%chk=000251607.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251607

0 1
Br -4.930868 0.770195 0.724665
O -2.770665 1.861752 -1.305594
C 1.702362 -0.165037 0.049734
C 3.102066 -0.706876 0.169538
C 4.138262 0.356749 0.553905
C 1.466880 1.192746 -0.075111
C 3.956389 1.615498 -0.298690
C 2.567157 2.220176 -0.063305
C 0.596524 -1.090320 0.028293
C -0.730718 -0.601811 -0.106079
C 0.129845 1.677728 -0.198109
C -0.936331 0.813015 -0.196508
C 0.789765 -2.506600 0.131190
C -1.821362 -1.528013 -0.163042
C -2.322189 1.373898 -0.300555
C -0.272326 -3.374005 0.087576
C -1.598010 -2.877956 -0.067761
C -3.092993 1.335179 1.009369
H 3.134622 -1.530027 0.913756
H 3.381826 -1.163745 -0.805608
H 4.037128 0.610253 1.627377
H 5.159018 -0.049958 0.428931
H 2.370131 2.998201 -0.829681
H 2.548777 2.746497 0.915344
H 4.082082 1.367038 -1.370928
H 4.739066 2.359809 -0.062208
H -0.029408 2.753171 -0.297291
H 1.802624 -2.893257 0.245265
H -2.835704 -1.149798 -0.298866
H -0.119820 -4.449379 0.165774
H -2.424450 -3.586383 -0.112805
H -2.640126 0.649098 1.749460
H -3.114054 2.346060 1.461464


%chk=000251607-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251607

0 1
Br -5.037700 0.564078 -0.093987
O -2.423850 2.710815 -0.604650
C 1.737735 -0.157917 0.099312
C 3.153051 -0.713436 0.235127
C 4.232231 0.367403 0.469618
C 1.517806 1.222674 -0.074174
C 4.019417 1.570432 -0.471465
C 2.660763 2.230207 -0.162681
C 0.604711 -1.062101 0.114803
C -0.753239 -0.553466 0.017414
C 0.182521 1.712606 -0.149986
C -0.945707 0.880823 -0.065763
C 0.797145 -2.483220 0.191251
C -1.833977 -1.493038 -0.067143
C -2.261033 1.602152 -0.015618
C -0.280397 -3.370840 0.149531
C -1.607594 -2.870113 0.005145
C -3.363327 1.095909 0.925487
H 3.187846 -1.447493 1.063324
H 3.399675 -1.284091 -0.685407
H 4.186145 0.719474 1.519720
H 5.234126 -0.077510 0.322978
H 2.413741 2.990388 -0.928232
H 2.733543 2.778985 0.799811
H 4.041193 1.224936 -1.524413
H 4.833988 2.309116 -0.354037
H 0.013526 2.791327 -0.252936
H 1.812127 -2.884264 0.263391
H -2.854096 -1.137393 -0.240252
H -0.106520 -4.450906 0.205053
H -2.450600 -3.565672 -0.067415
H -3.082490 0.221155 1.526816
H -3.695259 1.932881 1.558877


