COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.389   2.367  -2.658  1.00  0.00           C  
HETATM    2  C   UNL     1       8.311   0.859  -2.403  1.00  0.00           C  
HETATM    3  C   UNL     1       8.834   0.563  -0.993  1.00  0.00           C  
HETATM    4  C   UNL     1       8.565   1.128   1.407  1.00  0.00           C  
HETATM    5  C   UNL     1       8.019   1.367   0.023  1.00  0.00           C  
HETATM    6  C   UNL     1       5.781   1.723   0.804  1.00  0.00           C  
HETATM    7  C   UNL     1       4.351   1.195   0.671  1.00  0.00           C  
HETATM    8  C   UNL     1       3.400   2.094   1.463  1.00  0.00           C  
HETATM    9  O   UNL     1      -0.573   1.742   1.359  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.994  -2.257   1.357  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.086  -0.831   0.877  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.935   1.393   0.986  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.318   1.997   1.241  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.587   1.674   0.590  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.676   0.965  -0.174  1.00  0.00           C  
HETATM   16  C   UNL     1      -9.024   1.622   0.130  1.00  0.00           C  
HETATM   17  C   UNL     1     -10.129   0.901  -0.645  1.00  0.00           C  
HETATM   18  C   UNL     1     -11.476   1.559  -0.341  1.00  0.00           C  
HETATM   19  C   UNL     1     -12.582   0.838  -1.116  1.00  0.00           C  
HETATM   20  C   UNL     1     -13.929   1.495  -0.812  1.00  0.00           C  
HETATM   21  C   UNL     1     -15.034   0.775  -1.587  1.00  0.00           C  
HETATM   22  C   UNL     1       3.407 -13.350  -0.601  1.00  0.00           C  
HETATM   23  C   UNL     1       3.313 -11.903  -1.089  1.00  0.00           C  
HETATM   24  C   UNL     1       2.326 -11.131  -0.210  1.00  0.00           C  
HETATM   25  C   UNL     1       2.233  -9.684  -0.697  1.00  0.00           C  
HETATM   26  C   UNL     1       1.246  -8.913   0.182  1.00  0.00           C  
HETATM   27  C   UNL     1       1.153  -7.465  -0.305  1.00  0.00           C  
HETATM   28  C   UNL     1       0.166  -6.694   0.573  1.00  0.00           C  
HETATM   29  C   UNL     1       0.073  -5.247   0.086  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.914  -4.475   0.965  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.007  -3.028   0.478  1.00  0.00           C  
HETATM   32  C   UNL     1     -16.382   1.432  -1.284  1.00  0.00           C  
HETATM   33  C   UNL     1     -17.487   0.712  -2.059  1.00  0.00           C  
HETATM   34  C   UNL     1     -18.835   1.369  -1.755  1.00  0.00           C  
HETATM   35  C   UNL     1      -1.872   2.237   1.691  1.00  0.00           C  
HETATM   36  C   UNL     1       7.591   3.101  -1.577  1.00  0.00           C  
HETATM   37  C   UNL     1       7.713   4.611  -1.791  1.00  0.00           C  
HETATM   38  C   UNL     1       6.916   5.345  -0.711  1.00  0.00           C  
HETATM   39  O   UNL     1      -1.430  -0.469  -0.071  1.00  0.00           O  
HETATM   40  O   UNL     1      -2.897   0.036   1.502  1.00  0.00           O  
HETATM   41  O   UNL     1      -5.313   1.267   0.477  1.00  0.00           O  
HETATM   42  O   UNL     1      -6.862   2.610   1.304  1.00  0.00           O  
HETATM   43  O   UNL     1       0.849   2.198   3.522  1.00  0.00           O  
HETATM   44  O   UNL     1       0.811   3.839   1.605  1.00  0.00           O  
HETATM   45  O   UNL     1       2.053   1.671   1.245  1.00  0.00           O  
HETATM   46  O   UNL     1       4.286  -0.137   1.184  1.00  0.00           O  
HETATM   47  O   UNL     1       6.652   0.954  -0.028  1.00  0.00           O  
HETATM   48  O   UNL     1       8.677  -0.124   1.877  1.00  0.00           O  
HETATM   49  O   UNL     1       8.903   2.063   2.094  1.00  0.00           O  
HETATM   50  O   UNL     1       9.113   0.169  -3.364  1.00  0.00           O  
HETATM   51  O   UNL     1       7.837   2.662  -3.943  1.00  0.00           O  
HETATM   52  O   UNL     1       7.123   6.753  -0.840  1.00  0.00           O  
HETATM   53  O   UNL     1       7.196   4.953  -3.079  1.00  0.00           O  
HETATM   54  O   UNL     1       8.109   2.759  -0.290  1.00  0.00           O  
HETATM   55  P   UNL     1       0.785   2.394   1.926  1.00  0.00           P  
HETATM   56  H   UNL     1       9.430   2.689  -2.626  1.00  0.00           H  
HETATM   57  H   UNL     1       7.276   0.527  -2.486  1.00  0.00           H  
HETATM   58  H   UNL     1       8.731  -0.501  -0.782  1.00  0.00           H  
HETATM   59  H   UNL     1       9.884   0.848  -0.927  1.00  0.00           H  
HETATM   60  H   UNL     1       5.813   2.768   0.496  1.00  0.00           H  
HETATM   61  H   UNL     1       6.104   1.640   1.842  1.00  0.00           H  
HETATM   62  H   UNL     1       4.061   1.195  -0.380  1.00  0.00           H  
HETATM   63  H   UNL     1       3.635   2.025   2.525  1.00  0.00           H  
HETATM   64  H   UNL     1       3.515   3.126   1.132  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.648  -2.271   2.390  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.977  -2.724   1.296  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.737   1.380  -0.086  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.554   1.930   2.303  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.319   3.043   0.934  1.00  0.00           H  
HETATM   70  H   UNL     1      -7.472   1.031  -1.243  1.00  0.00           H  
HETATM   71  H   UNL     1      -7.707  -0.083   0.126  1.00  0.00           H  
HETATM   72  H   UNL     1      -9.227   1.556   1.199  1.00  0.00           H  
HETATM   73  H   UNL     1      -8.993   2.669  -0.170  1.00  0.00           H  
HETATM   74  H   UNL     1      -9.925   0.967  -1.714  1.00  0.00           H  
HETATM   75  H   UNL     1     -10.159  -0.146  -0.345  1.00  0.00           H  
HETATM   76  H   UNL     1     -11.680   1.493   0.728  1.00  0.00           H  
HETATM   77  H   UNL     1     -11.446   2.606  -0.641  1.00  0.00           H  
HETATM   78  H   UNL     1     -12.378   0.904  -2.185  1.00  0.00           H  
HETATM   79  H   UNL     1     -12.612  -0.209  -0.816  1.00  0.00           H  
HETATM   80  H   UNL     1     -14.133   1.429   0.256  1.00  0.00           H  
HETATM   81  H   UNL     1     -13.899   2.543  -1.112  1.00  0.00           H  
HETATM   82  H   UNL     1     -14.831   0.841  -2.656  1.00  0.00           H  
HETATM   83  H   UNL     1     -15.065  -0.272  -1.288  1.00  0.00           H  
HETATM   84  H   UNL     1       3.753 -13.364   0.432  1.00  0.00           H  
HETATM   85  H   UNL     1       2.424 -13.818  -0.662  1.00  0.00           H  
HETATM   86  H   UNL     1       4.109 -13.899  -1.227  1.00  0.00           H  
HETATM   87  H   UNL     1       4.296 -11.435  -1.028  1.00  0.00           H  
HETATM   88  H   UNL     1       2.967 -11.889  -2.122  1.00  0.00           H  
HETATM   89  H   UNL     1       1.344 -11.599  -0.270  1.00  0.00           H  
HETATM   90  H   UNL     1       2.672 -11.145   0.824  1.00  0.00           H  
HETATM   91  H   UNL     1       3.216  -9.216  -0.636  1.00  0.00           H  
HETATM   92  H   UNL     1       1.887  -9.670  -1.730  1.00  0.00           H  
HETATM   93  H   UNL     1       0.264  -9.380   0.121  1.00  0.00           H  
HETATM   94  H   UNL     1       1.592  -8.927   1.215  1.00  0.00           H  
HETATM   95  H   UNL     1       2.136  -6.997  -0.245  1.00  0.00           H  
HETATM   96  H   UNL     1       0.807  -7.451  -1.339  1.00  0.00           H  
HETATM   97  H   UNL     1      -0.817  -7.162   0.513  1.00  0.00           H  
HETATM   98  H   UNL     1       0.512  -6.708   1.607  1.00  0.00           H  
HETATM   99  H   UNL     1       1.055  -4.779   0.147  1.00  0.00           H  
HETATM  100  H   UNL     1      -0.273  -5.233  -0.947  1.00  0.00           H  
HETATM  101  H   UNL     1      -1.897  -4.943   0.905  1.00  0.00           H  
HETATM  102  H   UNL     1      -0.568  -4.489   1.999  1.00  0.00           H  
HETATM  103  H   UNL     1      -1.353  -3.014  -0.555  1.00  0.00           H  
HETATM  104  H   UNL     1      -0.025  -2.560   0.539  1.00  0.00           H  
HETATM  105  H   UNL     1     -16.586   1.366  -0.215  1.00  0.00           H  
HETATM  106  H   UNL     1     -16.351   2.480  -1.584  1.00  0.00           H  
HETATM  107  H   UNL     1     -17.284   0.778  -3.128  1.00  0.00           H  
HETATM  108  H   UNL     1     -17.518  -0.336  -1.759  1.00  0.00           H  
HETATM  109  H   UNL     1     -19.039   1.303  -0.686  1.00  0.00           H  
HETATM  110  H   UNL     1     -18.804   2.417  -2.055  1.00  0.00           H  
HETATM  111  H   UNL     1     -19.622   0.856  -2.307  1.00  0.00           H  
HETATM  112  H   UNL     1      -2.018   2.179   2.770  1.00  0.00           H  
HETATM  113  H   UNL     1      -1.959   3.275   1.369  1.00  0.00           H  
HETATM  114  H   UNL     1       6.543   2.809  -1.637  1.00  0.00           H  
HETATM  115  H   UNL     1       8.761   4.904  -1.731  1.00  0.00           H  
HETATM  116  H   UNL     1       5.855   5.122  -0.827  1.00  0.00           H  
HETATM  117  H   UNL     1       7.250   5.017   0.273  1.00  0.00           H  
HETATM  118  H   UNL     1       0.836   1.273   3.806  1.00  0.00           H  
HETATM  119  H   UNL     1       4.532  -0.213   2.116  1.00  0.00           H  
HETATM  120  H   UNL     1       9.032  -0.228   2.770  1.00  0.00           H  
HETATM  121  H   UNL     1       9.111  -0.793  -3.261  1.00  0.00           H  
HETATM  122  H   UNL     1       8.291   2.226  -4.676  1.00  0.00           H  
HETATM  123  H   UNL     1       6.647   7.282  -0.185  1.00  0.00           H  
HETATM  124  H   UNL     1       6.266   4.721  -3.204  1.00  0.00           H  
CONECT    1   36    2   51   56                                       
CONECT    2    3    1   50   57                                       
CONECT    3    5    2   58   59                                       
CONECT    4   49   49    5   48                                       
CONECT    5   47   54    4    3                                       
CONECT    6    7   47   60   61                                       
CONECT    7   46    8    6   62                                       
CONECT    8   45    7   63   64                                       
CONECT    9   35   55                                                 
CONECT   10   31   11   65   66                                       
CONECT   11   10   40   39   39                                       
CONECT   12   13   40   35   67                                       
CONECT   13   41   12   68   69                                       
CONECT   14   15   42   42   41                                       
CONECT   15   16   14   70   71                                       
CONECT   16   17   15   72   73                                       
CONECT   17   18   16   74   75                                       
CONECT   18   17   19   76   77                                       
CONECT   19   20   18   78   79                                       
CONECT   20   21   19   80   81                                       
CONECT   21   32   20   82   83                                       
CONECT   22   23   84   85   86                                       
CONECT   23   24   22   87   88                                       
CONECT   24   25   23   89   90                                       
CONECT   25   26   24   91   92                                       
CONECT   26   27   25   93   94                                       
CONECT   27   28   26   95   96                                       
CONECT   28   29   27   97   98                                       
CONECT   29   28   30   99  100                                       
CONECT   30   29   31  101  102                                       
CONECT   31   30   10  103  104                                       
CONECT   32   33   21  105  106                                       
CONECT   33   32   34  107  108                                       
CONECT   34   33  109  110  111                                       
CONECT   35   12    9  112  113                                       
CONECT   36   54   37    1  114                                       
CONECT   37   38   36   53  115                                       
CONECT   38   52   37  116  117                                       
CONECT   39   11   11                                                 
CONECT   40   12   11                                                 
CONECT   41   14   13                                                 
CONECT   42   14   14                                                 
CONECT   43   55  118                                                 
CONECT   44   55   55                                                 
CONECT   45   55    8                                                 
CONECT   46    7  119                                                 
CONECT   47    6    5                                                 
CONECT   48    4  120                                                 
CONECT   49    4    4                                                 
CONECT   50    2  121                                                 
CONECT   51    1  122                                                 
CONECT   52   38  123                                                 
CONECT   53   37  124                                                 
CONECT   54    5   36                                                 
CONECT   55    9   44   44   43                                       
CONECT   55   45                                                      
CONECT   56    1                                                      
CONECT   57    2                                                      
CONECT   58    3                                                      
CONECT   59    3                                                      
CONECT   60    6                                                      
CONECT   61    6                                                      
CONECT   62    7                                                      
CONECT   63    8                                                      
CONECT   64    8                                                      
CONECT   65   10                                                      
CONECT   66   10                                                      
CONECT   67   12                                                      
CONECT   68   13                                                      
CONECT   69   13                                                      
CONECT   70   15                                                      
CONECT   71   15                                                      
CONECT   72   16                                                      
CONECT   73   16                                                      
CONECT   74   17                                                      
CONECT   75   17                                                      
CONECT   76   18                                                      
CONECT   77   18                                                      
CONECT   78   19                                                      
CONECT   79   19                                                      
CONECT   80   20                                                      
CONECT   81   20                                                      
CONECT   82   21                                                      
CONECT   83   21                                                      
CONECT   84   22                                                      
CONECT   85   22                                                      
CONECT   86   22                                                      
CONECT   87   23                                                      
CONECT   88   23                                                      
CONECT   89   24                                                      
CONECT   90   24                                                      
CONECT   91   25                                                      
CONECT   92   25                                                      
CONECT   93   26                                                      
CONECT   94   26                                                      
CONECT   95   27                                                      
CONECT   96   27                                                      
CONECT   97   28                                                      
CONECT   98   28                                                      
CONECT   99   29                                                      
CONECT  100   29                                                      
CONECT  101   30                                                      
CONECT  102   30                                                      
CONECT  103   31                                                      
CONECT  104   31                                                      
CONECT  105   32                                                      
CONECT  106   32                                                      
CONECT  107   33                                                      
CONECT  108   33                                                      
CONECT  109   34                                                      
CONECT  110   34                                                      
CONECT  111   34                                                      
CONECT  112   35                                                      
CONECT  113   35                                                      
CONECT  114   36                                                      
CONECT  115   37                                                      
CONECT  116   38                                                      
CONECT  117   38                                                      
CONECT  118   43                                                      
CONECT  119   46                                                      
CONECT  120   48                                                      
CONECT  121   50                                                      
CONECT  122   51                                                      
CONECT  123   52                                                      
CONECT  124   53                                                      
MASTER        0    0    0    0    0    0    0    0  124    0  124    0
END
