%chk=000041914.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041914

0 1
 Br  -5.769300      0.5788000      -1.224000    
 Br  -1.290900      -4.154300       1.722100    
 O  -0.3723000       2.684000      0.5703000    
 O    4.750700     -0.8554000     -0.1944000    
 O    3.276500      -2.092400      -1.250700    
 N   -1.913000     -0.3752000      6.0199998E-02
 N    3.580900      -1.065700     -0.5966000    
 C   -1.124900      0.3677000     -0.9225000    
 C   -3.287500     -0.5445000     -0.4096000    
 C   -1.300600      -1.675800      0.3288000    
 C   0.2814000      0.6130000     -0.4441000    
 C   0.5850000       1.759500      0.2781000    
 C    1.262400     -0.3251000     -0.7381000    
 C   -3.920300      0.8120000     -0.6567000    
 C   -2.144700      -2.449100       1.324400    
 C    2.570200     -0.1127000     -0.3020000    
 C    1.892900       1.971800      0.7142000    
 C    2.885400       1.035800      0.4241000    
 C   3.7999999E-02   3.827700       1.316800    
 H   -1.097700     -0.1573000      -1.888400    
 H   -1.541600       1.353900      -1.144300    
 H   -3.913500      -1.025100      0.3481000    
 H   -3.330400      -1.162800      -1.316200    
 H   -1.171800      -2.261100     -0.5915000    
 H  -0.3196000      -1.560800      0.7993000    
 H    1.002200      -1.205500      -1.320500    
 H   -3.487700       1.368300      -1.490000    
 H   -3.944500       1.437900      0.2400000    
 H   -3.119700      -2.758500      0.9428000    
 H   -2.261100      -1.927200       2.278500    
 H    2.211400       2.839100       1.282100    
 H    3.893600       1.233200      0.7796000    
 H   0.7678000       4.430000      0.7649000    
 H   0.3932000       3.552200       2.315600    
 H  -0.8486000       4.454700       1.457700    


%chk=000041914-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041914

0 1
Br -4.778935 2.041360 1.173530
Br -1.579070 -4.404557 1.340554
O -0.760575 2.381140 -0.270242
O 4.833190 -0.447684 0.992160
O 3.782520 -2.058518 -0.238479
N -1.987191 -0.638926 -0.706995
N 3.819746 -0.893955 0.323653
C -0.835433 -0.150062 -1.487494
C -3.159630 0.218773 -0.501938
C -2.074363 -2.066418 -0.385320
C 0.378853 0.326553 -0.683412
C 0.394254 1.623789 -0.077436
C 1.519548 -0.481890 -0.544878
C -3.268616 0.677557 0.966215
C -1.409669 -2.407486 0.966543
C 2.635831 -0.023437 0.193400
C 1.520313 2.080152 0.655186
C 2.647926 1.251154 0.795541
C -0.816320 3.745827 0.280676
H -0.498145 -0.966021 -2.159114
H -1.181971 0.682880 -2.127232
H -4.091816 -0.310343 -0.789779
H -3.066482 1.112470 -1.142513
H -3.138120 -2.372256 -0.350088
H -1.590096 -2.668434 -1.181132
H 1.565640 -1.472127 -1.009982
H -2.358821 1.200574 1.291103
H -3.537755 -0.134787 1.658710
H -1.902268 -1.912668 1.817152
H -0.328854 -2.204703 0.974546
H 1.527795 3.073873 1.110442
H 3.530609 1.572934 1.354142
H -0.037681 4.385603 -0.174047
H -0.706363 3.735269 1.381014
H -1.816152 4.115466 0.013512


