COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1     -18.446  -7.242  -0.949  1.00  0.00           C  
HETATM    2  C   UNL     1     -17.515  -6.607   0.086  1.00  0.00           C  
HETATM    3  C   UNL     1     -16.300  -6.005  -0.623  1.00  0.00           C  
HETATM    4  C   UNL     1     -15.368  -5.371   0.412  1.00  0.00           C  
HETATM    5  C   UNL     1     -14.153  -4.769  -0.296  1.00  0.00           C  
HETATM    6  C   UNL     1     -13.222  -4.135   0.738  1.00  0.00           C  
HETATM    7  C   UNL     1     -12.006  -3.533   0.030  1.00  0.00           C  
HETATM    8  C   UNL     1     -11.075  -2.899   1.064  1.00  0.00           C  
HETATM    9  C   UNL     1      -9.860  -2.297   0.356  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.928  -1.663   1.391  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.713  -1.061   0.682  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.782  -0.426   1.717  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.567   0.175   1.008  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.635   0.810   2.043  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.420   1.411   1.334  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.502   2.036   2.353  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.530   3.210   2.995  1.00  0.00           C  
HETATM   18  C   UNL     1       0.713   3.835   2.358  1.00  0.00           C  
HETATM   19  C   UNL     1       0.286   4.838   1.284  1.00  0.00           C  
HETATM   20  C   UNL     1       2.848   2.999   1.706  1.00  0.00           C  
HETATM   21  C   UNL     1       3.751   1.961   1.092  1.00  0.00           C  
HETATM   22  C   UNL     1       5.203   2.439   1.168  1.00  0.00           C  
HETATM   23  C   UNL     1       6.120   1.386   0.544  1.00  0.00           C  
HETATM   24  C   UNL     1       7.571   1.864   0.620  1.00  0.00           C  
HETATM   25  C   UNL     1       8.489   0.811  -0.004  1.00  0.00           C  
HETATM   26  C   UNL     1       9.940   1.289   0.072  1.00  0.00           C  
HETATM   27  O   UNL     1      -2.791   2.004   3.526  1.00  0.00           O  
HETATM   28  O   UNL     1      -1.365   2.629   1.958  1.00  0.00           O  
HETATM   29  O   UNL     1      -0.573   4.192   0.343  1.00  0.00           O  
HETATM   30  O   UNL     1      -0.133   5.571  -1.725  1.00  0.00           O  
HETATM   31  O   UNL     1      -2.225   6.093  -0.412  1.00  0.00           O  
HETATM   32  O   UNL     1      -2.015   3.892  -1.835  1.00  0.00           O  
HETATM   33  O   UNL     1       1.522   2.793   1.751  1.00  0.00           O  
HETATM   34  O   UNL     1       3.316   4.016   2.159  1.00  0.00           O  
HETATM   35  P   UNL     1      -1.213   4.951  -0.925  1.00  0.00           P  
HETATM   36  H   UNL     1     -17.913  -8.027  -1.485  1.00  0.00           H  
HETATM   37  H   UNL     1     -19.312  -7.670  -0.444  1.00  0.00           H  
HETATM   38  H   UNL     1     -18.778  -6.480  -1.655  1.00  0.00           H  
HETATM   39  H   UNL     1     -18.048  -5.822   0.622  1.00  0.00           H  
HETATM   40  H   UNL     1     -17.183  -7.369   0.792  1.00  0.00           H  
HETATM   41  H   UNL     1     -15.766  -6.790  -1.159  1.00  0.00           H  
HETATM   42  H   UNL     1     -16.631  -5.244  -1.329  1.00  0.00           H  
HETATM   43  H   UNL     1     -15.902  -4.586   0.948  1.00  0.00           H  
HETATM   44  H   UNL     1     -15.037  -6.133   1.118  1.00  0.00           H  
HETATM   45  H   UNL     1     -13.620  -5.554  -0.833  1.00  0.00           H  
HETATM   46  H   UNL     1     -14.484  -4.008  -1.002  1.00  0.00           H  
HETATM   47  H   UNL     1     -13.755  -3.350   1.275  1.00  0.00           H  
HETATM   48  H   UNL     1     -12.890  -4.897   1.444  1.00  0.00           H  
HETATM   49  H   UNL     1     -11.473  -4.318  -0.506  1.00  0.00           H  
HETATM   50  H   UNL     1     -12.338  -2.772  -0.676  1.00  0.00           H  
HETATM   51  H   UNL     1     -11.608  -2.114   1.601  1.00  0.00           H  
HETATM   52  H   UNL     1     -10.744  -3.660   1.770  1.00  0.00           H  
HETATM   53  H   UNL     1      -9.326  -3.082  -0.180  1.00  0.00           H  
HETATM   54  H   UNL     1     -10.191  -1.536  -0.350  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.462  -0.878   1.927  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.597  -2.424   2.097  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.180  -1.846   0.146  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.044  -0.299  -0.024  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.315   0.358   2.253  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.450  -1.188   2.423  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.033  -0.610   0.472  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.898   0.937   0.302  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.168   1.595   2.579  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.304   0.048   2.749  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.886   0.627   0.798  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.751   2.173   0.628  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.227   2.432   3.695  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.091   3.978   3.526  1.00  0.00           H  
HETATM   69  H   UNL     1       1.295   4.347   3.123  1.00  0.00           H  
HETATM   70  H   UNL     1      -0.246   5.667   1.752  1.00  0.00           H  
HETATM   71  H   UNL     1       1.169   5.218   0.770  1.00  0.00           H  
HETATM   72  H   UNL     1       3.649   1.022   1.636  1.00  0.00           H  
HETATM   73  H   UNL     1       3.473   1.809   0.049  1.00  0.00           H  
HETATM   74  H   UNL     1       5.305   3.378   0.623  1.00  0.00           H  
HETATM   75  H   UNL     1       5.481   2.592   2.210  1.00  0.00           H  
HETATM   76  H   UNL     1       6.018   0.447   1.088  1.00  0.00           H  
HETATM   77  H   UNL     1       5.842   1.234  -0.499  1.00  0.00           H  
HETATM   78  H   UNL     1       7.674   2.803   0.075  1.00  0.00           H  
HETATM   79  H   UNL     1       7.850   2.016   1.662  1.00  0.00           H  
HETATM   80  H   UNL     1       8.387  -0.128   0.540  1.00  0.00           H  
HETATM   81  H   UNL     1       8.211   0.658  -1.047  1.00  0.00           H  
HETATM   82  H   UNL     1      10.042   2.228  -0.473  1.00  0.00           H  
HETATM   83  H   UNL     1      10.219   1.441   1.114  1.00  0.00           H  
HETATM   84  H   UNL     1      -2.960   5.758   0.120  1.00  0.00           H  
HETATM   85  C   UNL     1      -2.609   4.236  -3.089  1.00  0.00           C  
HETATM   86  C   UNL     1      -3.288   3.003  -3.687  1.00  0.00           C  
HETATM   87  C   UNL     1      -4.029   3.398  -4.965  1.00  0.00           C  
HETATM   88  O   UNL     1      -2.300   2.017  -3.994  1.00  0.00           O  
HETATM   89  O   UNL     1      -4.759   2.274  -5.460  1.00  0.00           O  
HETATM   90  C   UNL     1      10.858   0.235  -0.552  1.00  0.00           C  
HETATM   91  C   UNL     1      12.287   0.706  -0.478  1.00  0.00           C  
HETATM   92  C   UNL     1      13.206  -0.068   0.045  1.00  0.00           C  
HETATM   93  H   UNL     1      -3.350   5.021  -2.936  1.00  0.00           H  
HETATM   94  H   UNL     1      -1.837   4.593  -3.771  1.00  0.00           H  
HETATM   95  H   UNL     1      -3.998   2.594  -2.967  1.00  0.00           H  
HETATM   96  H   UNL     1      -4.720   4.213  -4.748  1.00  0.00           H  
HETATM   97  H   UNL     1      -3.310   3.724  -5.716  1.00  0.00           H  
HETATM   98  H   UNL     1      -1.635   2.312  -4.630  1.00  0.00           H  
HETATM   99  H   UNL     1      -5.254   2.452  -6.272  1.00  0.00           H  
HETATM  100  H   UNL     1      10.756  -0.703  -0.008  1.00  0.00           H  
HETATM  101  H   UNL     1      10.580   0.083  -1.595  1.00  0.00           H  
HETATM  102  H   UNL     1      12.555   1.683  -0.854  1.00  0.00           H  
HETATM  103  H   UNL     1      14.203   0.312   0.210  1.00  0.00           H  
HETATM  104  C   UNL     1      12.871  -1.490   0.414  1.00  0.00           C  
HETATM  105  H   UNL     1      12.926  -1.607   1.496  1.00  0.00           H  
HETATM  106  H   UNL     1      11.863  -1.726   0.074  1.00  0.00           H  
HETATM  107  C   UNL     1      13.869  -2.439  -0.253  1.00  0.00           C  
HETATM  108  C   UNL     1      13.529  -3.883   0.123  1.00  0.00           C  
HETATM  109  C   UNL     1      14.528  -4.831  -0.544  1.00  0.00           C  
HETATM  110  C   UNL     1      14.188  -6.275  -0.169  1.00  0.00           C  
HETATM  111  C   UNL     1      15.186  -7.224  -0.836  1.00  0.00           C  
HETATM  112  C   UNL     1      14.846  -8.668  -0.461  1.00  0.00           C  
HETATM  113  C   UNL     1      15.844  -9.616  -1.127  1.00  0.00           C  
HETATM  114  H   UNL     1      13.814  -2.322  -1.335  1.00  0.00           H  
HETATM  115  H   UNL     1      14.877  -2.203   0.087  1.00  0.00           H  
HETATM  116  H   UNL     1      13.584  -4.000   1.205  1.00  0.00           H  
HETATM  117  H   UNL     1      12.521  -4.119  -0.218  1.00  0.00           H  
HETATM  118  H   UNL     1      14.473  -4.715  -1.627  1.00  0.00           H  
HETATM  119  H   UNL     1      15.536  -4.595  -0.204  1.00  0.00           H  
HETATM  120  H   UNL     1      14.243  -6.392   0.913  1.00  0.00           H  
HETATM  121  H   UNL     1      13.179  -6.511  -0.509  1.00  0.00           H  
HETATM  122  H   UNL     1      15.131  -7.107  -1.918  1.00  0.00           H  
HETATM  123  H   UNL     1      16.194  -6.988  -0.496  1.00  0.00           H  
HETATM  124  H   UNL     1      14.901  -8.785   0.622  1.00  0.00           H  
HETATM  125  H   UNL     1      13.838  -8.904  -0.801  1.00  0.00           H  
HETATM  126  H   UNL     1      15.602 -10.645  -0.860  1.00  0.00           H  
HETATM  127  H   UNL     1      15.789  -9.500  -2.210  1.00  0.00           H  
HETATM  128  H   UNL     1      16.853  -9.380  -0.787  1.00  0.00           H  
CONECT    1    2   36   37   38                                       
CONECT    2    1    3   39   40                                       
CONECT    3    2    4   41   42                                       
CONECT    4    3    5   43   44                                       
CONECT    5    4    6   45   46                                       
CONECT    6    5    7   47   48                                       
CONECT    7    6    8   49   50                                       
CONECT    8    7    9   51   52                                       
CONECT    9    8   10   53   54                                       
CONECT   10    9   11   55   56                                       
CONECT   11   10   12   57   58                                       
CONECT   12   11   13   59   60                                       
CONECT   13   12   14   61   62                                       
CONECT   14   13   15   63   64                                       
CONECT   15   14   16   65   66                                       
CONECT   16   15   28   27   27                                       
CONECT   17   18   28   67   68                                       
CONECT   18   33   17   19   69                                       
CONECT   19   18   29   70   71                                       
CONECT   20   21   34   34   33                                       
CONECT   21   22   20   72   73                                       
CONECT   22   23   21   74   75                                       
CONECT   23   24   22   76   77                                       
CONECT   24   25   23   78   79                                       
CONECT   25   26   24   80   81                                       
CONECT   26   25   82   83   90                                       
CONECT   27   16   16                                                 
CONECT   28   16   17                                                 
CONECT   29   19   35                                                 
CONECT   30   35   35                                                 
CONECT   31   35   84                                                 
CONECT   32   35   85                                                 
CONECT   33   20   18                                                 
CONECT   34   20   20                                                 
CONECT   35   30   30   29   32                                       
CONECT   35   31                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    6                                                      
CONECT   49    7                                                      
CONECT   50    7                                                      
CONECT   51    8                                                      
CONECT   52    8                                                      
CONECT   53    9                                                      
CONECT   54    9                                                      
CONECT   55   10                                                      
CONECT   56   10                                                      
CONECT   57   11                                                      
CONECT   58   11                                                      
CONECT   59   12                                                      
CONECT   60   12                                                      
CONECT   61   13                                                      
CONECT   62   13                                                      
CONECT   63   14                                                      
CONECT   64   14                                                      
CONECT   65   15                                                      
CONECT   66   15                                                      
CONECT   67   17                                                      
CONECT   68   17                                                      
CONECT   69   18                                                      
CONECT   70   19                                                      
CONECT   71   19                                                      
CONECT   72   21                                                      
CONECT   73   21                                                      
CONECT   74   22                                                      
CONECT   75   22                                                      
CONECT   76   23                                                      
CONECT   77   23                                                      
CONECT   78   24                                                      
CONECT   79   24                                                      
CONECT   80   25                                                      
CONECT   81   25                                                      
CONECT   82   26                                                      
CONECT   83   26                                                      
CONECT   84   31                                                      
CONECT   85   32   86   93   94                                       
CONECT   86   85   87   88   95                                       
CONECT   87   86   89   96   97                                       
CONECT   88   86   98                                                 
CONECT   89   87   99                                                 
CONECT   90   26   91  100  101                                       
CONECT   91   90   92   92  102                                       
CONECT   92   91   91  103  104                                       
CONECT   93   85                                                      
CONECT   94   85                                                      
CONECT   95   86                                                      
CONECT   96   87                                                      
CONECT   97   87                                                      
CONECT   98   88                                                      
CONECT   99   89                                                      
CONECT  100   90                                                      
CONECT  101   90                                                      
CONECT  102   91                                                      
CONECT  103   92                                                      
CONECT  104   92  105  106  107                                       
CONECT  105  104                                                      
CONECT  106  104                                                      
CONECT  107  104  108  114  115                                       
CONECT  108  107  109  116  117                                       
CONECT  109  108  110  118  119                                       
CONECT  110  109  111  120  121                                       
CONECT  111  110  112  122  123                                       
CONECT  112  111  113  124  125                                       
CONECT  113  112  126  127  128                                       
CONECT  114  107                                                      
CONECT  115  107                                                      
CONECT  116  108                                                      
CONECT  117  108                                                      
CONECT  118  109                                                      
CONECT  119  109                                                      
CONECT  120  110                                                      
CONECT  121  110                                                      
CONECT  122  111                                                      
CONECT  123  111                                                      
CONECT  124  112                                                      
CONECT  125  112                                                      
CONECT  126  113                                                      
CONECT  127  113                                                      
CONECT  128  113                                                      
MASTER        0    0    0    0    0    0    0    0  128    0  128    0
END
