COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       6.485  -0.744  -1.852  1.00  0.00           F  
HETATM    2  C   UNL     1       6.651   0.384  -1.128  1.00  0.00           C  
HETATM    3  C   UNL     1       7.444   1.411  -1.617  1.00  0.00           C  
HETATM    4  F   UNL     1       8.050   1.283  -2.817  1.00  0.00           F  
HETATM    5  C   UNL     1       7.613   2.569  -0.875  1.00  0.00           C  
HETATM    6  F   UNL     1       8.385   3.570  -1.351  1.00  0.00           F  
HETATM    7  C   UNL     1       6.990   2.699   0.356  1.00  0.00           C  
HETATM    8  F   UNL     1       7.155   3.828   1.080  1.00  0.00           F  
HETATM    9  C   UNL     1       6.198   1.672   0.844  1.00  0.00           C  
HETATM   10  F   UNL     1       5.586   1.801   2.041  1.00  0.00           F  
HETATM   11  C   UNL     1       6.025   0.518   0.099  1.00  0.00           C  
HETATM   12  C   UNL     1       5.163  -0.599   0.630  1.00  0.00           C  
HETATM   13  C   UNL     1       3.718  -0.391   0.169  1.00  0.00           C  
HETATM   14  C   UNL     1       2.814  -1.457   0.818  1.00  0.00           C  
HETATM   15  N   UNL     1       1.424  -1.170   0.482  1.00  0.00           N1+
HETATM   16  C   UNL     1       0.931   0.036   0.680  1.00  0.00           C  
HETATM   17  C   UNL     1       1.533   0.980   1.653  1.00  0.00           C  
HETATM   18  O   UNL     1       2.311   0.609   2.509  1.00  0.00           O  
HETATM   19  N   UNL     1       1.156   2.276   1.604  1.00  0.00           N  
HETATM   20  C   UNL     1       3.251  -2.802   0.251  1.00  0.00           C  
HETATM   21  C   UNL     1       2.259  -3.912   0.622  1.00  0.00           C  
HETATM   22  C   UNL     1       2.299  -4.147   2.132  1.00  0.00           C  
HETATM   23  C   UNL     1       2.754  -5.171  -0.107  1.00  0.00           C  
HETATM   24  C   UNL     1       0.879  -3.512   0.181  1.00  0.00           C  
HETATM   25  C   UNL     1       0.589  -2.126   0.060  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.127  -4.391  -0.034  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.113  -5.814   0.473  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.316  -4.010  -0.665  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.316  -5.076  -1.035  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.589  -2.712  -0.952  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.700  -1.720  -0.511  1.00  0.00           C  
HETATM   32  N   UNL     1      -1.037  -0.424  -0.552  1.00  0.00           N1+
HETATM   33  C   UNL     1      -0.269   0.460   0.050  1.00  0.00           C  
HETATM   34  N   UNL     1      -0.586   1.806   0.088  1.00  0.00           N  
HETATM   35  C   UNL     1       0.151   2.670   0.811  1.00  0.00           C  
HETATM   36  O   UNL     1      -0.107   3.855   0.735  1.00  0.00           O  
HETATM   37  C   UNL     1      -2.258   0.000  -1.243  1.00  0.00           C  
HETATM   38  C   UNL     1      -3.430  -0.009  -0.260  1.00  0.00           C  
HETATM   39  O   UNL     1      -3.683  -1.348   0.168  1.00  0.00           O  
HETATM   40  C   UNL     1      -4.677   0.552  -0.947  1.00  0.00           C  
HETATM   41  O   UNL     1      -4.424   1.891  -1.375  1.00  0.00           O  
HETATM   42  C   UNL     1      -5.849   0.543   0.037  1.00  0.00           C  
HETATM   43  O   UNL     1      -6.102  -0.796   0.465  1.00  0.00           O  
HETATM   44  C   UNL     1      -7.096   1.104  -0.650  1.00  0.00           C  
HETATM   45  O   UNL     1      -8.158   1.205   0.300  1.00  0.00           O  
HETATM   46  P   UNL     1      -9.623   1.757  -0.078  1.00  0.00           P  
HETATM   47  O   UNL     1     -10.520   1.855   1.255  1.00  0.00           O  
HETATM   48  O   UNL     1      -9.501   3.099  -0.690  1.00  0.00           O  
HETATM   49  O   UNL     1     -10.322   0.752  -1.123  1.00  0.00           O  
HETATM   50  H   UNL     1       5.531  -1.553   0.252  1.00  0.00           H  
HETATM   51  H   UNL     1       5.200  -0.600   1.719  1.00  0.00           H  
HETATM   52  H   UNL     1       3.382   0.602   0.468  1.00  0.00           H  
HETATM   53  H   UNL     1       3.666  -0.481  -0.916  1.00  0.00           H  
HETATM   54  H   UNL     1       2.958  -1.433   1.894  1.00  0.00           H  
HETATM   55  H   UNL     1       1.621   2.929   2.150  1.00  0.00           H  
HETATM   56  H   UNL     1       3.319  -2.733  -0.839  1.00  0.00           H  
HETATM   57  H   UNL     1       4.238  -3.060   0.645  1.00  0.00           H  
HETATM   58  H   UNL     1       1.601  -4.942   2.395  1.00  0.00           H  
HETATM   59  H   UNL     1       3.307  -4.435   2.429  1.00  0.00           H  
HETATM   60  H   UNL     1       2.016  -3.230   2.649  1.00  0.00           H  
HETATM   61  H   UNL     1       2.111  -6.014   0.146  1.00  0.00           H  
HETATM   62  H   UNL     1       2.725  -5.002  -1.184  1.00  0.00           H  
HETATM   63  H   UNL     1       3.777  -5.389   0.199  1.00  0.00           H  
HETATM   64  H   UNL     1       0.267  -6.474  -0.307  1.00  0.00           H  
HETATM   65  H   UNL     1       0.531  -5.881   1.350  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.125  -6.115   0.741  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.009  -5.227  -0.208  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.869  -4.763  -1.921  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.791  -6.008  -1.245  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.476  -2.483  -1.521  1.00  0.00           H  
HETATM   71  H   UNL     1      -1.336   2.171  -0.403  1.00  0.00           H  
HETATM   72  H   UNL     1      -2.122   1.007  -1.638  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.468  -0.686  -2.064  1.00  0.00           H  
HETATM   74  H   UNL     1      -3.184   0.608   0.604  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.910  -1.954  -0.550  1.00  0.00           H  
HETATM   76  H   UNL     1      -4.924  -0.065  -1.811  1.00  0.00           H  
HETATM   77  H   UNL     1      -4.197   2.497  -0.656  1.00  0.00           H  
HETATM   78  H   UNL     1      -5.602   1.160   0.901  1.00  0.00           H  
HETATM   79  H   UNL     1      -6.328  -1.403  -0.254  1.00  0.00           H  
HETATM   80  H   UNL     1      -6.875   2.091  -1.055  1.00  0.00           H  
HETATM   81  H   UNL     1      -7.394   0.438  -1.460  1.00  0.00           H  
HETATM   82  H   UNL     1     -11.417   2.181   1.102  1.00  0.00           H  
HETATM   83  H   UNL     1     -10.435  -0.148  -0.789  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2   11    1    3    3                                       
CONECT    3    2    2    5    4                                       
CONECT    4    3                                                      
CONECT    5    7    7    3    6                                       
CONECT    6    5                                                      
CONECT    7    9    8    5    5                                       
CONECT    8    7                                                      
CONECT    9   10   11   11    7                                       
CONECT   10    9                                                      
CONECT   11   12    9    9    2                                       
CONECT   12   13   11   50   51                                       
CONECT   13   14   12   52   53                                       
CONECT   14   20   15   13   54                                       
CONECT   15   25   14   16   16                                       
CONECT   16   15   15   33   17                                       
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   35   55                                            
CONECT   20   21   14   56   57                                       
CONECT   21   23   22   24   20                                       
CONECT   22   21   58   59   60                                       
CONECT   23   21   61   62   63                                       
CONECT   24   26   21   25   25                                       
CONECT   25   24   24   31   15                                       
CONECT   26   27   28   28   24                                       
CONECT   27   26   64   65   66                                       
CONECT   28   29   26   26   30                                       
CONECT   29   28   67   68   69                                       
CONECT   30   28   31   31   70                                       
CONECT   31   30   30   25   32                                       
CONECT   32   31   37   33   33                                       
CONECT   33   32   32   16   34                                       
CONECT   34   33   35   71                                            
CONECT   35   34   19   36   36                                       
CONECT   36   35   35                                                 
CONECT   37   32   38   72   73                                       
CONECT   38   39   37   40   74                                       
CONECT   39   38   75                                                 
CONECT   40   38   42   41   76                                       
CONECT   41   40   77                                                 
CONECT   42   40   43   44   78                                       
CONECT   43   42   79                                                 
CONECT   44   42   45   80   81                                       
CONECT   45   44   46                                                 
CONECT   46   45   48   48   47                                       
CONECT   46   49                                                      
CONECT   47   46   82                                                 
CONECT   48   46   46                                                 
CONECT   49   46   83                                                 
CONECT   50   12                                                      
CONECT   51   12                                                      
CONECT   52   13                                                      
CONECT   53   13                                                      
CONECT   54   14                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   27                                                      
CONECT   67   29                                                      
CONECT   68   29                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   34                                                      
CONECT   72   37                                                      
CONECT   73   37                                                      
CONECT   74   38                                                      
CONECT   75   39                                                      
CONECT   76   40                                                      
CONECT   77   41                                                      
CONECT   78   42                                                      
CONECT   79   43                                                      
CONECT   80   44                                                      
CONECT   81   44                                                      
CONECT   82   47                                                      
CONECT   83   49                                                      
MASTER        0    0    0    0    0    0    0    0   83    0   83    0
END
