  0.00           O  
HETATM   44  O   UNL     1    -116.269  26.996  10.055  1.00  0.00           O  
HETATM   45  O   UNL     1    -113.886  29.082  13.878  1.00  0.00           O  
HETATM   46  O   UNL     1    -110.707  28.539  12.932  1.00  0.00           O  
HETATM   47  O   UNL     1    -112.544  30.933  13.362  1.00  0.00           O  
HETATM   48  O   UNL     1    -111.742  34.524  10.316  1.00  0.00           O  
HETATM   49  O   UNL     1    -109.890  33.880   8.408  1.00  0.00           O  
HETATM   50  O   UNL     1    -110.706  35.630   7.199  1.00  0.00           O  
HETATM   51  O   UNL     1    -112.320  31.471   6.081  1.00  0.00           O  
HETATM   52  O   UNL     1    -112.694  30.652   4.097  1.00  0.00           O  
HETATM   53  O   UNL     1    -113.609  27.588   5.678  1.00  0.00           O  
HETATM   54  C   UNL     1    -107.895  26.582   7.578  1.00  0.00           C  
HETATM   55  C   UNL     1    -106.670  26.944   8.085  1.00  0.00           C  
HETATM   56  C   UNL     1    -106.577  27.562   9.338  1.00  0.00           C  
HETATM   57  C   UNL     1    -107.738  27.818  10.092  1.00  0.00           C  
HETATM   58  O   UNL     1    -107.646  28.449  11.359  1.00  0.00           O  
HETATM   59  C   UNL     1    -106.690  29.461  11.580  1.00  0.00           C  
HETATM   60  C   UNL     1    -107.135  30.403  12.727  1.00  0.00           C  
HETATM   61  C   UNL     1    -106.623  29.881  14.090  1.00  0.00           C  
HETATM   62  C   UNL     1    -107.399  28.626  14.492  1.00  0.00           C  
HETATM   63  N   UNL     1    -104.643  26.819  17.061  1.00  0.00           N  
HETATM   64  C   UNL     1    -103.215  27.094  16.814  1.00  0.00           C  
HETATM   65  C   UNL     1    -103.005  27.536  15.361  1.00  0.00           C  
HETATM   66  C   UNL     1    -105.281  25.851  16.196  1.00  0.00           C  
HETATM   67  C   UNL     1    -106.464  26.375  15.390  1.00  0.00           C  
HETATM   68  N   UNL     1    -106.635  27.821  15.459  1.00  0.00           N  
HETATM   69  C   UNL     1    -106.753  28.195  16.885  1.00  0.00           C  
HETATM   70  C   UNL     1    -105.504  27.801  17.674  1.00  0.00           C  
HETATM   71  N   UNL     1    -101.467  24.676  13.678  1.00  0.00           N  
HETATM   72  C   UNL     1    -102.279  25.136  12.708  1.00  0.00           C  
HETATM   73  C   UNL     1    -102.950  26.242  13.202  1.00  0.00           C  
HETATM   74  N   UNL     1    -102.539  26.452  14.485  1.00  0.00           N  
HETATM   75  C   UNL     1    -101.616  25.492  14.783  1.00  0.00           C  
HETATM   76  H   UNL     1    -112.374  30.118  15.866  1.00  0.00           H  
HETATM   77  H   UNL     1    -111.934  28.418  15.489  1.00  0.00           H  
HETATM   78  H   UNL     1    -110.810  29.753  15.063  1.00  0.00           H  
HETATM   79  H   UNL     1    -116.836  27.369  13.314  1.00  0.00           H  
HETATM   80  H   UNL     1    -116.533  29.140  13.327  1.00  0.00           H  
HETATM   81  H   UNL     1    -117.400  28.387  11.946  1.00  0.00           H  
HETATM   82  H   UNL     1    -114.774  26.680   2.815  1.00  0.00           H  
HETATM   83  H   UNL     1    -112.624  27.376   1.327  1.00  0.00           H  
HETATM   84  H   UNL     1    -111.184  27.286   3.987  1.00  0.00           H  
HETATM   85  H   UNL     1    -111.730  29.731   2.146  1.00  0.00           H  
HETATM   86  H   UNL     1    -111.508  29.334   5.057  1.00  0.00           H  
HETATM   87  H   UNL     1    -109.532  30.654   4.994  1.00  0.00           H  
HETATM   88  H   UNL     1    -111.102  32.976   5.528  1.00  0.00           H  
HETATM   89  H   UNL     1    -110.392  30.907   7.605  1.00  0.00           H  
HETATM   90  H   UNL     1    -111.666  33.454   7.558  1.00  0.00           H  
HETATM   91  H   UNL     1    -111.016  31.390   9.571  1.00  0.00           H  
HETATM   92  H   UNL     1    -110.185  33.303  10.786  1.00  0.00           H  
HETATM   93  H   UNL     1    -112.430  33.430  12.497  1.00  0.00           H  
HETATM   94  H   UNL     1    -111.634  30.642  11.395  1.00  0.00           H  
HETATM   95  H   UNL     1    -112.433  23.991   4.861  1.00  0.00           H  
HETATM   96  H   UNL     1    -113.235  23.861   3.259  1.00  0.00           H  
HETATM   97  H   UNL     1    -111.685  24.753   3.417  1.00  0.00           H  
HETATM   98  H   UNL     1    -109.319  30.193   2.382  1.00  0.00           H  
HETATM   99  H   UNL     1    -109.150  28.695   3.359  1.00  0.00           H  
HETATM  100  H   UNL     1    -109.655  28.593   1.638  1.00  0.00           H  
HETATM  101  H   UNL     1    -109.445  32.844   3.930  1.00  0.00           H  
HETATM  102  H   UNL     1    -109.734  31.545   2.724  1.00  0.00           H  
HETATM  103  H   UNL     1    -111.092  32.590   3.261  1.00  0.00           H  
HETATM  104  H   UNL     1    -108.248  32.110   7.809  1.00  0.00           H  
HETATM  105  H   UNL     1    -108.437  31.335   6.199  1.00  0.00           H  
HETATM  106  H   UNL     1    -108.680  33.106   6.378  1.00  0.00           H  
HETATM  107  H   UNL     1    -113.411  31.743  10.058  1.00  0.00           H  
HETATM  108  H   UNL     1    -113.430  33.127   8.913  1.00  0.00           H  
HETATM  109  H   UNL     1    -113.108  31.466   8.309  1.00  0.00           H  
HETATM  110  H   UNL     1    -108.455  36.667   7.092  1.00  0.00           H  
HETATM  111  H   UNL     1    -107.997  35.873   8.637  1.00  0.00           H  
HETATM  112  H   UNL     1    -107.688  35.042   7.074  1.00  0.00           H  
HETATM  113  H   UNL     1    -112.136  36.452  10.844  1.00  0.00           H  
HETATM  114  H   UNL     1    -112.290  35.226  12.148  1.00  0.00           H  
HETATM  115  H   UNL     1    -110.663  35.718  11.565  1.00  0.00           H  
HETATM  116  H   UNL     1    -112.468  24.721   6.553  1.00  0.00           H  
HETATM  117  H   UNL     1    -116.033  26.612   9.219  1.00  0.00           H  
HETATM  118  H   UNL     1    -112.696  31.948   6.811  1.00  0.00           H  
HETATM  119  H   UNL     1    -112.904  31.142   4.883  1.00  0.00           H  
HETATM  120  H   UNL     1    -107.967  26.105   6.611  1.00  0.00           H  
HETATM  121  H   UNL     1    -105.774  26.751   7.514  1.00  0.00           H  
HETATM  122  H   UNL     1    -105.610  27.844   9.728  1.00  0.00           H  
HETATM  123  H   UNL     1    -105.730  28.997  11.848  1.00  0.00           H  
HETATM  124  H   UNL     1    -106.568  30.049  10.658  1.00  0.00           H  
HETATM  125  H   UNL     1    -106.726  31.408  12.548  1.00  0.00           H  
HETATM  126  H   UNL     1    -108.234  30.452  12.748  1.00  0.00           H  
HETATM  127  H   UNL     1    -105.553  29.638  14.009  1.00  0.00           H  
HETATM  128  H   UNL     1    -106.765  30.659  14.855  1.00  0.00           H  
HETATM  129  H   UNL     1    -108.355  28.924  14.948  1.00  0.00           H  
HETATM  130  H   UNL     1    -107.594  28.021  13.594  1.00  0.00           H  
HETATM  131  H   UNL     1    -102.631  26.181  17.004  1.00  0.00           H  
HETATM  132  H   UNL     1    -102.877  27.893  17.490  1.00  0.00           H  
HETATM  133  H   UNL     1    -102.257  28.343  15.346  1.00  0.00           H  
HETATM  134  H   UNL     1    -103.961  27.915  14.970  1.00  0.00           H  
HETATM  135  H   UNL     1    -105.638  25.020  16.822  1.00  0.00           H  
HETATM  136  H   UNL     1    -104.526  25.479  15.488  1.00  0.00           H  
HETATM  137  H   UNL     1    -107.380  25.900  15.771  1.00  0.00           H  
HETATM  138  H   UNL     1    -106.316  26.094  14.337  1.00  0.00           H  
HETATM  139  H   UNL     1    -106.893  29.284  16.958  1.00  0.00           H  
HETATM  140  H   UNL     1    -107.625  27.683  17.318  1.00  0.00           H  
HETATM  141  H   UNL     1    -104.910  28.712  17.837  1.00  0.00           H  
HETATM  142  H   UNL     1    -105.833  27.399  18.644  1.00  0.00           H  
HETATM  143  H   UNL     1    -102.388  24.716  11.719  1.00  0.00           H  
HETATM  144  H   UNL     1    -103.674  26.836  12.664  1.00  0.00           H  
HETATM  145  H   UNL     1    -101.092  25.388  15.722  1.00  0.00           H  
CONECT    1    2   43   43    9                                       
CONECT    2   38    3    3    1                                       
CONECT    3   39    2    2    4                                       
CONECT    4    3   42   42   10                                       
CONECT    5   10    6    6   11                                       
CONECT    6    5    5    7   45                                       
CONECT    7    8    8    6   14                                       
CONECT    8   44    9    7    7                                       
CONECT    9    1   10   10    8                                       
CONECT   10    4    9    9    5                                       
CONECT   11    5   46   46   12                                       
CONECT   12   11   47   45   13                                       
CONECT   13   12   76   77   78                                       
CONECT   14    7   79   80   81                                       
CONECT   15   16   53   53   38                                       
CONECT   16   17   17   30   15                                       
CONECT   17   18   16   16   82                                       
CONECT   18   17   19   19   83                                       
CONECT   19   18   18   20   84                                       
CONECT   20   31   19   21   85                                       
CONECT   21   20   52   22   86                                       
CONECT   22   32   21   23   87                                       
CONECT   23   22   51   24   88                                       
CONECT   24   23   33   25   89                                       
CONECT   25   24   49   26   90                                       
CONECT   26   25   34   27   91                                       
CONECT   27   26   48   28   92                                       
CONECT   28   27   29   29   93                                       
CONECT   29   28   28   47   94                                       
CONECT   30   16   95   96   97                                       
CONECT   31   20   98   99  100                                       
CONECT   32   22  101  102  103                                       
CONECT   33   24  104  105  106                                       
CONECT   34   26  107  108  109                                       
CONECT   35   50   50   36   49                                       
CONECT   36   35  110  111  112                                       
CONECT   37   48  113  114  115                                       
CONECT   38   15    2  116                                            
CONECT   39   40    3                                                 
CONECT   40   54   39   41   41                                       
CONECT   41   40   40   57   42                                       
CONECT   42   41    4    4                                            
CONECT   43    1    1                                                 
CONECT   44    8  117                                                 
CONECT   45    6   12                                                 
CONECT   46   11   11                                                 
CONECT   47   29   12                                                 
CONECT   48   27   37                                                 
CONECT   49   35   25                                                 
CONECT   50   35   35                                                 
CONECT   51   23  118                                                 
CONECT   52   21  119                                                 
CONECT   53   15   15                                                 
CONECT   54   55   55   40  120                                       
CONECT   55   54   54   56  121                                       
CONECT   56   55   57   57  122                                       
CONECT   57   56   56   41   58                                       
CONECT   58   57   59                                                 
CONECT   59   58   60  123  124                                       
CONECT   60   59   61  125  126                                       
CONECT   61   60   62  127  128                                       
CONECT   62   61   68  129  130                                       
CONECT   63   66   64   70                                            
CONECT   64   65   63  131  132                                       
CONECT   65   74   64  133  134                                       
CONECT   66   67   63  135  136                                       
CONECT   67   68   66  137  138                                       
CONECT   68   62   67   69                                            
CONECT   69   68   70  139  140                                       
CONECT   70   69   63  141  142                                       
CONECT   71   72   75   75                                            
CONECT   72   73   73   71  143                                       
CONECT   73   72   72   74  144                                       
CONECT   74   73   75   65                                            
CONECT   75   71   71   74  145                                       
CONECT   76   13                                                      
CONECT   77   13                                                      
CONECT   78   13                                                      
CONECT   79   14                                                      
CONECT   80   14                                                      
CONECT   81   14                                                      
CONECT   82   17                                                      
CONECT   83   18                                                      
CONECT   84   19                                                      
CONECT   85   20                                                      
CONECT   86   21                                                      
CONECT   87   22                                                      
CONECT   88   23                                                      
CONECT   89   24                                                      
CONECT   90   25                                                      
CONECT   91   26                                                      
CONECT   92   27                                                      
CONECT   93   28                                                      
CONECT   94   29                                                      
CONECT   95   30                                                      
CONECT   96   30                                                      
CONECT   97   30                                                      
CONECT   98   31                                                      
CONECT   99   31                                                      
CONECT  100   31                                                      
CONECT  101   32                                                      
CONECT  102   32                                                      
CONECT  103   32                                                      
CONECT  104   33                                                      
CONECT  105   33                                                      
CONECT  106   33                                                      
CONECT  107   34                                                      
CONECT  108   34                                                      
CONECT  109   34                                                      
CONECT  110   36                                                      
CONECT  111   36                                                      
CONECT  112   36                                                      
CONECT  113   37                                                      
CONECT  114   37                                                      
CONECT  115   37                                                      
CONECT  116   38                                                      
CONECT  117   44                                                      
CONECT  118   51                                                      
CONECT  119   52                                                      
CONECT  120   54                                                      
CONECT  121   55                                                      
CONECT  122   56                                                      
CONECT  123   59                                                      
CONECT  124   59                                                      
CONECT  125   60                                                      
CONECT  126   60                                                      
CONECT  127   61                                                      
CONECT  128   61                                                      
CONECT  129   62                                                      
CONECT  130   62                                                      
CONECT  131   64                                                      
CONECT  132   64                                                      
CONECT  133   65                                                      
CONECT  134   65                                                      
CONECT  135   66                                                      
CONECT  136   66                                                      
CONECT  137   67                                                      
CONECT  138   67                                                      
CONECT  139   69                                                      
CONECT  140   69                                                      
CONECT  141   70                                                      
CONECT  142   70                                                      
CONECT  143   72                                                      
CONECT  144   73                                                      
CONECT  145   75                                                      
MASTER        0    0    0    0    0    0    0    0  145    0  145    0
END
