%chk=000243529.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243529

0 1
Br 2.412278 -1.222486 -0.988433
N 0.648693 -0.557850 0.739555
C -0.680256 -0.266231 0.327626
C 1.589188 0.554067 1.023500
C -0.985577 0.887985 -0.423266
C -1.691248 -1.217674 0.597606
C -2.285036 1.079040 -0.892177
C -2.980659 -1.006101 0.113554
C -3.287935 0.141734 -0.625524
C 2.724627 0.363277 0.054197
C 3.793134 1.129124 -0.099350
H 0.730376 -1.327811 1.409090
H 1.962367 0.519818 2.071989
H 1.121550 1.556984 0.883349
H -0.210151 1.610211 -0.662953
H -1.465838 -2.116341 1.163673
H -2.518195 1.968947 -1.476667
H -3.758057 -1.742539 0.316441
H -4.296861 0.300248 -0.994171
H 4.577517 0.934272 -0.820510
H 3.975382 2.022226 0.484569


%chk=000243529-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243529

0 1
Br 3.243979 -1.623987 -0.335523
N 0.529035 -0.542492 1.305249
C -0.629303 -0.242072 0.568106
C 1.735528 0.274058 1.332583
C -0.797390 0.988678 -0.129569
C -1.694664 -1.190480 0.541350
C -2.001808 1.257116 -0.815643
C -2.887438 -0.911452 -0.152182
C -3.056506 0.317099 -0.836209
C 2.612374 0.209019 0.081932
C 2.987198 1.239145 -0.705738
H 0.610741 -1.493618 1.663075
H 2.342219 -0.045833 2.200420
H 1.471439 1.337090 1.498631
H 0.006770 1.730024 -0.152446
H -1.579361 -2.145523 1.070524
H -2.110102 2.210447 -1.346317
H -3.690504 -1.657567 -0.158267
H -3.984864 0.531553 -1.375343
H 3.638366 1.118205 -1.574781
H 2.629587 2.251491 -0.477755


