COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.962  -1.677  -0.340  1.00  0.00           C  
HETATM    2  C   UNL     1       6.187   0.048   1.457  1.00  0.00           C  
HETATM    3  C   UNL     1       8.427  -0.953   0.966  1.00  0.00           C  
HETATM    4  C   UNL     1      10.556  -0.272   0.032  1.00  0.00           C  
HETATM    5  C   UNL     1       9.456   2.248  -0.733  1.00  0.00           C  
HETATM    6  C   UNL     1       8.783   1.352   0.310  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.418  -1.416  -1.103  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.657   2.022   0.023  1.00  0.00           C  
HETATM    9  O   UNL     1      -4.528  -1.088  -1.588  1.00  0.00           O  
HETATM   10  C   UNL     1      -3.988  -0.337  -0.799  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.529  -0.412  -0.589  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.908   0.453   0.319  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.558   0.387   0.510  1.00  0.00           C  
HETATM   14  C   UNL     1       0.205  -0.548  -0.199  1.00  0.00           C  
HETATM   15  C   UNL     1       1.621  -0.618   0.002  1.00  0.00           C  
HETATM   16  C   UNL     1       2.782  -0.674   0.166  1.00  0.00           C  
HETATM   17  C   UNL     1       4.198  -0.744   0.366  1.00  0.00           C  
HETATM   18  C   UNL     1       6.326  -1.738  -0.141  1.00  0.00           C  
HETATM   19  C   UNL     1       6.937  -0.879   0.755  1.00  0.00           C  
HETATM   20  C   UNL     1       4.823   0.121   1.269  1.00  0.00           C  
HETATM   21  N   UNL     1       9.102  -0.054   0.020  1.00  0.00           N  
HETATM   22  C   UNL     1      11.211   0.641  -1.008  1.00  0.00           C  
HETATM   23  O   UNL     1      10.865   2.000  -0.729  1.00  0.00           O  
HETATM   24  C   UNL     1      -1.768  -1.347  -1.297  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.722   0.565  -0.116  1.00  0.00           N  
HETATM   26  C   UNL     1      -6.170   0.639  -0.325  1.00  0.00           C  
HETATM   27  O   UNL     1      -6.056   2.690   0.838  1.00  0.00           O  
HETATM   28  N   UNL     1      -7.761   2.517  -0.571  1.00  0.00           N  
HETATM   29  O   UNL     1      -8.157   3.855  -0.328  1.00  0.00           O  
HETATM   30  C   UNL     1      -6.868  -0.388   0.569  1.00  0.00           C  
HETATM   31  O   UNL     1      -6.516  -0.148   1.933  1.00  0.00           O  
HETATM   32  C   UNL     1      -6.426  -1.797   0.169  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.383  -0.262   0.403  1.00  0.00           C  
HETATM   34  F   UNL     1      -7.063  -2.736   0.987  1.00  0.00           F  
HETATM   35  F   UNL     1      -6.770  -2.032  -1.167  1.00  0.00           F  
HETATM   36  H   UNL     1       4.486  -2.352  -1.036  1.00  0.00           H  
HETATM   37  H   UNL     1       6.671   0.715   2.155  1.00  0.00           H  
HETATM   38  H   UNL     1       8.665  -0.651   1.987  1.00  0.00           H  
HETATM   39  H   UNL     1       8.767  -1.975   0.802  1.00  0.00           H  
HETATM   40  H   UNL     1      10.951  -0.039   1.020  1.00  0.00           H  
HETATM   41  H   UNL     1      10.770  -1.312  -0.210  1.00  0.00           H  
HETATM   42  H   UNL     1       9.050   2.026  -1.719  1.00  0.00           H  
HETATM   43  H   UNL     1       9.270   3.294  -0.489  1.00  0.00           H  
HETATM   44  H   UNL     1       9.150   1.610   1.304  1.00  0.00           H  
HETATM   45  H   UNL     1       7.703   1.496   0.272  1.00  0.00           H  
HETATM   46  H   UNL     1       0.170  -2.138  -1.650  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.497   1.175   0.865  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.079   1.055   1.211  1.00  0.00           H  
HETATM   49  H   UNL     1       6.918  -2.459  -0.686  1.00  0.00           H  
HETATM   50  H   UNL     1       4.239   0.845   1.818  1.00  0.00           H  
HETATM   51  H   UNL     1      12.294   0.524  -0.964  1.00  0.00           H  
HETATM   52  H   UNL     1      10.856   0.372  -2.003  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.248  -2.014  -1.997  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.291   1.164   0.513  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.398   0.426  -1.370  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.285   1.957  -1.165  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.960   4.119  -0.798  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.568  -0.211   2.112  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.346  -1.886   0.287  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.642  -0.345  -0.652  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.877  -1.058   0.961  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.712   0.705   0.783  1.00  0.00           H  
CONECT    1   17   17   18   36                                       
CONECT    2   20   20   19   37                                       
CONECT    3   19   21   38   39                                       
CONECT    4   21   22   40   41                                       
CONECT    5    6   23   42   43                                       
CONECT    6   21    5   44   45                                       
CONECT    7   24   24   14   46                                       
CONECT    8   28   26   27   27                                       
CONECT    9   10   10                                                 
CONECT   10    9    9   25   11                                       
CONECT   11   10   12   12   24                                       
CONECT   12   11   11   13   47                                       
CONECT   13   12   14   14   48                                       
CONECT   14   13   13    7   15                                       
CONECT   15   14   16   16   16                                       
CONECT   16   15   15   15   17                                       
CONECT   17   16    1    1   20                                       
CONECT   18    1   19   19   49                                       
CONECT   19   18   18    2    3                                       
CONECT   20   17    2    2   50                                       
CONECT   21    3    4    6                                            
CONECT   22    4   23   51   52                                       
CONECT   23   22    5                                                 
CONECT   24   11    7    7   53                                       
CONECT   25   26   10   54                                            
CONECT   26    8   30   25   55                                       
CONECT   27    8    8                                                 
CONECT   28   29    8   56                                            
CONECT   29   28   57                                                 
CONECT   30   32   26   31   33                                       
CONECT   31   30   58                                                 
CONECT   32   34   35   30   59                                       
CONECT   33   30   60   61   62                                       
CONECT   34   32                                                      
CONECT   35   32                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   18                                                      
CONECT   50   20                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   31                                                      
CONECT   59   32                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
