COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.498   0.971  -2.294  1.00  0.00           O  
HETATM    2  C   UNL     1       2.336   1.306  -1.480  1.00  0.00           C  
HETATM    3  N   UNL     1       2.317   2.566  -1.019  1.00  0.00           N  
HETATM    4  C   UNL     1       3.222   2.996  -0.113  1.00  0.00           C  
HETATM    5  O   UNL     1       3.198   4.140   0.299  1.00  0.00           O  
HETATM    6  C   UNL     1       4.240   2.042   0.363  1.00  0.00           C  
HETATM    7  C   UNL     1       5.208   2.408   1.295  1.00  0.00           C  
HETATM    8  C   UNL     1       6.139   1.478   1.708  1.00  0.00           C  
HETATM    9  C   UNL     1       6.115   0.188   1.201  1.00  0.00           C  
HETATM   10  C   UNL     1       5.161  -0.187   0.276  1.00  0.00           C  
HETATM   11  C   UNL     1       4.217   0.733  -0.150  1.00  0.00           C  
HETATM   12  N   UNL     1       3.239   0.396  -1.075  1.00  0.00           N  
HETATM   13  C   UNL     1       3.193  -0.963  -1.620  1.00  0.00           C  
HETATM   14  C   UNL     1       2.314  -1.824  -0.749  1.00  0.00           C  
HETATM   15  C   UNL     1       0.965  -1.919  -1.015  1.00  0.00           C  
HETATM   16  C   UNL     1       2.866  -2.521   0.312  1.00  0.00           C  
HETATM   17  C   UNL     1       2.068  -3.314   1.117  1.00  0.00           C  
HETATM   18  C   UNL     1       0.712  -3.415   0.865  1.00  0.00           C  
HETATM   19  F   UNL     1      -0.067  -4.189   1.652  1.00  0.00           F  
HETATM   20  C   UNL     1       0.151  -2.717  -0.209  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.297  -2.818  -0.484  1.00  0.00           C  
HETATM   22  O   UNL     1      -1.816  -3.909  -0.614  1.00  0.00           O  
HETATM   23  N   UNL     1      -2.042  -1.700  -0.593  1.00  0.00           N  
HETATM   24  C   UNL     1      -1.420  -0.369  -0.526  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.177   0.471   0.509  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.649   1.906   0.487  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.498  -1.779  -0.787  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.177  -0.887   0.258  1.00  0.00           C  
HETATM   29  N   UNL     1      -3.609   0.470   0.183  1.00  0.00           N  
HETATM   30  C   UNL     1      -4.349   1.399   1.047  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.668   1.783   0.371  1.00  0.00           C  
HETATM   32  F   UNL     1      -6.304   2.776   1.122  1.00  0.00           F  
HETATM   33  F   UNL     1      -5.409   2.265  -0.916  1.00  0.00           F  
HETATM   34  F   UNL     1      -6.495   0.658   0.290  1.00  0.00           F  
HETATM   35  H   UNL     1       1.640   3.181  -1.343  1.00  0.00           H  
HETATM   36  H   UNL     1       5.229   3.412   1.691  1.00  0.00           H  
HETATM   37  H   UNL     1       6.892   1.757   2.431  1.00  0.00           H  
HETATM   38  H   UNL     1       6.850  -0.530   1.533  1.00  0.00           H  
HETATM   39  H   UNL     1       5.151  -1.194  -0.114  1.00  0.00           H  
HETATM   40  H   UNL     1       2.787  -0.936  -2.631  1.00  0.00           H  
HETATM   41  H   UNL     1       4.200  -1.379  -1.643  1.00  0.00           H  
HETATM   42  H   UNL     1       0.538  -1.377  -1.846  1.00  0.00           H  
HETATM   43  H   UNL     1       3.924  -2.446   0.512  1.00  0.00           H  
HETATM   44  H   UNL     1       2.505  -3.855   1.942  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.377  -0.467  -0.226  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.479   0.113  -1.502  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.029   0.044   1.502  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.938   2.385  -0.449  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.070   2.462   1.325  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.562   1.895   0.568  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.753  -1.430  -1.788  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.829  -2.809  -0.659  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.248  -0.846   0.060  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.006  -1.297   1.253  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.557   0.919   2.003  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.752   2.296   1.213  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2   12    1    1    3                                       
CONECT    3    2    4   35                                            
CONECT    4    6    3    5    5                                       
CONECT    5    4    4                                                 
CONECT    6   11    7    7    4                                       
CONECT    7    8    6    6   36                                       
CONECT    8    9    9    7   37                                       
CONECT    9   10    8    8   38                                       
CONECT   10    9   11   11   39                                       
CONECT   11   10   10   12    6                                       
CONECT   12   13   11    2                                            
CONECT   13   14   12   40   41                                       
CONECT   14   16   16   15   13                                       
CONECT   15   20   20   14   42                                       
CONECT   16   17   14   14   43                                       
CONECT   17   18   18   16   44                                       
CONECT   18   19   17   17   20                                       
CONECT   19   18                                                      
CONECT   20   18   21   15   15                                       
CONECT   21   23   20   22   22                                       
CONECT   22   21   21                                                 
CONECT   23   27   24   21                                            
CONECT   24   23   25   45   46                                       
CONECT   25   24   29   26   47                                       
CONECT   26   25   48   49   50                                       
CONECT   27   23   28   51   52                                       
CONECT   28   27   29   53   54                                       
CONECT   29   30   28   25                                            
CONECT   30   31   29   55   56                                       
CONECT   31   33   30   34   32                                       
CONECT   32   31                                                      
CONECT   33   31                                                      
CONECT   34   31                                                      
CONECT   35    3                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
