COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      12.189   0.452  -0.515  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.633   2.062   0.076  1.00  0.00           C  
HETATM    3  C   UNL     1     -11.537   0.857  -0.083  1.00  0.00           C  
HETATM    4  C   UNL     1       0.859   2.132  -0.095  1.00  0.00           C  
HETATM    5  C   UNL     1     -12.683  -0.021   0.425  1.00  0.00           C  
HETATM    6  C   UNL     1     -13.965   0.327  -0.333  1.00  0.00           C  
HETATM    7  C   UNL     1     -15.111  -0.551   0.175  1.00  0.00           C  
HETATM    8  C   UNL     1       2.160   1.506   0.410  1.00  0.00           C  
HETATM    9  C   UNL     1       3.344   2.107  -0.350  1.00  0.00           C  
HETATM   10  C   UNL     1       4.646   1.482   0.155  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.346   1.588   2.320  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.308   1.205   0.839  1.00  0.00           C  
HETATM   13  C   UNL     1     -16.363  -0.292  -0.667  1.00  0.00           C  
HETATM   14  C   UNL     1     -10.419   0.874   2.152  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.234   1.922   2.142  1.00  0.00           C  
HETATM   16  C   UNL     1       5.817   1.989  -0.689  1.00  0.00           C  
HETATM   17  C   UNL     1     -17.472  -1.257  -0.241  1.00  0.00           C  
HETATM   18  C   UNL     1     -15.402  -0.213   1.638  1.00  0.00           C  
HETATM   19  C   UNL     1      12.606  -3.325   0.100  1.00  0.00           C  
HETATM   20  C   UNL     1      11.219  -3.525   0.716  1.00  0.00           C  
HETATM   21  C   UNL     1      12.959  -1.834   0.138  1.00  0.00           C  
HETATM   22  C   UNL     1      10.203  -2.668  -0.044  1.00  0.00           C  
HETATM   23  C   UNL     1     -10.254   0.509   0.675  1.00  0.00           C  
HETATM   24  C   UNL     1       4.865   1.872   1.618  1.00  0.00           C  
HETATM   25  C   UNL     1      11.876  -1.043  -0.600  1.00  0.00           C  
HETATM   26  C   UNL     1       7.099   1.271  -0.266  1.00  0.00           C  
HETATM   27  C   UNL     1     -18.723  -0.998  -1.083  1.00  0.00           C  
HETATM   28  C   UNL     1     -19.832  -1.963  -0.657  1.00  0.00           C  
HETATM   29  C   UNL     1       8.270   1.778  -1.110  1.00  0.00           C  
HETATM   30  C   UNL     1       8.824  -2.817   0.603  1.00  0.00           C  
HETATM   31  C   UNL     1     -21.083  -1.705  -1.499  1.00  0.00           C  
HETATM   32  C   UNL     1     -22.192  -2.670  -1.073  1.00  0.00           C  
HETATM   33  C   UNL     1     -23.443  -2.411  -1.915  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.610   1.644   0.166  1.00  0.00           C  
HETATM   35  C   UNL     1      -4.125   1.900   0.163  1.00  0.00           C  
HETATM   36  C   UNL     1      -0.325   1.531   0.665  1.00  0.00           C  
HETATM   37  C   UNL     1      -9.083   1.296   0.083  1.00  0.00           C  
HETATM   38  C   UNL     1      -7.781   0.857   0.757  1.00  0.00           C  
HETATM   39  C   UNL     1      -2.817   1.368   0.752  1.00  0.00           C  
HETATM   40  F   UNL     1      12.223   0.846   0.826  1.00  0.00           F  
HETATM   41  F   UNL     1      13.433   0.702  -1.106  1.00  0.00           F  
HETATM   42  O   UNL     1      10.606  -1.298   0.004  1.00  0.00           O  
HETATM   43  O   UNL     1      13.573  -4.065   0.848  1.00  0.00           O  
HETATM   44  O   UNL     1      10.848  -4.902   0.621  1.00  0.00           O  
HETATM   45  O   UNL     1      13.031  -1.395   1.495  1.00  0.00           O  
HETATM   46  O   UNL     1       9.468   1.107  -0.715  1.00  0.00           O  
HETATM   47  O   UNL     1       7.854  -2.112  -0.174  1.00  0.00           O  
HETATM   48  O   UNL     1      11.203   2.841  -1.312  1.00  0.00           O  
HETATM   49  O   UNL     1      10.861   0.941  -2.938  1.00  0.00           O  
HETATM   50  P   UNL     1      10.899   1.394  -1.394  1.00  0.00           P  
HETATM   51  H   UNL     1      -1.697   3.137   0.246  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.657   1.862  -0.995  1.00  0.00           H  
HETATM   53  H   UNL     1     -11.388   0.680  -1.148  1.00  0.00           H  
HETATM   54  H   UNL     1     -11.782   1.906   0.081  1.00  0.00           H  
HETATM   55  H   UNL     1       0.886   3.209   0.068  1.00  0.00           H  
HETATM   56  H   UNL     1       0.747   1.928  -1.160  1.00  0.00           H  
HETATM   57  H   UNL     1     -12.437  -1.070   0.261  1.00  0.00           H  
HETATM   58  H   UNL     1     -12.831   0.156   1.490  1.00  0.00           H  
HETATM   59  H   UNL     1     -14.211   1.376  -0.170  1.00  0.00           H  
HETATM   60  H   UNL     1     -13.817   0.150  -1.398  1.00  0.00           H  
HETATM   61  H   UNL     1     -14.829  -1.600   0.093  1.00  0.00           H  
HETATM   62  H   UNL     1       2.272   1.709   1.475  1.00  0.00           H  
HETATM   63  H   UNL     1       2.133   0.429   0.247  1.00  0.00           H  
HETATM   64  H   UNL     1       3.233   1.904  -1.416  1.00  0.00           H  
HETATM   65  H   UNL     1       3.371   3.185  -0.187  1.00  0.00           H  
HETATM   66  H   UNL     1       4.583   0.397   0.073  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.189   1.093   2.802  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.419   1.275   2.800  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.457   2.668   2.413  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.197   0.125   0.746  1.00  0.00           H  
HETATM   71  H   UNL     1     -16.697   0.734  -0.515  1.00  0.00           H  
HETATM   72  H   UNL     1     -16.131  -0.447  -1.720  1.00  0.00           H  
HETATM   73  H   UNL     1      -9.505   0.626   2.692  1.00  0.00           H  
HETATM   74  H   UNL     1     -10.617   1.942   2.242  1.00  0.00           H  
HETATM   75  H   UNL     1     -11.254   0.313   2.573  1.00  0.00           H  
HETATM   76  H   UNL     1      -0.258   3.008   2.232  1.00  0.00           H  
HETATM   77  H   UNL     1      -1.078   1.493   2.683  1.00  0.00           H  
HETATM   78  H   UNL     1       0.697   1.543   2.561  1.00  0.00           H  
HETATM   79  H   UNL     1       5.619   1.790  -1.742  1.00  0.00           H  
HETATM   80  H   UNL     1       5.935   3.062  -0.538  1.00  0.00           H  
HETATM   81  H   UNL     1     -17.138  -2.283  -0.393  1.00  0.00           H  
HETATM   82  H   UNL     1     -17.704  -1.102   0.812  1.00  0.00           H  
HETATM   83  H   UNL     1     -14.510  -0.397   2.238  1.00  0.00           H  
HETATM   84  H   UNL     1     -15.684   0.836   1.720  1.00  0.00           H  
HETATM   85  H   UNL     1     -16.219  -0.838   2.000  1.00  0.00           H  
HETATM   86  H   UNL     1      12.600  -3.672  -0.933  1.00  0.00           H  
HETATM   87  H   UNL     1      11.238  -3.225   1.764  1.00  0.00           H  
HETATM   88  H   UNL     1      13.921  -1.675  -0.349  1.00  0.00           H  
HETATM   89  H   UNL     1      10.154  -2.997  -1.082  1.00  0.00           H  
HETATM   90  H   UNL     1     -10.056  -0.559   0.585  1.00  0.00           H  
HETATM   91  H   UNL     1       4.927   2.957   1.699  1.00  0.00           H  
HETATM   92  H   UNL     1       4.030   1.510   2.219  1.00  0.00           H  
HETATM   93  H   UNL     1       5.792   1.426   1.978  1.00  0.00           H  
HETATM   94  H   UNL     1      11.850  -1.350  -1.646  1.00  0.00           H  
HETATM   95  H   UNL     1       7.297   1.470   0.787  1.00  0.00           H  
HETATM   96  H   UNL     1       6.981   0.198  -0.417  1.00  0.00           H  
HETATM   97  H   UNL     1     -19.057   0.028  -0.931  1.00  0.00           H  
HETATM   98  H   UNL     1     -18.491  -1.153  -2.136  1.00  0.00           H  
HETATM   99  H   UNL     1     -19.498  -2.990  -0.809  1.00  0.00           H  
HETATM  100  H   UNL     1     -20.064  -1.808   0.396  1.00  0.00           H  
HETATM  101  H   UNL     1       8.073   1.579  -2.163  1.00  0.00           H  
HETATM  102  H   UNL     1       8.389   2.851  -0.959  1.00  0.00           H  
HETATM  103  H   UNL     1       8.556  -3.873   0.647  1.00  0.00           H  
HETATM  104  H   UNL     1       8.850  -2.407   1.612  1.00  0.00           H  
HETATM  105  H   UNL     1     -21.417  -0.678  -1.347  1.00  0.00           H  
HETATM  106  H   UNL     1     -20.851  -1.860  -2.552  1.00  0.00           H  
HETATM  107  H   UNL     1     -21.858  -3.696  -1.225  1.00  0.00           H  
HETATM  108  H   UNL     1     -22.424  -2.515  -0.020  1.00  0.00           H  
HETATM  109  H   UNL     1     -23.777  -1.385  -1.763  1.00  0.00           H  
HETATM  110  H   UNL     1     -23.211  -2.566  -2.968  1.00  0.00           H  
HETATM  111  H   UNL     1     -24.233  -3.099  -1.612  1.00  0.00           H  
HETATM  112  H   UNL     1      -6.766   2.710   0.335  1.00  0.00           H  
HETATM  113  H   UNL     1      -6.547   1.452  -0.906  1.00  0.00           H  
HETATM  114  H   UNL     1      -4.149   1.699  -0.908  1.00  0.00           H  
HETATM  115  H   UNL     1      -4.189   2.975   0.333  1.00  0.00           H  
HETATM  116  H   UNL     1      -0.301   0.444   0.575  1.00  0.00           H  
HETATM  117  H   UNL     1      -9.020   1.104  -0.988  1.00  0.00           H  
HETATM  118  H   UNL     1      -9.238   2.362   0.253  1.00  0.00           H  
HETATM  119  H   UNL     1      -7.626  -0.208   0.587  1.00  0.00           H  
HETATM  120  H   UNL     1      -7.844   1.049   1.828  1.00  0.00           H  
HETATM  121  H   UNL     1      -2.752   0.293   0.583  1.00  0.00           H  
HETATM  122  H   UNL     1      -2.792   1.569   1.823  1.00  0.00           H  
HETATM  123  H   UNL     1      13.408  -5.018   0.868  1.00  0.00           H  
HETATM  124  H   UNL     1       9.978  -5.102   0.992  1.00  0.00           H  
HETATM  125  H   UNL     1      13.698  -1.855   2.023  1.00  0.00           H  
HETATM  126  H   UNL     1       6.955  -2.163   0.178  1.00  0.00           H  
HETATM  127  H   UNL     1      10.667   0.002  -3.068  1.00  0.00           H  
CONECT    1   41   50   40   25                                       
CONECT    2   39   36   51   52                                       
CONECT    3    5   23   53   54                                       
CONECT    4   36    8   55   56                                       
CONECT    5    6    3   57   58                                       
CONECT    6    7    5   59   60                                       
CONECT    7   13   18    6   61                                       
CONECT    8    4    9   62   63                                       
CONECT    9    8   10   64   65                                       
CONECT   10    9   24   16   66                                       
CONECT   11   12   67   68   69                                       
CONECT   12   11   35   34   70                                       
CONECT   13   17    7   71   72                                       
CONECT   14   23   73   74   75                                       
CONECT   15   36   76   77   78                                       
CONECT   16   10   26   79   80                                       
CONECT   17   13   27   81   82                                       
CONECT   18    7   83   84   85                                       
CONECT   19   43   20   21   86                                       
CONECT   20   44   19   22   87                                       
CONECT   21   45   25   19   88                                       
CONECT   22   20   30   42   89                                       
CONECT   23    3   37   14   90                                       
CONECT   24   10   91   92   93                                       
CONECT   25    1   21   42   94                                       
CONECT   26   16   29   95   96                                       
CONECT   27   17   28   97   98                                       
CONECT   28   27   31   99  100                                       
CONECT   29   26   46  101  102                                       
CONECT   30   22   47  103  104                                       
CONECT   31   28   32  105  106                                       
CONECT   32   33   31  107  108                                       
CONECT   33   32  109  110  111                                       
CONECT   34   12   38  112  113                                       
CONECT   35   39   12  114  115                                       
CONECT   36   15    2    4  116                                       
CONECT   37   23   38  117  118                                       
CONECT   38   37   34  119  120                                       
CONECT   39    2   35  121  122                                       
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42   25   22                                                 
CONECT   43   19  123                                                 
CONECT   44   20  124                                                 
CONECT   45   21  125                                                 
CONECT   46   29   50                                                 
CONECT   47   30  126                                                 
CONECT   48   50   50                                                 
CONECT   49   50  127                                                 
CONECT   50   46    1   48   48                                       
CONECT   50   49                                                      
CONECT   51    2                                                      
CONECT   52    2                                                      
CONECT   53    3                                                      
CONECT   54    3                                                      
CONECT   55    4                                                      
CONECT   56    4                                                      
CONECT   57    5                                                      
CONECT   58    5                                                      
CONECT   59    6                                                      
CONECT   60    6                                                      
CONECT   61    7                                                      
CONECT   62    8                                                      
CONECT   63    8                                                      
CONECT   64    9                                                      
CONECT   65    9                                                      
CONECT   66   10                                                      
CONECT   67   11                                                      
CONECT   68   11                                                      
CONECT   69   11                                                      
CONECT   70   12                                                      
CONECT   71   13                                                      
CONECT   72   13                                                      
CONECT   73   14                                                      
CONECT   74   14                                                      
CONECT   75   14                                                      
CONECT   76   15                                                      
CONECT   77   15                                                      
CONECT   78   15                                                      
CONECT   79   16                                                      
CONECT   80   16                                                      
CONECT   81   17                                                      
CONECT   82   17                                                      
CONECT   83   18                                                      
CONECT   84   18                                                      
CONECT   85   18                                                      
CONECT   86   19                                                      
CONECT   87   20                                                      
CONECT   88   21                                                      
CONECT   89   22                                                      
CONECT   90   23                                                      
CONECT   91   24                                                      
CONECT   92   24                                                      
CONECT   93   24                                                      
CONECT   94   25                                                      
CONECT   95   26                                                      
CONECT   96   26                                                      
CONECT   97   27                                                      
CONECT   98   27                                                      
CONECT   99   28                                                      
CONECT  100   28                                                      
CONECT  101   29                                                      
CONECT  102   29                                                      
CONECT  103   30                                                      
CONECT  104   30                                                      
CONECT  105   31                                                      
CONECT  106   31                                                      
CONECT  107   32                                                      
CONECT  108   32                                                      
CONECT  109   33                                                      
CONECT  110   33                                                      
CONECT  111   33                                                      
CONECT  112   34                                                      
CONECT  113   34                                                      
CONECT  114   35                                                      
CONECT  115   35                                                      
CONECT  116   36                                                      
CONECT  117   37                                                      
CONECT  118   37                                                      
CONECT  119   38                                                      
CONECT  120   38                                                      
CONECT  121   39                                                      
CONECT  122   39                                                      
CONECT  123   43                                                      
CONECT  124   44                                                      
CONECT  125   45                                                      
CONECT  126   47                                                      
CONECT  127   49                                                      
MASTER        0    0    0    0    0    0    0    0  127    0  127    0
END
