COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.280   2.460  -0.589  1.00  0.00           C  
HETATM    2  C   UNL     1      10.315   3.277   0.553  1.00  0.00           C  
HETATM    3  C   UNL     1      11.129   4.423   0.525  1.00  0.00           C  
HETATM    4  C   UNL     1       8.967   1.632   0.977  1.00  0.00           C  
HETATM    5  N   UNL     1      11.826   4.677  -0.578  1.00  0.00           N  
HETATM    6  N   UNL     1      11.012   2.796  -1.646  1.00  0.00           N  
HETATM    7  O   UNL     1      -7.961   3.793  -2.372  1.00  0.00           O  
HETATM    8  C   UNL     1      -7.192   3.400  -1.521  1.00  0.00           C  
HETATM    9  N   UNL     1      -5.996   4.003  -1.321  1.00  0.00           N  
HETATM   10  C   UNL     1      -5.120   3.491  -0.436  1.00  0.00           C  
HETATM   11  O   UNL     1      -4.228   4.201  -0.010  1.00  0.00           O  
HETATM   12  N   UNL     1      -5.201   2.222  -0.008  1.00  0.00           N  
HETATM   13  C   UNL     1      -6.291   1.522  -0.214  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.532   2.234  -0.647  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.383   2.747   0.545  1.00  0.00           C  
HETATM   16  C   UNL     1      -8.375   1.766   1.689  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.889   2.149   2.925  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.882   1.249   3.974  1.00  0.00           C  
HETATM   19  C   UNL     1      -8.362  -0.034   3.787  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.849  -0.417   2.552  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.860   0.485   1.504  1.00  0.00           C  
HETATM   22  C   UNL     1      -9.754   2.806  -0.132  1.00  0.00           C  
HETATM   23  C   UNL     1      -9.732   1.953  -1.157  1.00  0.00           C  
HETATM   24  N   UNL     1      -8.509   1.301  -1.219  1.00  0.00           N  
HETATM   25  C   UNL     1      -8.225  -0.019  -1.558  1.00  0.00           C  
HETATM   26  C   UNL     1      -9.007  -0.748  -2.432  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.687  -2.067  -2.703  1.00  0.00           C  
HETATM   28  C   UNL     1      -9.535  -2.865  -3.659  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.590  -2.653  -2.098  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.259  -4.095  -2.386  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.795  -1.926  -1.232  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.096  -0.600  -0.965  1.00  0.00           C  
HETATM   33  N   UNL     1      -6.254   0.173  -0.160  1.00  0.00           N  
HETATM   34  C   UNL     1      -5.332  -0.489   0.767  1.00  0.00           C  
HETATM   35  C   UNL     1      -3.952  -0.605   0.118  1.00  0.00           C  
HETATM   36  O   UNL     1      -4.027  -1.485  -1.006  1.00  0.00           O  
HETATM   37  C   UNL     1      -2.955  -1.161   1.136  1.00  0.00           C  
HETATM   38  O   UNL     1      -2.880  -0.281   2.259  1.00  0.00           O  
HETATM   39  C   UNL     1      -1.574  -1.277   0.486  1.00  0.00           C  
HETATM   40  O   UNL     1      -1.649  -2.157  -0.637  1.00  0.00           O  
HETATM   41  C   UNL     1      -0.577  -1.833   1.505  1.00  0.00           C  
HETATM   42  O   UNL     1       0.734  -1.833   0.936  1.00  0.00           O  
HETATM   43  P   UNL     1       2.035  -2.353   1.730  1.00  0.00           P  
HETATM   44  O   UNL     1       1.802  -3.735   2.205  1.00  0.00           O  
HETATM   45  O   UNL     1       2.313  -1.392   2.992  1.00  0.00           O  
HETATM   46  O   UNL     1       3.309  -2.330   0.747  1.00  0.00           O  
HETATM   47  P   UNL     1       4.742  -3.065   0.756  1.00  0.00           P  
HETATM   48  O   UNL     1       4.577  -4.570   0.208  1.00  0.00           O  
HETATM   49  O   UNL     1       5.271  -3.098   2.138  1.00  0.00           O  
HETATM   50  O   UNL     1       5.764  -2.258  -0.191  1.00  0.00           O  
HETATM   51  C   UNL     1       7.147  -2.599  -0.312  1.00  0.00           C  
HETATM   52  C   UNL     1       7.826  -1.635  -1.287  1.00  0.00           C  
HETATM   53  O   UNL     1       7.843  -0.309  -0.732  1.00  0.00           O  
HETATM   54  C   UNL     1       9.291  -2.059  -1.507  1.00  0.00           C  
HETATM   55  O   UNL     1       9.525  -2.353  -2.886  1.00  0.00           O  
HETATM   56  C   UNL     1      10.113  -0.822  -1.071  1.00  0.00           C  
HETATM   57  O   UNL     1      11.205  -0.594  -1.964  1.00  0.00           O  
HETATM   58  C   UNL     1       9.067   0.317  -1.174  1.00  0.00           C  
HETATM   59  N   UNL     1       9.426   1.429  -0.290  1.00  0.00           N  
HETATM   60  N   UNL     1       9.491   2.716   1.471  1.00  0.00           N  
HETATM   61  C   UNL     1      11.760   3.879  -1.628  1.00  0.00           C  
HETATM   62  N   UNL     1      11.204   5.266   1.620  1.00  0.00           N  
HETATM   63  H   UNL     1       8.273   0.988   1.496  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.770   4.806  -1.817  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.056   3.735   0.871  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.514   3.151   3.071  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.501   1.548   4.939  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.356  -0.737   4.607  1.00  0.00           H  
HETATM   69  H   UNL     1      -9.223  -1.419   2.405  1.00  0.00           H  
HETATM   70  H   UNL     1      -9.244   0.187   0.539  1.00  0.00           H  
HETATM   71  H   UNL     1     -10.587   3.424   0.166  1.00  0.00           H  
HETATM   72  H   UNL     1     -10.552   1.792  -1.842  1.00  0.00           H  
HETATM   73  H   UNL     1      -9.864  -0.290  -2.903  1.00  0.00           H  
HETATM   74  H   UNL     1      -9.146  -2.753  -4.671  1.00  0.00           H  
HETATM   75  H   UNL     1      -9.511  -3.917  -3.375  1.00  0.00           H  
HETATM   76  H   UNL     1     -10.562  -2.503  -3.623  1.00  0.00           H  
HETATM   77  H   UNL     1      -6.588  -4.149  -3.243  1.00  0.00           H  
HETATM   78  H   UNL     1      -6.773  -4.537  -1.516  1.00  0.00           H  
HETATM   79  H   UNL     1      -8.176  -4.641  -2.607  1.00  0.00           H  
HETATM   80  H   UNL     1      -5.940  -2.391  -0.763  1.00  0.00           H  
HETATM   81  H   UNL     1      -5.255   0.097   1.683  1.00  0.00           H  
HETATM   82  H   UNL     1      -5.708  -1.484   1.004  1.00  0.00           H  
HETATM   83  H   UNL     1      -3.622   0.380  -0.213  1.00  0.00           H  
HETATM   84  H   UNL     1      -4.323  -2.379  -0.786  1.00  0.00           H  
HETATM   85  H   UNL     1      -3.284  -2.146   1.467  1.00  0.00           H  
HETATM   86  H   UNL     1      -2.592   0.616   2.038  1.00  0.00           H  
HETATM   87  H   UNL     1      -1.244  -0.292   0.155  1.00  0.00           H  
HETATM   88  H   UNL     1      -1.936  -3.053  -0.416  1.00  0.00           H  
HETATM   89  H   UNL     1      -0.585  -1.210   2.399  1.00  0.00           H  
HETATM   90  H   UNL     1      -0.858  -2.852   1.769  1.00  0.00           H  
HETATM   91  H   UNL     1       2.474  -0.468   2.755  1.00  0.00           H  
HETATM   92  H   UNL     1       4.234  -4.624  -0.694  1.00  0.00           H  
HETATM   93  H   UNL     1       7.626  -2.525   0.664  1.00  0.00           H  
HETATM   94  H   UNL     1       7.238  -3.618  -0.686  1.00  0.00           H  
HETATM   95  H   UNL     1       7.292  -1.632  -2.237  1.00  0.00           H  
HETATM   96  H   UNL     1       9.536  -2.921  -0.887  1.00  0.00           H  
HETATM   97  H   UNL     1      10.432  -2.625  -3.082  1.00  0.00           H  
HETATM   98  H   UNL     1      10.468  -0.933  -0.046  1.00  0.00           H  
HETATM   99  H   UNL     1      11.841  -1.321  -2.002  1.00  0.00           H  
HETATM  100  H   UNL     1       8.973   0.659  -2.204  1.00  0.00           H  
HETATM  101  H   UNL     1      12.343   4.123  -2.503  1.00  0.00           H  
HETATM  102  H   UNL     1      10.691   5.069   2.419  1.00  0.00           H  
HETATM  103  H   UNL     1      11.770   6.053   1.588  1.00  0.00           H  
CONECT    1   59    2    2    6                                       
CONECT    2   60    1    1    3                                       
CONECT    3    2   62    5    5                                       
CONECT    4   60   60   59   63                                       
CONECT    5    3    3   61                                            
CONECT    6    1   61   61                                            
CONECT    7    8    8                                                 
CONECT    8    7    7   14    9                                       
CONECT    9    8   10   64                                            
CONECT   10    9   12   11   11                                       
CONECT   11   10   10                                                 
CONECT   12   13   13   10                                            
CONECT   13   14   33   12   12                                       
CONECT   14   24   15    8   13                                       
CONECT   15   22   14   16   65                                       
CONECT   16   15   17   17   21                                       
CONECT   17   16   16   18   66                                       
CONECT   18   17   19   19   67                                       
CONECT   19   18   18   20   68                                       
CONECT   20   21   21   19   69                                       
CONECT   21   16   20   20   70                                       
CONECT   22   23   23   15   71                                       
CONECT   23   22   22   24   72                                       
CONECT   24   23   25   14                                            
CONECT   25   26   24   32   32                                       
CONECT   26   27   27   25   73                                       
CONECT   27   28   26   26   29                                       
CONECT   28   27   74   75   76                                       
CONECT   29   27   30   31   31                                       
CONECT   30   29   77   78   79                                       
CONECT   31   29   29   32   80                                       
CONECT   32   25   25   31   33                                       
CONECT   33   32   13   34                                            
CONECT   34   33   35   81   82                                       
CONECT   35   36   34   37   83                                       
CONECT   36   35   84                                                 
CONECT   37   35   38   39   85                                       
CONECT   38   37   86                                                 
CONECT   39   37   40   41   87                                       
CONECT   40   39   88                                                 
CONECT   41   39   42   89   90                                       
CONECT   42   41   43                                                 
CONECT   43   46   42   44   44                                       
CONECT   43   45                                                      
CONECT   44   43   43                                                 
CONECT   45   43   91                                                 
CONECT   46   47   43                                                 
CONECT   47   49   49   48   50                                       
CONECT   47   46                                                      
CONECT   48   47   92                                                 
CONECT   49   47   47                                                 
CONECT   50   47   51                                                 
CONECT   51   50   52   93   94                                       
CONECT   52   54   53   51   95                                       
CONECT   53   58   52                                                 
CONECT   54   56   55   52   96                                       
CONECT   55   54   97                                                 
CONECT   56   57   54   58   98                                       
CONECT   57   56   99                                                 
CONECT   58   56   59   53  100                                       
CONECT   59    4   58    1                                            
CONECT   60    4    4    2                                            
CONECT   61    6    6    5  101                                       
CONECT   62    3  102  103                                            
CONECT   63    4                                                      
CONECT   64    9                                                      
CONECT   65   15                                                      
CONECT   66   17                                                      
CONECT   67   18                                                      
CONECT   68   19                                                      
CONECT   69   20                                                      
CONECT   70   21                                                      
CONECT   71   22                                                      
CONECT   72   23                                                      
CONECT   73   26                                                      
CONECT   74   28                                                      
CONECT   75   28                                                      
CONECT   76   28                                                      
CONECT   77   30                                                      
CONECT   78   30                                                      
CONECT   79   30                                                      
CONECT   80   31                                                      
CONECT   81   34                                                      
CONECT   82   34                                                      
CONECT   83   35                                                      
CONECT   84   36                                                      
CONECT   85   37                                                      
CONECT   86   38                                                      
CONECT   87   39                                                      
CONECT   88   40                                                      
CONECT   89   41                                                      
CONECT   90   41                                                      
CONECT   91   45                                                      
CONECT   92   48                                                      
CONECT   93   51                                                      
CONECT   94   51                                                      
CONECT   95   52                                                      
CONECT   96   54                                                      
CONECT   97   55                                                      
CONECT   98   56                                                      
CONECT   99   57                                                      
CONECT  100   58                                                      
CONECT  101   61                                                      
CONECT  102   62                                                      
CONECT  103   62                                                      
MASTER        0    0    0    0    0    0    0    0  103    0  103    0
END
