%chk=000232245.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232245

0 1
Br -1.636703 -1.328345 -2.674562
O -1.825262 0.059759 0.474365
O -1.008216 -2.042007 0.743748
C 0.147412 1.461213 0.842028
C 1.024009 0.649410 -0.129516
C -0.512181 2.654780 0.121681
C 1.836248 -0.447836 0.568355
C -0.930541 0.590406 1.506835
C 2.834223 -1.099752 -0.398390
C 0.501494 3.740842 -0.260466
C 3.620521 -2.227235 0.285456
C -0.167808 4.904922 -0.987224
C 4.624214 -2.874422 -0.666470
C -1.710124 -1.264616 0.144691
C -2.626967 -1.542738 -1.014654
H 0.796817 1.853588 1.666632
H 1.708437 1.342616 -0.659570
H 0.388437 0.202313 -0.919878
H -1.298057 3.094323 0.765586
H -1.045002 2.291101 -0.779825
H 1.149566 -1.225132 0.969469
H 2.374125 -0.032558 1.440524
H -0.497940 -0.244819 2.087965
H -1.624516 1.174625 2.135921
H 2.295528 -1.502125 -1.278454
H 3.534082 -0.339403 -0.793331
H 1.294865 3.306104 -0.902165
H 1.017467 4.112516 0.646286
H 2.917561 -2.995092 0.665956
H 4.148847 -1.833374 1.175133
H -0.932719 5.384254 -0.365907
H -0.656995 4.575610 -1.911330
H 0.563152 5.674400 -1.259764
H 5.357737 -2.148755 -1.034769
H 4.126143 -3.309867 -1.540336
H 5.177633 -3.679204 -0.170168
H -3.489870 -0.845843 -1.036904
H -3.012016 -2.581560 -0.969348


%chk=000232245-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232245

0 1
Br -1.923049 -1.418643 -2.768485
O -1.893339 0.067629 0.398612
O -1.194986 -2.140780 0.763581
C 0.137003 1.468308 0.781124
C 1.074998 0.644008 -0.142220
C -0.494538 2.689232 0.055390
C 1.902278 -0.451499 0.569416
C -0.951321 0.598781 1.441649
C 2.909521 -1.143310 -0.378114
C 0.504158 3.822297 -0.275679
C 3.733269 -2.252343 0.314705
C -0.186610 5.047330 -0.913482
C 4.728983 -2.948370 -0.638335
C -1.883510 -1.296486 0.145385
C -2.850262 -1.626069 -0.976766
H 0.745094 1.854218 1.631762
H 1.778310 1.342937 -0.636363
H 0.473477 0.189342 -0.955760
H -1.299066 3.109880 0.695093
H -0.989283 2.342483 -0.873472
H 1.230171 -1.223687 0.992017
H 2.453789 -0.001112 1.422386
H -0.534344 -0.257770 1.998201
H -1.595432 1.204691 2.101937
H 2.359153 -1.581571 -1.236807
H 3.600585 -0.385479 -0.804761
H 1.288828 3.449148 -0.962078
H 1.024074 4.132955 0.654443
H 3.039023 -3.004865 0.740663
H 4.283862 -1.815344 1.173173
H -0.955223 5.466079 -0.236509
H -0.689231 4.770322 -1.859181
H 0.539637 5.849753 -1.138573
H 5.453771 -2.223287 -1.055185
H 4.198964 -3.417857 -1.488528
H 5.302348 -3.738953 -0.119825
H -3.702727 -0.934841 -1.005586
H -3.154777 -2.679025 -0.926231


