COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.604  -7.320  -0.148  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.822  -7.041   0.324  1.00  0.00           C  
HETATM    3  C   UNL     1       0.291  -6.608  -0.245  1.00  0.00           C  
HETATM    4  C   UNL     1       1.611  -6.446   0.326  1.00  0.00           C  
HETATM    5  C   UNL     1       3.973  -5.737   0.156  1.00  0.00           C  
HETATM    6  C   UNL     1       4.651  -7.097   0.340  1.00  0.00           C  
HETATM    7  C   UNL     1       5.159  -3.086   0.902  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.366   0.611   1.322  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.931  -0.720   0.706  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.926  -1.801   1.787  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.378  -3.107   1.210  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.994  -2.844   0.612  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.447  -4.140   0.007  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.025  -5.085   1.129  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.549  -4.888   3.470  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.070  -6.129   0.609  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.766  -6.010   0.812  1.00  0.00           C  
HETATM   18  C   UNL     1       2.596  -5.936  -0.420  1.00  0.00           C  
HETATM   19  C   UNL     1       4.804  -4.877  -0.802  1.00  0.00           C  
HETATM   20  C   UNL     1       4.587  -3.397  -0.482  1.00  0.00           C  
HETATM   21  C   UNL     1       5.280  -2.547  -1.515  1.00  0.00           C  
HETATM   22  C   UNL     1       5.913  -1.241  -1.106  1.00  0.00           C  
HETATM   23  C   UNL     1       5.817  -0.531   1.181  1.00  0.00           C  
HETATM   24  C   UNL     1       5.972  -0.300  -2.311  1.00  0.00           C  
HETATM   25  C   UNL     1       5.270   0.989  -1.973  1.00  0.00           C  
HETATM   26  C   UNL     1       5.407   1.582  -0.593  1.00  0.00           C  
HETATM   27  C   UNL     1       4.538   1.595  -2.874  1.00  0.00           C  
HETATM   28  C   UNL     1       3.831   2.880  -2.519  1.00  0.00           C  
HETATM   29  C   UNL     1       3.676   3.741  -3.774  1.00  0.00           C  
HETATM   30  C   UNL     1       2.468   2.558  -1.956  1.00  0.00           C  
HETATM   31  C   UNL     1       1.261   3.312  -2.446  1.00  0.00           C  
HETATM   32  C   UNL     1       0.057   2.992  -1.554  1.00  0.00           C  
HETATM   33  C   UNL     1       0.180   3.759  -0.236  1.00  0.00           C  
HETATM   34  C   UNL     1       1.381   3.232   0.551  1.00  0.00           C  
HETATM   35  C   UNL     1       1.247   3.637   2.020  1.00  0.00           C  
HETATM   36  C   UNL     1       1.137   5.160   2.121  1.00  0.00           C  
HETATM   37  C   UNL     1       1.003   5.565   3.591  1.00  0.00           C  
HETATM   38  C   UNL     1       2.233   5.089   4.366  1.00  0.00           C  
HETATM   39  C   UNL     1       2.342   3.566   4.265  1.00  0.00           C  
HETATM   40  C   UNL     1       3.232   2.818   6.360  1.00  0.00           C  
HETATM   41  C   UNL     1       2.477   3.161   2.795  1.00  0.00           C  
HETATM   42  C   UNL     1       0.375   5.248  -0.528  1.00  0.00           C  
HETATM   43  C   UNL     1      -2.333   3.054  -1.676  1.00  0.00           C  
HETATM   44  C   UNL     1      -3.611   3.404  -2.393  1.00  0.00           C  
HETATM   45  C   UNL     1      -4.023   4.833  -2.016  1.00  0.00           C  
HETATM   46  C   UNL     1      -5.377   5.145  -2.658  1.00  0.00           C  
HETATM   47  C   UNL     1      -6.438   4.175  -2.135  1.00  0.00           C  
HETATM   48  C   UNL     1      -6.057   2.745  -2.527  1.00  0.00           C  
HETATM   49  C   UNL     1      -4.480   1.401  -1.262  1.00  0.00           C  
HETATM   50  C   UNL     1      -5.597   0.443  -1.012  1.00  0.00           C  
HETATM   51  C   UNL     1      -5.532  -0.565   0.101  1.00  0.00           C  
HETATM   52  C   UNL     1       2.546  -0.594  -0.276  1.00  0.00           C  
HETATM   53  C   UNL     1       3.374  -1.864  -0.481  1.00  0.00           C  
HETATM   54  N   UNL     1      -4.690   2.480  -2.041  1.00  0.00           N  
HETATM   55  N   UNL     1       2.339   1.648  -1.066  1.00  0.00           N  
HETATM   56  O   UNL     1      -3.386  -4.333   2.163  1.00  0.00           O  
HETATM   57  O   UNL     1       5.135  -0.639  -0.070  1.00  0.00           O  
HETATM   58  O   UNL     1       7.336  -0.028  -2.637  1.00  0.00           O  
HETATM   59  O   UNL     1       2.107   5.468   5.738  1.00  0.00           O  
HETATM   60  O   UNL     1       3.491   3.122   4.988  1.00  0.00           O  
HETATM   61  O   UNL     1      -1.160   3.392  -2.237  1.00  0.00           O  
HETATM   62  O   UNL     1      -4.622  -0.117   1.110  1.00  0.00           O  
HETATM   63  O   UNL     1      -5.092  -1.832  -0.398  1.00  0.00           O  
HETATM   64  O   UNL     1      -6.574   0.478  -1.720  1.00  0.00           O  
HETATM   65  O   UNL     1      -3.388   1.210  -0.766  1.00  0.00           O  
HETATM   66  O   UNL     1      -2.363   2.480  -0.613  1.00  0.00           O  
HETATM   67  O   UNL     1       2.868   0.355  -1.295  1.00  0.00           O  
HETATM   68  O   UNL     1       5.329  -2.911  -2.665  1.00  0.00           O  
HETATM   69  H   UNL     1      -3.643  -7.087  -1.212  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.948  -8.176   0.012  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.606  -7.559   0.209  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.107  -8.037   0.523  1.00  0.00           H  
HETATM   73  H   UNL     1       0.200  -6.338  -1.320  1.00  0.00           H  
HETATM   74  H   UNL     1       1.816  -6.723   1.350  1.00  0.00           H  
HETATM   75  H   UNL     1       3.895  -5.235   1.121  1.00  0.00           H  
HETATM   76  H   UNL     1       5.648  -6.952   0.755  1.00  0.00           H  
HETATM   77  H   UNL     1       4.059  -7.708   1.022  1.00  0.00           H  
HETATM   78  H   UNL     1       4.727  -7.598  -0.625  1.00  0.00           H  
HETATM   79  H   UNL     1       4.956  -2.045   1.153  1.00  0.00           H  
HETATM   80  H   UNL     1       4.694  -3.736   1.642  1.00  0.00           H  
HETATM   81  H   UNL     1       6.236  -3.254   0.896  1.00  0.00           H  
HETATM   82  H   UNL     1      -6.670   0.889   2.113  1.00  0.00           H  
HETATM   83  H   UNL     1      -7.370   1.383   0.553  1.00  0.00           H  
HETATM   84  H   UNL     1      -8.368   0.508   1.739  1.00  0.00           H  
HETATM   85  H   UNL     1      -7.634  -1.002  -0.078  1.00  0.00           H  
HETATM   86  H   UNL     1      -6.298  -1.480   2.618  1.00  0.00           H  
HETATM   87  H   UNL     1      -7.944  -1.961   2.144  1.00  0.00           H  
HETATM   88  H   UNL     1      -6.298  -3.851   2.002  1.00  0.00           H  
HETATM   89  H   UNL     1      -7.050  -3.473   0.433  1.00  0.00           H  
HETATM   90  H   UNL     1      -4.318  -2.503   1.395  1.00  0.00           H  
HETATM   91  H   UNL     1      -5.222  -4.615  -0.596  1.00  0.00           H  
HETATM   92  H   UNL     1      -3.586  -3.914  -0.621  1.00  0.00           H  
HETATM   93  H   UNL     1      -4.908  -5.576   1.538  1.00  0.00           H  
HETATM   94  H   UNL     1      -4.610  -4.935   3.715  1.00  0.00           H  
HETATM   95  H   UNL     1      -3.126  -5.892   3.494  1.00  0.00           H  
HETATM   96  H   UNL     1      -3.036  -4.260   4.198  1.00  0.00           H  
HETATM   97  H   UNL     1      -1.366  -5.163   1.353  1.00  0.00           H  
HETATM   98  H   UNL     1       2.400  -5.668  -1.449  1.00  0.00           H  
HETATM   99  H   UNL     1       5.860  -5.122  -0.686  1.00  0.00           H  
HETATM  100  H   UNL     1       4.496  -5.076  -1.828  1.00  0.00           H  
HETATM  101  H   UNL     1       3.519  -3.178  -0.491  1.00  0.00           H  
HETATM  102  H   UNL     1       6.923  -1.426  -0.741  1.00  0.00           H  
HETATM  103  H   UNL     1       5.136  -0.133   1.933  1.00  0.00           H  
HETATM  104  H   UNL     1       6.165  -1.517   1.491  1.00  0.00           H  
HETATM  105  H   UNL     1       6.671   0.138   1.073  1.00  0.00           H  
HETATM  106  H   UNL     1       5.481  -0.769  -3.163  1.00  0.00           H  
HETATM  107  H   UNL     1       6.463   1.689  -0.347  1.00  0.00           H  
HETATM  108  H   UNL     1       4.927   2.561  -0.570  1.00  0.00           H  
HETATM  109  H   UNL     1       4.929   0.926   0.134  1.00  0.00           H  
HETATM  110  H   UNL     1       4.438   1.179  -3.864  1.00  0.00           H  
HETATM  111  H   UNL     1       4.414   3.423  -1.775  1.00  0.00           H  
HETATM  112  H   UNL     1       3.091   3.198  -4.517  1.00  0.00           H  
HETATM  113  H   UNL     1       3.165   4.669  -3.517  1.00  0.00           H  
HETATM  114  H   UNL     1       4.660   3.969  -4.183  1.00  0.00           H  
HETATM  115  H   UNL     1       1.463   4.382  -2.413  1.00  0.00           H  
HETATM  116  H   UNL     1       1.040   3.016  -3.472  1.00  0.00           H  
HETATM  117  H   UNL     1       0.027   1.922  -1.352  1.00  0.00           H  
HETATM  118  H   UNL     1      -0.728   3.620   0.351  1.00  0.00           H  
HETATM  119  H   UNL     1       1.417   2.145   0.475  1.00  0.00           H  
HETATM  120  H   UNL     1       2.298   3.654   0.140  1.00  0.00           H  
HETATM  121  H   UNL     1       0.352   3.180   2.443  1.00  0.00           H  
HETATM  122  H   UNL     1       2.032   5.617   1.699  1.00  0.00           H  
HETATM  123  H   UNL     1       0.261   5.498   1.569  1.00  0.00           H  
HETATM  124  H   UNL     1       0.925   6.650   3.663  1.00  0.00           H  
HETATM  125  H   UNL     1       0.108   5.107   4.013  1.00  0.00           H  
HETATM  126  H   UNL     1       3.128   5.547   3.943  1.00  0.00           H  
HETATM  127  H   UNL     1       1.448   3.109   4.687  1.00  0.00           H  
HETATM  128  H   UNL     1       2.858   3.708   6.866  1.00  0.00           H  
HETATM  129  H   UNL     1       2.487   2.025   6.422  1.00  0.00           H  
HETATM  130  H   UNL     1       4.154   2.488   6.840  1.00  0.00           H  
HETATM  131  H   UNL     1       2.555   2.077   2.723  1.00  0.00           H  
HETATM  132  H   UNL     1       3.372   3.619   2.373  1.00  0.00           H  
HETATM  133  H   UNL     1       1.214   5.377  -1.211  1.00  0.00           H  
HETATM  134  H   UNL     1      -0.530   5.651  -0.984  1.00  0.00           H  
HETATM  135  H   UNL     1       0.580   5.777   0.403  1.00  0.00           H  
HETATM  136  H   UNL     1      -3.438   3.367  -3.473  1.00  0.00           H  
HETATM  137  H   UNL     1      -4.106   4.915  -0.932  1.00  0.00           H  
HETATM  138  H   UNL     1      -3.276   5.537  -2.381  1.00  0.00           H  
HETATM  139  H   UNL     1      -5.668   6.167  -2.413  1.00  0.00           H  
HETATM  140  H   UNL     1      -5.297   5.042  -3.740  1.00  0.00           H  
HETATM  141  H   UNL     1      -6.495   4.251  -1.049  1.00  0.00           H  
HETATM  142  H   UNL     1      -7.406   4.426  -2.568  1.00  0.00           H  
HETATM  143  H   UNL     1      -6.752   2.041  -2.070  1.00  0.00           H  
HETATM  144  H   UNL     1      -6.089   2.641  -3.612  1.00  0.00           H  
HETATM  145  H   UNL     1       1.485  -0.839  -0.329  1.00  0.00           H  
HETATM  146  H   UNL     1       2.771  -0.167   0.702  1.00  0.00           H  
HETATM  147  H   UNL     1       3.582  -2.322   0.486  1.00  0.00           H  
HETATM  148  H   UNL     1       2.816  -2.565  -1.102  1.00  0.00           H  
HETATM  149  H   UNL     1       4.313  -1.610  -0.972  1.00  0.00           H  
HETATM  150  H   UNL     1       7.449   0.563  -3.393  1.00  0.00           H  
HETATM  151  H   UNL     1       2.033   6.422   5.878  1.00  0.00           H  
HETATM  152  H   UNL     1      -3.717   0.012   0.794  1.00  0.00           H  
CONECT    1   16   69   70   71                                       
CONECT    2   17    3    3   72                                       
CONECT    3    2    2    4   73                                       
CONECT    4    3   18   18   74                                       
CONECT    5   18   19    6   75                                       
CONECT    6    5   76   77   78                                       
CONECT    7   20   79   80   81                                       
CONECT    8    9   82   83   84                                       
CONECT    9    8   51   10   85                                       
CONECT   10    9   11   86   87                                       
CONECT   11   10   12   88   89                                       
CONECT   12   63   11   13   90                                       
CONECT   13   12   14   91   92                                       
CONECT   14   56   13   16   93                                       
CONECT   15   56   94   95   96                                       
CONECT   16   14    1   17   17                                       
CONECT   17   16   16    2   97                                       
CONECT   18    4    4    5   98                                       
CONECT   19   20    5   99  100                                       
CONECT   20    7   21   19  101                                       
CONECT   21   22   20   68   68                                       
CONECT   22   24   21   57  102                                       
CONECT   23   57  103  104  105                                       
CONECT   24   25   58   22  106                                       
CONECT   25   27   27   26   24                                       
CONECT   26   25  107  108  109                                       
CONECT   27   28   25   25  110                                       
CONECT   28   30   29   27  111                                       
CONECT   29   28  112  113  114                                       
CONECT   30   31   55   55   28                                       
CONECT   31   32   30  115  116                                       
CONECT   32   61   33   31  117                                       
CONECT   33   42   32   34  118                                       
CONECT   34   33   35  119  120                                       
CONECT   35   41   34   36  121                                       
CONECT   36   35   37  122  123                                       
CONECT   37   38   36  124  125                                       
CONECT   38   39   59   37  126                                       
CONECT   39   60   41   38  127                                       
CONECT   40   60  128  129  130                                       
CONECT   41   39   35  131  132                                       
CONECT   42   33  133  134  135                                       
CONECT   43   44   61   66   66                                       
CONECT   44   54   45   43  136                                       
CONECT   45   44   46  137  138                                       
CONECT   46   47   45  139  140                                       
CONECT   47   48   46  141  142                                       
CONECT   48   54   47  143  144                                       
CONECT   49   50   65   65   54                                       
CONECT   50   64   64   51   49                                       
CONECT   51   62   50    9   63                                       
CONECT   52   53   67  145  146                                       
CONECT   53   52  147  148  149                                       
CONECT   54   49   48   44                                            
CONECT   55   30   30   67                                            
CONECT   56   15   14                                                 
CONECT   57   22   23                                                 
CONECT   58   24  150                                                 
CONECT   59   38  151                                                 
CONECT   60   40   39                                                 
CONECT   61   43   32                                                 
CONECT   62   51  152                                                 
CONECT   63   51   12                                                 
CONECT   64   50   50                                                 
CONECT   65   49   49                                                 
CONECT   66   43   43                                                 
CONECT   67   55   52                                                 
CONECT   68   21   21                                                 
CONECT   69    1                                                      
CONECT   70    1                                                      
CONECT   71    1                                                      
CONECT   72    2                                                      
CONECT   73    3                                                      
CONECT   74    4                                                      
CONECT   75    5                                                      
CONECT   76    6                                                      
CONECT   77    6                                                      
CONECT   78    6                                                      
CONECT   79    7                                                      
CONECT   80    7                                                      
CONECT   81    7                                                      
CONECT   82    8                                                      
CONECT   83    8                                                      
CONECT   84    8                                                      
CONECT   85    9                                                      
CONECT   86   10                                                      
CONECT   87   10                                                      
CONECT   88   11                                                      
CONECT   89   11                                                      
CONECT   90   12                                                      
CONECT   91   13                                                      
CONECT   92   13                                                      
CONECT   93   14                                                      
CONECT   94   15                                                      
CONECT   95   15                                                      
CONECT   96   15                                                      
CONECT   97   17                                                      
CONECT   98   18                                                      
CONECT   99   19                                                      
CONECT  100   19                                                      
CONECT  101   20                                                      
CONECT  102   22                                                      
CONECT  103   23                                                      
CONECT  104   23                                                      
CONECT  105   23                                                      
CONECT  106   24                                                      
CONECT  107   26                                                      
CONECT  108   26                                                      
CONECT  109   26                                                      
CONECT  110   27                                                      
CONECT  111   28                                                      
CONECT  112   29                                                      
CONECT  113   29                                                      
CONECT  114   29                                                      
CONECT  115   31                                                      
CONECT  116   31                                                      
CONECT  117   32                                                      
CONECT  118   33                                                      
CONECT  119   34                                                      
CONECT  120   34                                                      
CONECT  121   35                                                      
CONECT  122   36                                                      
CONECT  123   36                                                      
CONECT  124   37                                                      
CONECT  125   37                                                      
CONECT  126   38                                                      
CONECT  127   39                                                      
CONECT  128   40                                                      
CONECT  129   40                                                      
CONECT  130   40                                                      
CONECT  131   41                                                      
CONECT  132   41                                                      
CONECT  133   42                                                      
CONECT  134   42                                                      
CONECT  135   42                                                      
CONECT  136   44                                                      
CONECT  137   45                                                      
CONECT  138   45                                                      
CONECT  139   46                                                      
CONECT  140   46                                                      
CONECT  141   47                                                      
CONECT  142   47                                                      
CONECT  143   48                                                      
CONECT  144   48                                                      
CONECT  145   52                                                      
CONECT  146   52                                                      
CONECT  147   53                                                      
CONECT  148   53                                                      
CONECT  149   53                                                      
CONECT  150   58                                                      
CONECT  151   59                                                      
CONECT  152   62                                                      
MASTER        0    0    0    0    0    0    0    0  152    0  152    0
END
