COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.523  -1.031   1.532  1.00  0.00           C  
HETATM    2  C   UNL     1       5.700  -0.866   0.236  1.00  0.00           C  
HETATM    3  C   UNL     1       4.272  -0.175   1.895  1.00  0.00           C  
HETATM    4  C   UNL     1       5.562  -0.565   2.649  1.00  0.00           C  
HETATM    5  C   UNL     1       3.625   1.053   2.541  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.326   3.823  -0.189  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.778   3.498  -1.614  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.502   1.959  -1.467  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.123   3.177  -2.196  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.064   4.278  -1.947  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.662  -0.410  -1.372  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.879  -0.352  -0.221  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.542  -1.496   0.443  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.985  -2.734  -0.034  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.639  -3.977   0.658  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.794  -3.958   1.906  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.100  -5.148   0.146  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.889  -5.139  -1.023  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.777  -2.799  -1.196  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.110  -1.628  -1.859  1.00  0.00           C  
HETATM   21  C   UNL     1       7.327  -1.193  -1.676  1.00  0.00           C  
HETATM   22  C   UNL     1       8.366  -2.969  -2.700  1.00  0.00           C  
HETATM   23  C   UNL     1       8.832  -0.866  -3.531  1.00  0.00           C  
HETATM   24  C   UNL     1       7.969  -0.317  -2.567  1.00  0.00           C  
HETATM   25  C   UNL     1       6.739   0.889  -1.251  1.00  0.00           C  
HETATM   26  F   UNL     1      -2.550  -3.387   1.619  1.00  0.00           F  
HETATM   27  F   UNL     1      -4.437  -3.203   2.893  1.00  0.00           F  
HETATM   28  F   UNL     1      -3.612  -5.267   2.366  1.00  0.00           F  
HETATM   29  N   UNL     1       6.558  -0.404  -0.858  1.00  0.00           N  
HETATM   30  N   UNL     1       7.553  -2.499  -1.778  1.00  0.00           N  
HETATM   31  N   UNL     1       8.992  -2.185  -3.559  1.00  0.00           N  
HETATM   32  N   UNL     1       9.492  -0.054  -4.436  1.00  0.00           N  
HETATM   33  N   UNL     1       7.567   0.938  -2.253  1.00  0.00           N  
HETATM   34  O   UNL     1       6.888  -2.399   1.724  1.00  0.00           O  
HETATM   35  O   UNL     1       4.708   0.134   0.553  1.00  0.00           O  
HETATM   36  O   UNL     1       5.304  -1.632   3.564  1.00  0.00           O  
HETATM   37  O   UNL     1       2.412   1.368   1.855  1.00  0.00           O  
HETATM   38  O   UNL     1       0.131   2.583   1.370  1.00  0.00           O  
HETATM   39  O   UNL     1      -2.073   3.187   0.070  1.00  0.00           O  
HETATM   40  O   UNL     1      -4.087   2.098  -1.722  1.00  0.00           O  
HETATM   41  O   UNL     1      -4.879   5.069  -3.123  1.00  0.00           O  
HETATM   42  O   UNL     1      -6.267   2.915  -3.594  1.00  0.00           O  
HETATM   43  O   UNL     1      -5.994   0.736  -2.019  1.00  0.00           O  
HETATM   44  O   UNL     1      -6.203  -3.996  -1.653  1.00  0.00           O  
HETATM   45  O   UNL     1      -6.295  -6.195  -1.472  1.00  0.00           O  
HETATM   46  O   UNL     1      -2.174   2.614   2.634  1.00  0.00           O  
HETATM   47  O   UNL     1      -1.101   4.743   1.804  1.00  0.00           O  
HETATM   48  O   UNL     1       2.256   3.988   2.022  1.00  0.00           O  
HETATM   49  O   UNL     1       1.104   2.493   3.697  1.00  0.00           O  
HETATM   50  P   UNL     1       1.468   2.605   2.267  1.00  0.00           P  
HETATM   51  P   UNL     1      -1.300   3.313   1.477  1.00  0.00           P  
HETATM   52  H   UNL     1       7.412  -0.400   1.503  1.00  0.00           H  
HETATM   53  H   UNL     1       5.220  -1.808  -0.031  1.00  0.00           H  
HETATM   54  H   UNL     1       3.571  -1.010   1.883  1.00  0.00           H  
HETATM   55  H   UNL     1       5.974   0.297   3.173  1.00  0.00           H  
HETATM   56  H   UNL     1       3.406   0.840   3.587  1.00  0.00           H  
HETATM   57  H   UNL     1       4.309   1.899   2.478  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.216   4.902  -0.080  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.071   3.460   0.520  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.991   3.761  -2.321  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.707   2.006  -0.397  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.080   3.449  -1.752  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.357   4.906  -1.106  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.537   0.603   0.148  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.934  -1.445   1.335  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.862  -6.082   0.632  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.717  -1.664  -2.751  1.00  0.00           H  
HETATM   68  H   UNL     1       8.525  -4.036  -2.758  1.00  0.00           H  
HETATM   69  H   UNL     1       6.264   1.747  -0.797  1.00  0.00           H  
HETATM   70  H   UNL     1       9.361   0.907  -4.410  1.00  0.00           H  
HETATM   71  H   UNL     1      10.085  -0.445  -5.096  1.00  0.00           H  
HETATM   72  H   UNL     1       7.407  -2.559   2.524  1.00  0.00           H  
HETATM   73  H   UNL     1       6.080  -1.918   4.065  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.658   5.582  -3.379  1.00  0.00           H  
HETATM   75  H   UNL     1      -6.852   2.172  -3.796  1.00  0.00           H  
HETATM   76  H   UNL     1      -2.343   1.674   2.485  1.00  0.00           H  
HETATM   77  H   UNL     1       2.526   4.129   1.104  1.00  0.00           H  
CONECT    1    4   34    2   52                                       
CONECT    2    1   35   29   53                                       
CONECT    3    4    5   35   54                                       
CONECT    4   36    3    1   55                                       
CONECT    5    3   37   56   57                                       
CONECT    6   39    7   58   59                                       
CONECT    7    6   10   40   60                                       
CONECT    8   40    9   43   61                                       
CONECT    9   10    8   42   62                                       
CONECT   10    7   41    9   63                                       
CONECT   11   43   20   20   12                                       
CONECT   12   11   13   13   64                                       
CONECT   13   12   12   14   65                                       
CONECT   14   19   19   13   15                                       
CONECT   15   14   17   17   16                                       
CONECT   16   26   15   28   27                                       
CONECT   17   18   15   15   66                                       
CONECT   18   44   45   45   17                                       
CONECT   19   20   44   14   14                                       
CONECT   20   11   11   19   67                                       
CONECT   21   29   30   30   24                                       
CONECT   22   30   31   31   68                                       
CONECT   23   24   24   31   32                                       
CONECT   24   21   33   23   23                                       
CONECT   25   29   33   33   69                                       
CONECT   26   16                                                      
CONECT   27   16                                                      
CONECT   28   16                                                      
CONECT   29    2   25   21                                            
CONECT   30   21   21   22                                            
CONECT   31   22   22   23                                            
CONECT   32   23   70   71                                            
CONECT   33   25   25   24                                            
CONECT   34    1   72                                                 
CONECT   35    3    2                                                 
CONECT   36    4   73                                                 
CONECT   37    5   50                                                 
CONECT   38   51   50                                                 
CONECT   39   51    6                                                 
CONECT   40    7    8                                                 
CONECT   41   10   74                                                 
CONECT   42    9   75                                                 
CONECT   43    8   11                                                 
CONECT   44   19   18                                                 
CONECT   45   18   18                                                 
CONECT   46   51   76                                                 
CONECT   47   51   51                                                 
CONECT   48   50   77                                                 
CONECT   49   50   50                                                 
CONECT   50   38   37   49   49                                       
CONECT   50   48                                                      
CONECT   51   47   47   46   39                                       
CONECT   51   38                                                      
CONECT   52    1                                                      
CONECT   53    2                                                      
CONECT   54    3                                                      
CONECT   55    4                                                      
CONECT   56    5                                                      
CONECT   57    5                                                      
CONECT   58    6                                                      
CONECT   59    6                                                      
CONECT   60    7                                                      
CONECT   61    8                                                      
CONECT   62    9                                                      
CONECT   63   10                                                      
CONECT   64   12                                                      
CONECT   65   13                                                      
CONECT   66   17                                                      
CONECT   67   20                                                      
CONECT   68   22                                                      
CONECT   69   25                                                      
CONECT   70   32                                                      
CONECT   71   32                                                      
CONECT   72   34                                                      
CONECT   73   36                                                      
CONECT   74   41                                                      
CONECT   75   42                                                      
CONECT   76   46                                                      
CONECT   77   48                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
