COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.451  -2.940  -4.374  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.690  -0.344   0.568  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.005   0.000   1.271  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.960   0.658   0.273  1.00  0.00           C  
HETATM    5  C   UNL     1      -9.274   1.002   0.976  1.00  0.00           C  
HETATM    6  C   UNL     1     -10.229   1.660  -0.022  1.00  0.00           C  
HETATM    7  C   UNL     1     -12.499   2.661  -0.317  1.00  0.00           C  
HETATM    8  C   UNL     1     -16.084   4.006   0.090  1.00  0.00           C  
HETATM    9  C   UNL     1     -18.354   5.008  -0.205  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.405  -2.999   2.450  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.910  -3.147  -2.483  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.453  -3.816  -3.747  1.00  0.00           C  
HETATM   13  C   UNL     1       2.975  -2.201   1.425  1.00  0.00           C  
HETATM   14  C   UNL     1       5.261  -1.290   1.121  1.00  0.00           C  
HETATM   15  C   UNL     1       7.560  -0.361   0.811  1.00  0.00           C  
HETATM   16  C   UNL     1       9.858   0.568   0.501  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.479  -1.993   1.847  1.00  0.00           C  
HETATM   18  C   UNL     1     -13.814   3.005   0.386  1.00  0.00           C  
HETATM   19  C   UNL     1     -14.769   3.663  -0.613  1.00  0.00           C  
HETATM   20  C   UNL     1     -17.039   4.664  -0.908  1.00  0.00           C  
HETATM   21  C   UNL     1     -19.309   5.666  -1.203  1.00  0.00           C  
HETATM   22  C   UNL     1       0.937  -3.372   1.817  1.00  0.00           C  
HETATM   23  C   UNL     1       0.694  -4.257   0.592  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.420  -1.345   0.863  1.00  0.00           C  
HETATM   25  C   UNL     1       3.766  -0.985   1.016  1.00  0.00           C  
HETATM   26  C   UNL     1       6.064  -0.056   0.706  1.00  0.00           C  
HETATM   27  C   UNL     1       8.363   0.873   0.396  1.00  0.00           C  
HETATM   28  C   UNL     1      10.661   1.803   0.085  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.735  -1.002   1.566  1.00  0.00           C  
HETATM   30  C   UNL     1      12.157   1.497   0.190  1.00  0.00           C  
HETATM   31  C   UNL     1      12.960   2.732  -0.225  1.00  0.00           C  
HETATM   32  C   UNL     1      14.455   2.426  -0.120  1.00  0.00           C  
HETATM   33  C   UNL     1      15.258   3.661  -0.535  1.00  0.00           C  
HETATM   34  C   UNL     1      16.754   3.355  -0.430  1.00  0.00           C  
HETATM   35  C   UNL     1      17.557   4.590  -0.845  1.00  0.00           C  
HETATM   36  C   UNL     1      19.052   4.285  -0.740  1.00  0.00           C  
HETATM   37  C   UNL     1      19.855   5.519  -1.155  1.00  0.00           C  
HETATM   38  C   UNL     1     -11.544   2.003   0.681  1.00  0.00           C  
HETATM   39  O   UNL     1      -2.825  -2.163   2.992  1.00  0.00           O  
HETATM   40  O   UNL     1      -1.257  -2.382   1.450  1.00  0.00           O  
HETATM   41  O   UNL     1      -0.195  -3.592  -0.307  1.00  0.00           O  
HETATM   42  O   UNL     1       0.598  -4.390  -2.683  1.00  0.00           O  
HETATM   43  O   UNL     1      -1.269  -5.566  -1.457  1.00  0.00           O  
HETATM   44  O   UNL     1       1.633  -2.165   1.411  1.00  0.00           O  
HETATM   45  O   UNL     1       3.549  -3.208   1.765  1.00  0.00           O  
HETATM   46  P   UNL     1      -0.671  -4.235  -1.704  1.00  0.00           P  
HETATM   47  H   UNL     1      -3.826  -3.359  -5.212  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.188  -2.708  -3.725  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.886  -1.032  -0.254  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.237   0.568   0.179  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.458  -0.912   1.661  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.808   0.688   2.093  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.507   1.570  -0.116  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.156  -0.030  -0.549  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.727   0.090   1.365  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.078   1.690   1.798  1.00  0.00           H  
HETATM   57  H   UNL     1      -9.776   2.571  -0.412  1.00  0.00           H  
HETATM   58  H   UNL     1     -10.426   0.971  -0.844  1.00  0.00           H  
HETATM   59  H   UNL     1     -12.696   1.973  -1.140  1.00  0.00           H  
HETATM   60  H   UNL     1     -12.046   3.573  -0.707  1.00  0.00           H  
HETATM   61  H   UNL     1     -16.537   3.095   0.480  1.00  0.00           H  
HETATM   62  H   UNL     1     -15.887   4.694   0.913  1.00  0.00           H  
HETATM   63  H   UNL     1     -18.807   4.096   0.185  1.00  0.00           H  
HETATM   64  H   UNL     1     -18.157   5.696   0.617  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.887  -3.897   2.835  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.238  -2.298   3.268  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.445  -2.197  -2.746  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.728  -2.970  -1.785  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.918  -4.766  -3.484  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.635  -3.993  -4.445  1.00  0.00           H  
HETATM   71  H   UNL     1       5.507  -1.554   2.149  1.00  0.00           H  
HETATM   72  H   UNL     1       5.509  -2.123   0.463  1.00  0.00           H  
HETATM   73  H   UNL     1       7.805  -0.625   1.839  1.00  0.00           H  
HETATM   74  H   UNL     1       7.808  -1.194   0.153  1.00  0.00           H  
HETATM   75  H   UNL     1      10.104   0.304   1.529  1.00  0.00           H  
HETATM   76  H   UNL     1      10.106  -0.265  -0.158  1.00  0.00           H  
HETATM   77  H   UNL     1     -14.267   2.093   0.775  1.00  0.00           H  
HETATM   78  H   UNL     1     -13.618   3.693   1.208  1.00  0.00           H  
HETATM   79  H   UNL     1     -14.966   2.975  -1.435  1.00  0.00           H  
HETATM   80  H   UNL     1     -14.316   4.574  -1.002  1.00  0.00           H  
HETATM   81  H   UNL     1     -16.586   5.576  -1.297  1.00  0.00           H  
HETATM   82  H   UNL     1     -17.236   3.976  -1.730  1.00  0.00           H  
HETATM   83  H   UNL     1     -19.505   4.978  -2.025  1.00  0.00           H  
HETATM   84  H   UNL     1     -20.246   5.911  -0.702  1.00  0.00           H  
HETATM   85  H   UNL     1     -18.856   6.577  -1.592  1.00  0.00           H  
HETATM   86  H   UNL     1       1.543  -3.914   2.543  1.00  0.00           H  
HETATM   87  H   UNL     1       1.642  -4.450   0.090  1.00  0.00           H  
HETATM   88  H   UNL     1       0.252  -5.202   0.909  1.00  0.00           H  
HETATM   89  H   UNL     1      -2.967  -0.433   0.474  1.00  0.00           H  
HETATM   90  H   UNL     1      -3.616  -2.033   0.041  1.00  0.00           H  
HETATM   91  H   UNL     1       3.520  -0.721  -0.013  1.00  0.00           H  
HETATM   92  H   UNL     1       3.518  -0.152   1.674  1.00  0.00           H  
HETATM   93  H   UNL     1       5.819   0.209  -0.323  1.00  0.00           H  
HETATM   94  H   UNL     1       5.816   0.777   1.364  1.00  0.00           H  
HETATM   95  H   UNL     1       8.117   1.138  -0.633  1.00  0.00           H  
HETATM   96  H   UNL     1       8.115   1.706   1.054  1.00  0.00           H  
HETATM   97  H   UNL     1      10.416   2.067  -0.943  1.00  0.00           H  
HETATM   98  H   UNL     1      10.413   2.635   0.744  1.00  0.00           H  
HETATM   99  H   UNL     1      -4.538  -0.313   2.389  1.00  0.00           H  
HETATM  100  H   UNL     1      -5.188  -1.913   1.956  1.00  0.00           H  
HETATM  101  H   UNL     1      12.402   1.233   1.219  1.00  0.00           H  
HETATM  102  H   UNL     1      12.405   0.664  -0.468  1.00  0.00           H  
HETATM  103  H   UNL     1      12.714   2.996  -1.253  1.00  0.00           H  
HETATM  104  H   UNL     1      12.712   3.565   0.433  1.00  0.00           H  
HETATM  105  H   UNL     1      14.701   2.162   0.909  1.00  0.00           H  
HETATM  106  H   UNL     1      14.703   1.594  -0.778  1.00  0.00           H  
HETATM  107  H   UNL     1      15.012   3.925  -1.563  1.00  0.00           H  
HETATM  108  H   UNL     1      15.010   4.494   0.123  1.00  0.00           H  
HETATM  109  H   UNL     1      16.999   3.091   0.599  1.00  0.00           H  
HETATM  110  H   UNL     1      17.001   2.523  -1.088  1.00  0.00           H  
HETATM  111  H   UNL     1      17.311   4.854  -1.873  1.00  0.00           H  
HETATM  112  H   UNL     1      17.309   5.423  -0.187  1.00  0.00           H  
HETATM  113  H   UNL     1      19.298   4.020   0.289  1.00  0.00           H  
HETATM  114  H   UNL     1      19.300   3.452  -1.398  1.00  0.00           H  
HETATM  115  H   UNL     1      20.920   5.302  -1.080  1.00  0.00           H  
HETATM  116  H   UNL     1      19.609   5.783  -2.184  1.00  0.00           H  
HETATM  117  H   UNL     1      19.607   6.352  -0.497  1.00  0.00           H  
HETATM  118  H   UNL     1     -11.997   1.091   1.070  1.00  0.00           H  
HETATM  119  H   UNL     1     -11.348   2.691   1.503  1.00  0.00           H  
HETATM  120  H   UNL     1       1.040  -3.555  -2.889  1.00  0.00           H  
CONECT    1   12   47   48                                            
CONECT    2    3   29   49   50                                       
CONECT    3    2    4   51   52                                       
CONECT    4    3    5   53   54                                       
CONECT    5    4    6   55   56                                       
CONECT    6    5   38   57   58                                       
CONECT    7   18   38   59   60                                       
CONECT    8   20   19   61   62                                       
CONECT    9   21   20   63   64                                       
CONECT   10   40   22   65   66                                       
CONECT   11   46   12   67   68                                       
CONECT   12    1   11   69   70                                       
CONECT   13   45   45   44   25                                       
CONECT   14   25   26   71   72                                       
CONECT   15   27   26   73   74                                       
CONECT   16   28   27   75   76                                       
CONECT   17   24   40   39   39                                       
CONECT   18    7   19   77   78                                       
CONECT   19    8   18   79   80                                       
CONECT   20    9    8   81   82                                       
CONECT   21    9   83   84   85                                       
CONECT   22   10   44   23   86                                       
CONECT   23   22   41   87   88                                       
CONECT   24   29   17   89   90                                       
CONECT   25   14   13   91   92                                       
CONECT   26   15   14   93   94                                       
CONECT   27   16   15   95   96                                       
CONECT   28   30   16   97   98                                       
CONECT   29    2   24   99  100                                       
CONECT   30   28   31  101  102                                       
CONECT   31   30   32  103  104                                       
CONECT   32   31   33  105  106                                       
CONECT   33   32   34  107  108                                       
CONECT   34   33   35  109  110                                       
CONECT   35   34   36  111  112                                       
CONECT   36   35   37  113  114                                       
CONECT   37   36  115  116  117                                       
CONECT   38    7    6  118  119                                       
CONECT   39   17   17                                                 
CONECT   40   17   10                                                 
CONECT   41   23   46                                                 
CONECT   42   46  120                                                 
CONECT   43   46   46                                                 
CONECT   44   22   13                                                 
CONECT   45   13   13                                                 
CONECT   46   41   43   43   11                                       
CONECT   46   42                                                      
CONECT   47    1                                                      
CONECT   48    1                                                      
CONECT   49    2                                                      
CONECT   50    2                                                      
CONECT   51    3                                                      
CONECT   52    3                                                      
CONECT   53    4                                                      
CONECT   54    4                                                      
CONECT   55    5                                                      
CONECT   56    5                                                      
CONECT   57    6                                                      
CONECT   58    6                                                      
CONECT   59    7                                                      
CONECT   60    7                                                      
CONECT   61    8                                                      
CONECT   62    8                                                      
CONECT   63    9                                                      
CONECT   64    9                                                      
CONECT   65   10                                                      
CONECT   66   10                                                      
CONECT   67   11                                                      
CONECT   68   11                                                      
CONECT   69   12                                                      
CONECT   70   12                                                      
CONECT   71   14                                                      
CONECT   72   14                                                      
CONECT   73   15                                                      
CONECT   74   15                                                      
CONECT   75   16                                                      
CONECT   76   16                                                      
CONECT   77   18                                                      
CONECT   78   18                                                      
CONECT   79   19                                                      
CONECT   80   19                                                      
CONECT   81   20                                                      
CONECT   82   20                                                      
CONECT   83   21                                                      
CONECT   84   21                                                      
CONECT   85   21                                                      
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   35                                                      
CONECT  112   35                                                      
CONECT  113   36                                                      
CONECT  114   36                                                      
CONECT  115   37                                                      
CONECT  116   37                                                      
CONECT  117   37                                                      
CONECT  118   38                                                      
CONECT  119   38                                                      
CONECT  120   42                                                      
MASTER        0    0    0    0    0    0    0    0  120    0  120    0
END
