COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.963   0.732   0.144  1.00  0.00           C  
HETATM    2  C   UNL     1       7.315   1.994   0.588  1.00  0.00           C  
HETATM    3  C   UNL     1       6.609   3.103   0.154  1.00  0.00           C  
HETATM    4  C   UNL     1       5.550   2.949  -0.724  1.00  0.00           C  
HETATM    5  C   UNL     1       5.198   1.686  -1.169  1.00  0.00           C  
HETATM    6  C   UNL     1       5.907   0.578  -0.738  1.00  0.00           C  
HETATM    7  C   UNL     1       5.527  -0.797  -1.226  1.00  0.00           C  
HETATM    8  N   UNL     1       4.508  -2.686   1.731  1.00  0.00           N  
HETATM    9  C   UNL     1       5.209  -2.086   0.809  1.00  0.00           C  
HETATM   10  N   UNL     1       4.662  -1.444  -0.237  1.00  0.00           N  
HETATM   11  C   UNL     1       3.289  -1.391  -0.387  1.00  0.00           C  
HETATM   12  C   UNL     1       2.486  -2.023   0.579  1.00  0.00           C  
HETATM   13  C   UNL     1       1.099  -1.992   0.463  1.00  0.00           C  
HETATM   14  C   UNL     1       0.521  -1.336  -0.608  1.00  0.00           C  
HETATM   15  C   UNL     1       1.319  -0.712  -1.564  1.00  0.00           C  
HETATM   16  C   UNL     1       2.693  -0.737  -1.457  1.00  0.00           C  
HETATM   17  C   UNL     1       3.162  -2.705   1.697  1.00  0.00           C  
HETATM   18  O   UNL     1       2.521  -3.271   2.566  1.00  0.00           O  
HETATM   19  F   UNL     1      -4.268  -0.235  -2.020  1.00  0.00           F  
HETATM   20  O   UNL     1      -0.832  -1.301  -0.730  1.00  0.00           O  
HETATM   21  C   UNL     1      -1.522  -0.444   0.068  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.853   0.295   1.035  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.550   1.169   1.849  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.915   1.312   1.706  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.596   0.574   0.736  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.891  -0.303  -0.088  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.618  -1.104  -1.137  1.00  0.00           C  
HETATM   28  F   UNL     1       6.953   4.335   0.587  1.00  0.00           F  
HETATM   29  F   UNL     1      -4.562  -1.933  -0.520  1.00  0.00           F  
HETATM   30  F   UNL     1      -2.701  -1.888  -1.845  1.00  0.00           F  
HETATM   31  F   UNL     1       7.652  -0.350   0.568  1.00  0.00           F  
HETATM   32  F   UNL     1       4.164   1.535  -2.025  1.00  0.00           F  
HETATM   33  C   UNL     1      -5.058   0.725   0.580  1.00  0.00           C  
HETATM   34  O   UNL     1      -5.823   1.591   1.272  1.00  0.00           O  
HETATM   35  N   UNL     1      -5.799   0.040  -0.255  1.00  0.00           N  
HETATM   36  C   UNL     1      -7.089   0.440  -0.127  1.00  0.00           C  
HETATM   37  C   UNL     1      -7.100   1.442   0.860  1.00  0.00           C  
HETATM   38  C   UNL     1      -8.302   2.042   1.205  1.00  0.00           C  
HETATM   39  C   UNL     1      -9.453   1.626   0.556  1.00  0.00           C  
HETATM   40  C   UNL     1      -9.372   0.634  -0.407  1.00  0.00           C  
HETATM   41  N   UNL     1      -8.222   0.078  -0.723  1.00  0.00           N  
HETATM   42  H   UNL     1       8.142   2.115   1.273  1.00  0.00           H  
HETATM   43  H   UNL     1       4.998   3.813  -1.062  1.00  0.00           H  
HETATM   44  H   UNL     1       4.995  -0.711  -2.174  1.00  0.00           H  
HETATM   45  H   UNL     1       6.428  -1.394  -1.368  1.00  0.00           H  
HETATM   46  H   UNL     1       6.286  -2.105   0.892  1.00  0.00           H  
HETATM   47  H   UNL     1       0.479  -2.476   1.204  1.00  0.00           H  
HETATM   48  H   UNL     1       0.857  -0.203  -2.397  1.00  0.00           H  
HETATM   49  H   UNL     1       3.304  -0.250  -2.203  1.00  0.00           H  
HETATM   50  H   UNL     1       0.215   0.186   1.152  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.025   1.740   2.600  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.456   1.995   2.344  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.339   2.814   1.959  1.00  0.00           H  
HETATM   54  H   UNL     1     -10.406   2.069   0.801  1.00  0.00           H  
HETATM   55  H   UNL     1     -10.271   0.311  -0.912  1.00  0.00           H  
CONECT    1    2   31    6    6                                       
CONECT    2    3    3    1   42                                       
CONECT    3   28    2    2    4                                       
CONECT    4    3    5    5   43                                       
CONECT    5    4    4    6   32                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6   10   44   45                                       
CONECT    8   17    9    9                                            
CONECT    9    8    8   10   46                                       
CONECT   10   11    7    9                                            
CONECT   11   12   12   16   10                                       
CONECT   12   13   17   11   11                                       
CONECT   13   14   14   12   47                                       
CONECT   14   20   13   13   15                                       
CONECT   15   14   16   16   48                                       
CONECT   16   15   15   11   49                                       
CONECT   17   18   18   12    8                                       
CONECT   18   17   17                                                 
CONECT   19   27                                                      
CONECT   20   21   14                                                 
CONECT   21   26   20   22   22                                       
CONECT   22   21   21   23   50                                       
CONECT   23   24   24   22   51                                       
CONECT   24   25   23   23   52                                       
CONECT   25   33   26   26   24                                       
CONECT   26   27   25   25   21                                       
CONECT   27   30   29   19   26                                       
CONECT   28    3                                                      
CONECT   29   27                                                      
CONECT   30   27                                                      
CONECT   31    1                                                      
CONECT   32    5                                                      
CONECT   33   34   35   35   25                                       
CONECT   34   37   33                                                 
CONECT   35   36   33   33                                            
CONECT   36   41   41   37   35                                       
CONECT   37   38   38   36   34                                       
CONECT   38   39   37   37   53                                       
CONECT   39   40   40   38   54                                       
CONECT   40   39   39   41   55                                       
CONECT   41   40   36   36                                            
CONECT   42    2                                                      
CONECT   43    4                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    9                                                      
CONECT   47   13                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   38                                                      
CONECT   54   39                                                      
CONECT   55   40                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
