%chk=000163757.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163757

0 1
 Br  -2.121500       1.602500      -2.565700    
 F    2.687000      0.4474000       1.569800    
 F    1.542500      0.6101000      -1.765300    
 F    3.567000      0.7749000     -0.9960000    
 F    1.282300      -1.888900     -0.7358000    
 F    2.964100      -1.585400      -2.078300    
 F    1.497000       2.837800       1.766500    
 F    3.048400       2.834500      0.2390000    
 F   0.9450000       2.819200     -0.3401000    
 F    3.032100      -1.718800       1.434600    
 F    4.680500      -1.443800      3.3399999E-02
 F    3.515600      -3.278400     -1.4600000E-02
 O   0.2387000     -0.3001000       1.991200    
 O   -6.416600      -1.350200       1.156400    
 O   -6.735400     -0.3829000     -0.7884000    
 N  -0.5405000      0.6027000     -2.5000000E-02
 N   -5.986300     -0.7210000      0.1598000    
 C    1.817600      0.8119000      0.5746000    
 C    2.348600      0.2174000     -0.7380000    
 C    2.500200      -1.296200     -0.8281000    
 C    1.834700       2.336900      0.5566000    
 C   0.4158000      0.3033000      0.9350000    
 C    3.431200      -1.945200      0.1656000    
 C   -1.918100      0.2821000     -5.5999998E-03
 C   -2.752800      0.6512000      -1.049000    
 C   -2.404600     -0.4128000       1.092000    
 C   -4.106200      0.3181000     -0.9944000    
 C   -3.757900     -0.7459000       1.146600    
 C   -4.608700     -0.3805000      0.1033000    
 H  -0.2335000       1.113900     -0.8496000    
 H   -1.825100     -0.7363000       1.942400    
 H   -4.755800      0.6108000      -1.816600    
 H   -4.115900      -1.290700       2.016700    


%chk=000163757-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163757

0 1
Br -2.143072 1.698304 -2.503854
F 2.722930 0.486020 1.572009
F 1.572940 0.494942 -1.883908
F 3.689389 0.825200 -1.101747
F 1.392153 -1.959111 -0.651013
F 3.128814 -1.657347 -2.109606
F 1.147511 2.893611 1.603671
F 3.121240 2.962268 0.510107
F 1.180412 2.910231 -0.667917
F 3.052692 -2.210343 1.455562
F 4.818399 -1.269311 0.370289
F 4.016130 -3.288029 -0.279782
O 0.275646 -0.368416 1.944094
O -6.603666 -1.339451 1.185707
O -6.892569 -0.258815 -0.805290
N -0.593810 0.610334 -0.017798
N -6.161493 -0.668691 0.176463
C 1.841411 0.846551 0.501116
C 2.453911 0.216374 -0.789316
C 2.663569 -1.350009 -0.813890
C 1.842871 2.414949 0.481668
C 0.400470 0.283405 0.884435
C 3.654646 -2.027778 0.211800
C -1.966254 0.269520 0.071060
C -2.842803 0.684892 -0.978364
C -2.511838 -0.467319 1.160253
C -4.210019 0.384458 -0.952862
C -3.881526 -0.775412 1.197747
C -4.713510 -0.347239 0.143961
H -0.336145 1.136739 -0.864976
H -1.849748 -0.789888 1.964706
H -4.888286 0.697383 -1.749914
H -4.310997 -1.340425 2.028588


