%chk=000290506.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290506

0 1
Br 5.701226 3.031510 -0.416572
O 2.071428 -1.790088 -0.160821
O -1.611583 0.074317 1.205924
O 0.526946 0.017422 1.934941
N -1.376043 0.478797 -1.034367
C 2.432117 0.451611 -0.708588
C 2.944012 -0.740931 -0.130545
C 1.063184 0.534137 -1.227872
C -0.047856 0.398381 -0.486470
C -2.228386 0.287699 -0.052636
C 3.272533 1.568107 -0.796314
C -3.687322 0.262036 -0.050778
C 4.255170 -0.800208 0.370442
C -0.180868 0.146068 0.987691
C 4.575316 1.498353 -0.296801
C 5.069567 0.329241 0.289609
C 2.407193 -3.007765 0.592603
C -4.388605 0.435145 -1.257082
C -4.385772 0.066366 1.154023
C -5.784940 0.410901 -1.251686
C -5.781064 0.044068 1.147165
C -6.480089 0.215961 -0.053375
C 1.148881 -3.839062 0.458193
H 0.975286 0.736374 -2.306437
H 2.898661 2.492553 -1.245109
H 4.643344 -1.709388 0.820601
H 6.088726 0.291876 0.681933
H 3.285132 -3.470572 0.111420
H 2.626569 -2.723670 1.636457
H -3.838712 0.587925 -2.189502
H -3.828728 -0.065733 2.085785
H -6.332270 0.544967 -2.184080
H -6.325794 -0.106618 2.078511
H 1.286672 -4.843220 0.876108
H 0.298948 -3.371013 0.975750
H 0.852203 -3.947356 -0.595627
H -7.569980 0.198311 -0.054193


%chk=000290506-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290506

0 1
Br 5.927314 2.917017 -1.113245
O 2.048525 -1.728023 0.043724
O -1.743110 -0.370242 1.231041
O 0.489576 -0.599711 1.951539
N -1.429835 0.663199 -0.822534
C 2.412855 0.538944 -0.647851
C 2.936196 -0.674227 -0.079437
C 1.005885 0.774587 -0.953947
C -0.140256 0.379801 -0.290998
C -2.312869 0.209946 0.055879
C 3.336125 1.574178 -0.985669
C -3.767937 0.238195 -0.040019
C 4.314262 -0.768697 0.245221
C -0.288731 -0.253881 1.053300
C 4.696751 1.453219 -0.671444
C 5.195007 0.294396 -0.037997
C 2.481873 -2.947147 0.767769
C -4.378997 0.795290 -1.198339
C -4.576708 -0.281245 1.008019
C -5.782320 0.830154 -1.302574
C -5.981429 -0.242175 0.894283
C -6.587834 0.311999 -0.258013
C 1.277023 -3.880124 0.825955
H 0.809592 1.408892 -1.829943
H 2.957061 2.486159 -1.457847
H 4.716202 -1.674196 0.706165
H 6.255680 0.210963 0.215449
H 3.326530 -3.411085 0.218218
H 2.817032 -2.656438 1.782090
H -3.738497 1.189681 -1.993630
H -4.096195 -0.704948 1.895058
H -6.251789 1.259250 -2.194266
H -6.603756 -0.641638 1.702191
H 1.557819 -4.821802 1.331924
H 0.454367 -3.411198 1.390039
H 0.919541 -4.123625 -0.189243
H -7.679852 0.341032 -0.342566


