COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.871   0.347   2.638  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.634  -4.641  -0.743  1.00  0.00           C  
HETATM    3  C   UNL     1       0.834  -4.545  -1.162  1.00  0.00           C  
HETATM    4  C   UNL     1       1.069  -3.225  -1.900  1.00  0.00           C  
HETATM    5  C   UNL     1       2.710  -1.485  -1.624  1.00  0.00           C  
HETATM    6  C   UNL     1       4.127  -1.000  -1.446  1.00  0.00           C  
HETATM    7  C   UNL     1       3.150   1.209  -1.455  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.364   5.507   0.417  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.277   4.375  -0.369  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.409   3.380  -0.385  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.662   1.023   0.067  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.295  -0.245   0.792  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.488  -0.728   1.618  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.111  -2.016   2.353  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.214  -2.332   0.274  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.818  -3.432  -0.676  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.317  -5.301  -0.118  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.332  -3.306  -1.016  1.00  0.00           C  
HETATM   19  C   UNL     1       3.070   2.631  -0.964  1.00  0.00           C  
HETATM   20  C   UNL     1       1.126   4.035  -1.162  1.00  0.00           C  
HETATM   21  C   UNL     1       0.117   4.817  -1.962  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.110   5.061  -1.121  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.151   4.152  -1.139  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.198   6.195  -0.335  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.324   6.418   0.435  1.00  0.00           C  
HETATM   26  C   UNL     1       2.575   2.648   0.484  1.00  0.00           C  
HETATM   27  C   UNL     1       3.503   1.793   1.349  1.00  0.00           C  
HETATM   28  C   UNL     1       3.091   1.921   2.818  1.00  0.00           C  
HETATM   29  C   UNL     1       4.019   1.066   3.683  1.00  0.00           C  
HETATM   30  C   UNL     1       4.856  -1.905  -0.450  1.00  0.00           C  
HETATM   31  C   UNL     1       6.326  -1.489  -0.364  1.00  0.00           C  
HETATM   32  C   UNL     1       7.055  -2.394   0.631  1.00  0.00           C  
HETATM   33  C   UNL     1       8.524  -1.977   0.716  1.00  0.00           C  
HETATM   34  N   UNL     1      -3.985   2.169   0.348  1.00  0.00           N  
HETATM   35  N   UNL     1      -3.934  -1.275  -0.209  1.00  0.00           N  
HETATM   36  N   UNL     1      -3.067  -4.732  -0.049  1.00  0.00           N  
HETATM   37  N   UNL     1      -5.333  -4.650  -0.777  1.00  0.00           N  
HETATM   38  N   UNL     1      -4.538  -6.457   0.440  1.00  0.00           N  
HETATM   39  N   UNL     1       2.485  -2.829  -1.720  1.00  0.00           N  
HETATM   40  N   UNL     1       4.098   0.383  -0.931  1.00  0.00           N  
HETATM   41  N   UNL     1       2.124   3.378  -1.824  1.00  0.00           N  
HETATM   42  N   UNL     1       3.623   1.188   5.093  1.00  0.00           N  
HETATM   43  N   UNL     1       9.224  -2.846   1.672  1.00  0.00           N  
HETATM   44  O   UNL     1      -5.553   1.023  -0.757  1.00  0.00           O  
HETATM   45  O   UNL     1      -2.900  -2.383   1.444  1.00  0.00           O  
HETATM   46  O   UNL     1       1.790  -0.697  -1.682  1.00  0.00           O  
HETATM   47  O   UNL     1       2.383   0.806  -2.303  1.00  0.00           O  
HETATM   48  O   UNL     1       1.055   3.990   0.048  1.00  0.00           O  
HETATM   49  H   UNL     1      -6.721   0.002   3.227  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.025   0.539   3.298  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.140   1.264   2.114  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.124  -5.430  -1.314  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.694  -4.871   0.320  1.00  0.00           H  
HETATM   54  H   UNL     1       1.468  -4.584  -0.276  1.00  0.00           H  
HETATM   55  H   UNL     1       1.079  -5.378  -1.821  1.00  0.00           H  
HETATM   56  H   UNL     1       0.858  -3.356  -2.961  1.00  0.00           H  
HETATM   57  H   UNL     1       0.416  -2.455  -1.489  1.00  0.00           H  
HETATM   58  H   UNL     1       4.643  -1.022  -2.405  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.244   5.681   1.019  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.283   3.813   0.100  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.651   3.118  -1.415  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.444  -0.058   1.447  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.333  -0.921   0.958  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.265  -1.824   3.013  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.961  -2.361   2.942  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.838  -2.782   1.627  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.407  -3.352  -1.590  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.882  -2.528  -0.399  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.220  -3.046  -2.069  1.00  0.00           H  
HETATM   70  H   UNL     1       4.056   3.093  -1.019  1.00  0.00           H  
HETATM   71  H   UNL     1       0.550   5.772  -2.259  1.00  0.00           H  
HETATM   72  H   UNL     1      -0.159   4.250  -2.851  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.085   3.267  -1.755  1.00  0.00           H  
HETATM   74  H   UNL     1      -0.385   6.907  -0.322  1.00  0.00           H  
HETATM   75  H   UNL     1      -2.392   7.304   1.049  1.00  0.00           H  
HETATM   76  H   UNL     1       2.573   3.673   0.855  1.00  0.00           H  
HETATM   77  H   UNL     1       1.564   2.244   0.526  1.00  0.00           H  
HETATM   78  H   UNL     1       3.430   0.751   1.041  1.00  0.00           H  
HETATM   79  H   UNL     1       4.530   2.137   1.230  1.00  0.00           H  
HETATM   80  H   UNL     1       3.164   2.963   3.126  1.00  0.00           H  
HETATM   81  H   UNL     1       2.063   1.577   2.938  1.00  0.00           H  
HETATM   82  H   UNL     1       3.945   0.023   3.375  1.00  0.00           H  
HETATM   83  H   UNL     1       5.046   1.409   3.563  1.00  0.00           H  
HETATM   84  H   UNL     1       4.393  -1.811   0.532  1.00  0.00           H  
HETATM   85  H   UNL     1       4.790  -2.940  -0.785  1.00  0.00           H  
HETATM   86  H   UNL     1       6.788  -1.583  -1.347  1.00  0.00           H  
HETATM   87  H   UNL     1       6.391  -0.454  -0.030  1.00  0.00           H  
HETATM   88  H   UNL     1       6.593  -2.299   1.613  1.00  0.00           H  
HETATM   89  H   UNL     1       6.989  -3.429   0.296  1.00  0.00           H  
HETATM   90  H   UNL     1       8.987  -2.071  -0.266  1.00  0.00           H  
HETATM   91  H   UNL     1       8.590  -0.942   1.051  1.00  0.00           H  
HETATM   92  H   UNL     1      -3.262   2.190   0.994  1.00  0.00           H  
HETATM   93  H   UNL     1      -4.190  -1.204  -1.142  1.00  0.00           H  
HETATM   94  H   UNL     1      -2.351  -5.191   0.416  1.00  0.00           H  
HETATM   95  H   UNL     1      -5.168  -3.789  -1.193  1.00  0.00           H  
HETATM   96  H   UNL     1      -6.215  -5.051  -0.826  1.00  0.00           H  
HETATM   97  H   UNL     1      -3.822  -6.917   0.905  1.00  0.00           H  
HETATM   98  H   UNL     1       3.203  -3.479  -1.672  1.00  0.00           H  
HETATM   99  H   UNL     1       4.721   0.688  -0.253  1.00  0.00           H  
HETATM  100  H   UNL     1       2.207   3.399  -2.790  1.00  0.00           H  
HETATM  101  H   UNL     1       2.654   0.937   5.220  1.00  0.00           H  
HETATM  102  H   UNL     1       4.221   0.632   5.686  1.00  0.00           H  
HETATM  103  H   UNL     1      10.198  -2.591   1.747  1.00  0.00           H  
HETATM  104  H   UNL     1       8.775  -2.826   2.575  1.00  0.00           H  
CONECT    1   13   49   50   51                                       
CONECT    2   18    3   52   53                                       
CONECT    3    2    4   54   55                                       
CONECT    4   39    3   56   57                                       
CONECT    5    6   46   46   39                                       
CONECT    6   30   40    5   58                                       
CONECT    7   40   19   47   47                                       
CONECT    8   25    9    9   59                                       
CONECT    9    8    8   23   10                                       
CONECT   10    9   34   60   61                                       
CONECT   11   44   44   34   12                                       
CONECT   12   11   35   13   62                                       
CONECT   13   12   14    1   63                                       
CONECT   14   13   64   65   66                                       
CONECT   15   45   45   16   35                                       
CONECT   16   15   36   18   67                                       
CONECT   17   37   36   38   38                                       
CONECT   18   16    2   68   69                                       
CONECT   19   41   26    7   70                                       
CONECT   20   21   41   48   48                                       
CONECT   21   22   20   71   72                                       
CONECT   22   24   21   23   23                                       
CONECT   23   22   22    9   73                                       
CONECT   24   25   25   22   74                                       
CONECT   25   24   24    8   75                                       
CONECT   26   27   19   76   77                                       
CONECT   27   28   26   78   79                                       
CONECT   28   29   27   80   81                                       
CONECT   29   42   28   82   83                                       
CONECT   30   31    6   84   85                                       
CONECT   31   32   30   86   87                                       
CONECT   32   33   31   88   89                                       
CONECT   33   43   32   90   91                                       
CONECT   34   10   11   92                                            
CONECT   35   15   12   93                                            
CONECT   36   16   17   94                                            
CONECT   37   17   95   96                                            
CONECT   38   17   17   97                                            
CONECT   39    5    4   98                                            
CONECT   40    6    7   99                                            
CONECT   41   20   19  100                                            
CONECT   42   29  101  102                                            
CONECT   43   33  103  104                                            
CONECT   44   11   11                                                 
CONECT   45   15   15                                                 
CONECT   46    5    5                                                 
CONECT   47    7    7                                                 
CONECT   48   20   20                                                 
CONECT   49    1                                                      
CONECT   50    1                                                      
CONECT   51    1                                                      
CONECT   52    2                                                      
CONECT   53    2                                                      
CONECT   54    3                                                      
CONECT   55    3                                                      
CONECT   56    4                                                      
CONECT   57    4                                                      
CONECT   58    6                                                      
CONECT   59    8                                                      
CONECT   60   10                                                      
CONECT   61   10                                                      
CONECT   62   12                                                      
CONECT   63   13                                                      
CONECT   64   14                                                      
CONECT   65   14                                                      
CONECT   66   14                                                      
CONECT   67   16                                                      
CONECT   68   18                                                      
CONECT   69   18                                                      
CONECT   70   19                                                      
CONECT   71   21                                                      
CONECT   72   21                                                      
CONECT   73   23                                                      
CONECT   74   24                                                      
CONECT   75   25                                                      
CONECT   76   26                                                      
CONECT   77   26                                                      
CONECT   78   27                                                      
CONECT   79   27                                                      
CONECT   80   28                                                      
CONECT   81   28                                                      
CONECT   82   29                                                      
CONECT   83   29                                                      
CONECT   84   30                                                      
CONECT   85   30                                                      
CONECT   86   31                                                      
CONECT   87   31                                                      
CONECT   88   32                                                      
CONECT   89   32                                                      
CONECT   90   33                                                      
CONECT   91   33                                                      
CONECT   92   34                                                      
CONECT   93   35                                                      
CONECT   94   36                                                      
CONECT   95   37                                                      
CONECT   96   37                                                      
CONECT   97   38                                                      
CONECT   98   39                                                      
CONECT   99   40                                                      
CONECT  100   41                                                      
CONECT  101   42                                                      
CONECT  102   42                                                      
CONECT  103   43                                                      
CONECT  104   43                                                      
MASTER        0    0    0    0    0    0    0    0  104    0  104    0
END
