COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.295  -1.742  -1.626  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.856  -3.829   1.143  1.00  0.00           C  
HETATM    3  C   UNL     1       8.029   0.743   1.986  1.00  0.00           C  
HETATM    4  C   UNL     1       9.738   0.222  -1.237  1.00  0.00           C  
HETATM    5  C   UNL     1       7.075  -0.202  -1.974  1.00  0.00           C  
HETATM    6  C   UNL     1       9.031   0.647   1.069  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.199  -1.932  -0.259  1.00  0.00           C  
HETATM    8  C   UNL     1       8.728   0.330  -0.266  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.364  -1.490   0.959  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.966  -2.130   0.327  1.00  0.00           C  
HETATM   11  C   UNL     1       0.287  -0.235   1.029  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.618  -1.268   0.359  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.552   0.696   0.502  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.673   2.775   0.906  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.823   3.498   0.200  1.00  0.00           C  
HETATM   16  C   UNL     1       9.406  -0.086  -2.521  1.00  0.00           C  
HETATM   17  C   UNL     1       8.079  -0.297  -2.888  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.158  -1.750  -2.413  1.00  0.00           C  
HETATM   19  C   UNL     1       0.004  -2.788   1.342  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.919  -1.948  -1.837  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.097  -3.624   0.559  1.00  0.00           C  
HETATM   22  C   UNL     1       6.701   0.533   1.623  1.00  0.00           C  
HETATM   23  C   UNL     1       7.378   0.114  -0.640  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.816  -2.139  -0.461  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.488  -2.352   0.164  1.00  0.00           C  
HETATM   26  C   UNL     1       6.366   0.222   0.335  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.264   2.131   0.381  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.781   1.020  -0.755  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.930   1.760  -1.445  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.862  -2.336   1.817  1.00  0.00           C  
HETATM   31  C   UNL     1       1.663   0.022   1.588  1.00  0.00           C  
HETATM   32  C   UNL     1       2.701  -0.114   0.472  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.861   0.737  -0.537  1.00  0.00           C  
HETATM   34  C   UNL     1      -3.763   1.329   0.548  1.00  0.00           C  
HETATM   35  C   UNL     1       4.097   0.147   1.039  1.00  0.00           C  
HETATM   36  N   UNL     1      -1.714   0.074   0.090  1.00  0.00           N  
HETATM   37  N   UNL     1      -4.912   1.995  -0.080  1.00  0.00           N  
HETATM   38  O   UNL     1       0.799   2.573   0.771  1.00  0.00           O  
HETATM   39  O   UNL     1      -7.639   2.538  -0.476  1.00  0.00           O  
HETATM   40  O   UNL     1      -1.179   2.959  -0.162  1.00  0.00           O  
HETATM   41  O   UNL     1       5.067   0.020  -0.003  1.00  0.00           O  
HETATM   42  H   UNL     1      -7.263  -1.591  -2.081  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.564  -4.826   1.441  1.00  0.00           H  
HETATM   44  H   UNL     1       8.268   0.983   3.011  1.00  0.00           H  
HETATM   45  H   UNL     1      10.771   0.384  -0.967  1.00  0.00           H  
HETATM   46  H   UNL     1       6.051  -0.368  -2.273  1.00  0.00           H  
HETATM   47  H   UNL     1      10.056   0.814   1.367  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.091  -1.924   0.351  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.016   3.508   1.375  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.075   2.107   1.668  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.424   4.032   0.936  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.418   4.206  -0.523  1.00  0.00           H  
HETATM   53  H   UNL     1      10.184  -0.167  -3.266  1.00  0.00           H  
HETATM   54  H   UNL     1       7.843  -0.540  -3.914  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.239  -1.601  -3.479  1.00  0.00           H  
HETATM   56  H   UNL     1       0.968  -2.963   1.794  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.032  -1.955  -2.453  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.764  -4.460   0.410  1.00  0.00           H  
HETATM   59  H   UNL     1       5.926   0.615   2.370  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.186   0.323  -0.021  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.203   0.470  -1.498  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.529   2.417  -2.216  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.608   1.037  -1.899  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.937  -3.400   2.043  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.904  -1.956   2.170  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.671  -1.801   2.315  1.00  0.00           H  
HETATM   67  H   UNL     1       1.704   1.030   2.001  1.00  0.00           H  
HETATM   68  H   UNL     1       1.877  -0.702   2.374  1.00  0.00           H  
HETATM   69  H   UNL     1       2.659  -1.122   0.059  1.00  0.00           H  
HETATM   70  H   UNL     1       2.486   0.610  -0.314  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.425   0.012  -1.123  1.00  0.00           H  
HETATM   72  H   UNL     1      -2.506   1.535  -1.190  1.00  0.00           H  
HETATM   73  H   UNL     1      -4.117   0.531   1.201  1.00  0.00           H  
HETATM   74  H   UNL     1      -3.198   2.055   1.134  1.00  0.00           H  
HETATM   75  H   UNL     1       4.139   1.155   1.453  1.00  0.00           H  
HETATM   76  H   UNL     1       4.312  -0.577   1.825  1.00  0.00           H  
HETATM   77  H   UNL     1      -0.945   3.895  -0.221  1.00  0.00           H  
CONECT    1   18   18    7   42                                       
CONECT    2   21   19   19   43                                       
CONECT    3   22   22    6   44                                       
CONECT    4    8   16   16   45                                       
CONECT    5   23   17   17   46                                       
CONECT    6    3    8    8   47                                       
CONECT    7    1   10   10   48                                       
CONECT    8    6    6   23    4                                       
CONECT    9   12   12   19   11                                       
CONECT   10    7    7   24   30                                       
CONECT   11   13   13    9   31                                       
CONECT   12   25   36    9    9                                       
CONECT   13   36   27   11   11                                       
CONECT   14   15   37   49   50                                       
CONECT   15   39   14   51   52                                       
CONECT   16    4    4   17   53                                       
CONECT   17    5    5   16   54                                       
CONECT   18    1    1   20   55                                       
CONECT   19    2    2    9   56                                       
CONECT   20   18   24   24   57                                       
CONECT   21   25   25    2   58                                       
CONECT   22    3    3   26   59                                       
CONECT   23   26   26    8    5                                       
CONECT   24   20   20   10   25                                       
CONECT   25   24   21   21   12                                       
CONECT   26   22   41   23   23                                       
CONECT   27   13   38   38   40                                       
CONECT   28   29   37   60   61                                       
CONECT   29   39   28   62   63                                       
CONECT   30   10   64   65   66                                       
CONECT   31   11   32   67   68                                       
CONECT   32   35   31   69   70                                       
CONECT   33   34   36   71   72                                       
CONECT   34   37   33   73   74                                       
CONECT   35   32   41   75   76                                       
CONECT   36   33   12   13                                            
CONECT   37   14   28   34                                            
CONECT   38   27   27                                                 
CONECT   39   15   29                                                 
CONECT   40   27   77                                                 
CONECT   41   35   26                                                 
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    3                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   32                                                      
CONECT   70   32                                                      
CONECT   71   33                                                      
CONECT   72   33                                                      
CONECT   73   34                                                      
CONECT   74   34                                                      
CONECT   75   35                                                      
CONECT   76   35                                                      
CONECT   77   40                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
