COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.416  -3.510   1.930  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.787  -3.481   2.609  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.888  -2.243   3.501  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.652  -0.900   4.414  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.793  -2.292   4.568  1.00  0.00           C  
HETATM    6  C   UNL     1       2.308  -2.970  -0.766  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.421  -2.321   3.890  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.320  -3.560   2.997  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.167  -3.696  -1.753  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.487  -3.162  -1.210  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.657  -3.462  -2.141  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.169  -3.974  -3.496  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.446  -2.202  -2.364  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.356  -1.772  -1.531  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.701  -2.528  -0.268  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.080  -0.477  -1.829  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.139   0.702  -1.584  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.975   1.391  -2.354  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.950   1.961  -1.424  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.052  -3.482  -0.707  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.614   2.936  -0.326  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.571   2.714   0.850  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.779   4.361  -0.858  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.009   5.346   0.026  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.679   6.721  -0.042  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.584   5.461  -0.458  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.566   5.391   0.390  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.186   5.498  -0.090  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.176   5.167   0.734  1.00  0.00           C  
HETATM   30  C   UNL     1       1.218   5.282   0.318  1.00  0.00           C  
HETATM   31  C   UNL     1       2.030   4.233   0.477  1.00  0.00           C  
HETATM   32  C   UNL     1       1.481   2.948   1.059  1.00  0.00           C  
HETATM   33  C   UNL     1       3.483   4.288   0.078  1.00  0.00           C  
HETATM   34  C   UNL     1       4.356   4.159   1.320  1.00  0.00           C  
HETATM   35  C   UNL     1       5.489   3.171   1.112  1.00  0.00           C  
HETATM   36  C   UNL     1      -0.017  -4.690   0.230  1.00  0.00           C  
HETATM   37  C   UNL     1       6.019   0.958   0.357  1.00  0.00           C  
HETATM   38  C   UNL     1       5.709  -0.105  -0.623  1.00  0.00           C  
HETATM   39  C   UNL     1       4.557  -0.997  -0.700  1.00  0.00           C  
HETATM   40  C   UNL     1       5.994  -2.941  -0.688  1.00  0.00           C  
HETATM   41  C   UNL     1       6.354  -3.770  -1.914  1.00  0.00           C  
HETATM   42  C   UNL     1       5.314  -4.844  -2.198  1.00  0.00           C  
HETATM   43  C   UNL     1       4.026  -4.612  -1.413  1.00  0.00           C  
HETATM   44  C   UNL     1       3.614  -3.134  -1.499  1.00  0.00           C  
HETATM   45  C   UNL     1       7.439   1.484   0.097  1.00  0.00           C  
HETATM   46  C   UNL     1       8.251   1.471   1.391  1.00  0.00           C  
HETATM   47  C   UNL     1       7.386   2.891  -0.490  1.00  0.00           C  
HETATM   48  C   UNL     1       6.704   3.852   0.482  1.00  0.00           C  
HETATM   49  C   UNL     1       3.575   5.492  -1.993  1.00  0.00           C  
HETATM   50  C   UNL     1       0.129  -5.971  -0.595  1.00  0.00           C  
HETATM   51  C   UNL     1      -2.967  -1.280   0.201  1.00  0.00           C  
HETATM   52  C   UNL     1      -1.315  -4.748   1.037  1.00  0.00           C  
HETATM   53  N   UNL     1       4.684  -2.302  -0.946  1.00  0.00           N  
HETATM   54  O   UNL     1       2.261  -2.524   0.352  1.00  0.00           O  
HETATM   55  O   UNL     1      -4.169  -2.216   4.135  1.00  0.00           O  
HETATM   56  O   UNL     1      -1.887  -1.136   5.402  1.00  0.00           O  
HETATM   57  O   UNL     1       1.208  -3.375  -1.420  1.00  0.00           O  
HETATM   58  O   UNL     1      -7.216  -0.372  -0.971  1.00  0.00           O  
HETATM   59  O   UNL     1      -4.252   0.848  -2.696  1.00  0.00           O  
HETATM   60  O   UNL     1      -6.867   2.194  -2.174  1.00  0.00           O  
HETATM   61  O   UNL     1       5.094   2.059   0.281  1.00  0.00           O  
HETATM   62  O   UNL     1       5.980   0.428   1.694  1.00  0.00           O  
HETATM   63  O   UNL     1       6.521  -0.250  -1.514  1.00  0.00           O  
HETATM   64  O   UNL     1       3.459  -0.550  -0.476  1.00  0.00           O  
HETATM   65  O   UNL     1       3.758   5.529  -0.576  1.00  0.00           O  
HETATM   66  O   UNL     1      -2.386  -1.744  -1.019  1.00  0.00           O  
HETATM   67  H   UNL     1      -1.292  -2.613   1.323  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.568  -3.446   1.849  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.911  -4.378   3.216  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.764  -1.346   2.895  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.953  -0.390   5.078  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.742  -0.341   3.483  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.628  -0.965   4.894  1.00  0.00           H  
HETATM   74  H   UNL     1      -1.917  -3.189   5.175  1.00  0.00           H  
HETATM   75  H   UNL     1      -0.297  -1.425   3.283  1.00  0.00           H  
HETATM   76  H   UNL     1       0.359  -2.357   4.650  1.00  0.00           H  
HETATM   77  H   UNL     1      -0.444  -4.457   3.604  1.00  0.00           H  
HETATM   78  H   UNL     1       0.656  -3.580   2.513  1.00  0.00           H  
HETATM   79  H   UNL     1      -1.238  -4.767  -1.948  1.00  0.00           H  
HETATM   80  H   UNL     1      -0.879  -3.162  -2.661  1.00  0.00           H  
HETATM   81  H   UNL     1      -2.688  -3.629  -0.236  1.00  0.00           H  
HETATM   82  H   UNL     1      -4.293  -4.229  -1.691  1.00  0.00           H  
HETATM   83  H   UNL     1      -2.594  -4.889  -3.353  1.00  0.00           H  
HETATM   84  H   UNL     1      -4.026  -4.179  -4.137  1.00  0.00           H  
HETATM   85  H   UNL     1      -2.538  -3.218  -3.964  1.00  0.00           H  
HETATM   86  H   UNL     1      -4.247  -1.620  -3.264  1.00  0.00           H  
HETATM   87  H   UNL     1      -5.024  -3.375  -0.155  1.00  0.00           H  
HETATM   88  H   UNL     1      -5.601  -1.865   0.591  1.00  0.00           H  
HETATM   89  H   UNL     1      -6.727  -2.890  -0.330  1.00  0.00           H  
HETATM   90  H   UNL     1      -6.406  -0.481  -2.869  1.00  0.00           H  
HETATM   91  H   UNL     1      -4.558   0.524  -0.678  1.00  0.00           H  
HETATM   92  H   UNL     1      -2.361   1.470  -3.251  1.00  0.00           H  
HETATM   93  H   UNL     1      -3.107   2.381  -1.916  1.00  0.00           H  
HETATM   94  H   UNL     1      -2.483   0.738  -1.633  1.00  0.00           H  
HETATM   95  H   UNL     1      -0.247  -2.574  -0.143  1.00  0.00           H  
HETATM   96  H   UNL     1      -4.590   2.780   0.002  1.00  0.00           H  
HETATM   97  H   UNL     1      -6.462   1.695   1.219  1.00  0.00           H  
HETATM   98  H   UNL     1      -6.333   3.417   1.649  1.00  0.00           H  
HETATM   99  H   UNL     1      -7.597   2.874   0.519  1.00  0.00           H  
HETATM  100  H   UNL     1      -5.398   4.412  -1.878  1.00  0.00           H  
HETATM  101  H   UNL     1      -6.837   4.624  -0.855  1.00  0.00           H  
HETATM  102  H   UNL     1      -5.007   4.997   1.057  1.00  0.00           H  
HETATM  103  H   UNL     1      -5.671   7.078  -1.072  1.00  0.00           H  
HETATM  104  H   UNL     1      -6.709   6.641   0.307  1.00  0.00           H  
HETATM  105  H   UNL     1      -5.135   7.422   0.590  1.00  0.00           H  
HETATM  106  H   UNL     1      -3.394   5.602  -1.514  1.00  0.00           H  
HETATM  107  H   UNL     1      -2.739   5.249   1.451  1.00  0.00           H  
HETATM  108  H   UNL     1      -0.982   5.821  -1.100  1.00  0.00           H  
HETATM  109  H   UNL     1      -0.404   4.824   1.740  1.00  0.00           H  
HETATM  110  H   UNL     1       1.575   6.164  -0.172  1.00  0.00           H  
HETATM  111  H   UNL     1       1.596   2.962   2.143  1.00  0.00           H  
HETATM  112  H   UNL     1       0.424   2.857   0.806  1.00  0.00           H  
HETATM  113  H   UNL     1       2.027   2.100   0.646  1.00  0.00           H  
HETATM  114  H   UNL     1       3.696   3.467  -0.606  1.00  0.00           H  
HETATM  115  H   UNL     1       4.786   5.138   1.555  1.00  0.00           H  
HETATM  116  H   UNL     1       3.756   3.839   2.171  1.00  0.00           H  
HETATM  117  H   UNL     1       5.781   2.768   2.091  1.00  0.00           H  
HETATM  118  H   UNL     1       0.830  -4.598   0.910  1.00  0.00           H  
HETATM  119  H   UNL     1       5.919  -3.584   0.189  1.00  0.00           H  
HETATM  120  H   UNL     1       6.754  -2.180  -0.524  1.00  0.00           H  
HETATM  121  H   UNL     1       6.423  -3.110  -2.780  1.00  0.00           H  
HETATM  122  H   UNL     1       7.319  -4.248  -1.749  1.00  0.00           H  
HETATM  123  H   UNL     1       5.086  -4.845  -3.263  1.00  0.00           H  
HETATM  124  H   UNL     1       5.725  -5.816  -1.923  1.00  0.00           H  
HETATM  125  H   UNL     1       3.230  -5.234  -1.824  1.00  0.00           H  
HETATM  126  H   UNL     1       4.189  -4.880  -0.367  1.00  0.00           H  
HETATM  127  H   UNL     1       3.465  -2.885  -2.556  1.00  0.00           H  
HETATM  128  H   UNL     1       7.939   0.826  -0.621  1.00  0.00           H  
HETATM  129  H   UNL     1       8.313   0.451   1.771  1.00  0.00           H  
HETATM  130  H   UNL     1       9.255   1.847   1.193  1.00  0.00           H  
HETATM  131  H   UNL     1       7.765   2.106   2.132  1.00  0.00           H  
HETATM  132  H   UNL     1       8.403   3.236  -0.689  1.00  0.00           H  
HETATM  133  H   UNL     1       6.838   2.868  -1.435  1.00  0.00           H  
HETATM  134  H   UNL     1       6.374   4.741  -0.063  1.00  0.00           H  
HETATM  135  H   UNL     1       7.403   4.159   1.261  1.00  0.00           H  
HETATM  136  H   UNL     1       4.241   4.746  -2.426  1.00  0.00           H  
HETATM  137  H   UNL     1       2.541   5.232  -2.219  1.00  0.00           H  
HETATM  138  H   UNL     1       3.804   6.471  -2.414  1.00  0.00           H  
HETATM  139  H   UNL     1      -0.686  -6.034  -1.315  1.00  0.00           H  
HETATM  140  H   UNL     1       1.082  -5.956  -1.124  1.00  0.00           H  
HETATM  141  H   UNL     1       0.095  -6.836   0.068  1.00  0.00           H  
HETATM  142  H   UNL     1      -2.938  -0.190   0.226  1.00  0.00           H  
HETATM  143  H   UNL     1      -4.002  -1.617   0.263  1.00  0.00           H  
HETATM  144  H   UNL     1      -2.404  -1.677   1.046  1.00  0.00           H  
HETATM  145  H   UNL     1      -1.318  -5.645   1.657  1.00  0.00           H  
HETATM  146  H   UNL     1      -2.165  -4.775   0.356  1.00  0.00           H  
HETATM  147  H   UNL     1      -1.221  -1.101   6.103  1.00  0.00           H  
HETATM  148  H   UNL     1      -7.855  -1.091  -1.073  1.00  0.00           H  
HETATM  149  H   UNL     1       5.123   0.059   1.945  1.00  0.00           H  
CONECT    1   52    8    2   67                                       
CONECT    2    1    3   68   69                                       
CONECT    3    2    5   55   70                                       
CONECT    4   55   71   72   73                                       
CONECT    5    7    3   56   74                                       
CONECT    6   44   57   54   54                                       
CONECT    7    8    5   75   76                                       
CONECT    8    1    7   77   78                                       
CONECT    9   10   20   79   80                                       
CONECT   10   66   11    9   81                                       
CONECT   11   12   10   13   82                                       
CONECT   12   11   83   84   85                                       
CONECT   13   11   14   14   86                                       
CONECT   14   13   13   15   16                                       
CONECT   15   14   87   88   89                                       
CONECT   16   14   17   58   90                                       
CONECT   17   19   16   59   91                                       
CONECT   18   59   92   93   94                                       
CONECT   19   21   60   60   17                                       
CONECT   20   57    9   36   95                                       
CONECT   21   22   23   19   96                                       
CONECT   22   21   97   98   99                                       
CONECT   23   24   21  100  101                                       
CONECT   24   26   25   23  102                                       
CONECT   25   24  103  104  105                                       
CONECT   26   27   27   24  106                                       
CONECT   27   28   26   26  107                                       
CONECT   28   29   29   27  108                                       
CONECT   29   30   28   28  109                                       
CONECT   30   31   31   29  110                                       
CONECT   31   32   33   30   30                                       
CONECT   32   31  111  112  113                                       
CONECT   33   65   31   34  114                                       
CONECT   34   33   35  115  116                                       
CONECT   35   34   61   48  117                                       
CONECT   36   20   50   52  118                                       
CONECT   37   62   61   38   45                                       
CONECT   38   63   63   37   39                                       
CONECT   39   38   53   64   64                                       
CONECT   40   41   53  119  120                                       
CONECT   41   40   42  121  122                                       
CONECT   42   41   43  123  124                                       
CONECT   43   42   44  125  126                                       
CONECT   44   53   43    6  127                                       
CONECT   45   37   47   46  128                                       
CONECT   46   45  129  130  131                                       
CONECT   47   48   45  132  133                                       
CONECT   48   35   47  134  135                                       
CONECT   49   65  136  137  138                                       
CONECT   50   36  139  140  141                                       
CONECT   51   66  142  143  144                                       
CONECT   52   36    1  145  146                                       
CONECT   53   40   39   44                                            
CONECT   54    6    6                                                 
CONECT   55    3    4                                                 
CONECT   56    5  147                                                 
CONECT   57    6   20                                                 
CONECT   58   16  148                                                 
CONECT   59   17   18                                                 
CONECT   60   19   19                                                 
CONECT   61   35   37                                                 
CONECT   62   37  149                                                 
CONECT   63   38   38                                                 
CONECT   64   39   39                                                 
CONECT   65   49   33                                                 
CONECT   66   51   10                                                 
CONECT   67    1                                                      
CONECT   68    2                                                      
CONECT   69    2                                                      
CONECT   70    3                                                      
CONECT   71    4                                                      
CONECT   72    4                                                      
CONECT   73    4                                                      
CONECT   74    5                                                      
CONECT   75    7                                                      
CONECT   76    7                                                      
CONECT   77    8                                                      
CONECT   78    8                                                      
CONECT   79    9                                                      
CONECT   80    9                                                      
CONECT   81   10                                                      
CONECT   82   11                                                      
CONECT   83   12                                                      
CONECT   84   12                                                      
CONECT   85   12                                                      
CONECT   86   13                                                      
CONECT   87   15                                                      
CONECT   88   15                                                      
CONECT   89   15                                                      
CONECT   90   16                                                      
CONECT   91   17                                                      
CONECT   92   18                                                      
CONECT   93   18                                                      
CONECT   94   18                                                      
CONECT   95   20                                                      
CONECT   96   21                                                      
CONECT   97   22                                                      
CONECT   98   22                                                      
CONECT   99   22                                                      
CONECT  100   23                                                      
CONECT  101   23                                                      
CONECT  102   24                                                      
CONECT  103   25                                                      
CONECT  104   25                                                      
CONECT  105   25                                                      
CONECT  106   26                                                      
CONECT  107   27                                                      
CONECT  108   28                                                      
CONECT  109   29                                                      
CONECT  110   30                                                      
CONECT  111   32                                                      
CONECT  112   32                                                      
CONECT  113   32                                                      
CONECT  114   33                                                      
CONECT  115   34                                                      
CONECT  116   34                                                      
CONECT  117   35                                                      
CONECT  118   36                                                      
CONECT  119   40                                                      
CONECT  120   40                                                      
CONECT  121   41                                                      
CONECT  122   41                                                      
CONECT  123   42                                                      
CONECT  124   42                                                      
CONECT  125   43                                                      
CONECT  126   43                                                      
CONECT  127   44                                                      
CONECT  128   45                                                      
CONECT  129   46                                                      
CONECT  130   46                                                      
CONECT  131   46                                                      
CONECT  132   47                                                      
CONECT  133   47                                                      
CONECT  134   48                                                      
CONECT  135   48                                                      
CONECT  136   49                                                      
CONECT  137   49                                                      
CONECT  138   49                                                      
CONECT  139   50                                                      
CONECT  140   50                                                      
CONECT  141   50                                                      
CONECT  142   51                                                      
CONECT  143   51                                                      
CONECT  144   51                                                      
CONECT  145   52                                                      
CONECT  146   52                                                      
CONECT  147   56                                                      
CONECT  148   58                                                      
CONECT  149   62                                                      
MASTER        0    0    0    0    0    0    0    0  149    0  149    0
END
