%chk=000288751.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288751

0 1
Br -4.357173 0.008048 1.833069
O 0.096039 -0.009075 -2.233234
N 1.582739 -1.228340 0.094489
N 1.583090 1.228627 0.084558
C 0.887058 0.002462 0.638669
C 3.034383 -1.257180 0.467667
C 3.034744 1.260067 0.457487
C 3.715034 -0.000880 -0.087735
C -0.543644 0.000604 0.129645
C 0.907946 -2.473039 0.568566
C 0.908659 2.477313 0.548559
C -0.840085 -0.004969 -1.254221
C -1.607450 0.004444 1.039567
C -2.176206 -0.006656 -1.716432
C -2.921572 0.002740 0.573745
C -3.216255 -0.002780 -0.797198
H 0.892381 0.007014 1.764992
H 3.482838 -2.164676 0.006033
H 3.200538 -1.336951 1.563353
H 3.200925 1.348649 1.552492
H 3.483459 2.163671 -0.011471
H 4.789590 0.000004 0.169085
H 3.657314 -0.005356 -1.196632
H 0.901495 -2.609601 1.659514
H 1.402409 -3.344181 0.108618
H -0.137464 -2.480888 0.212868
H -0.136755 2.482585 0.192827
H 1.403363 3.344563 0.081568
H 0.902269 2.622700 1.638366
H -1.404070 0.008766 2.112249
H -2.361720 -0.010982 -2.789274
H -4.251988 -0.004037 -1.142626
H 1.040907 -0.007664 -1.852864


%chk=000288751-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288751

0 1
Br -4.419500 -0.712395 1.793951
O 0.161269 0.642821 -2.110355
N 1.540138 -1.243468 0.237259
N 1.611464 1.190203 -0.033474
C 0.880815 0.033469 0.626208
C 2.978086 -1.279885 0.596359
C 3.080826 1.190487 0.243420
C 3.719772 -0.151294 -0.132724
C -0.569600 0.045284 0.150130
C 0.821995 -2.447998 0.707380
C 1.025910 2.501380 0.374193
C -0.845187 0.281103 -1.236104
C -1.633255 -0.231273 1.035608
C -2.175649 0.169508 -1.713016
C -2.949069 -0.319329 0.543081
C -3.230751 -0.134518 -0.827923
H 0.915541 0.176033 1.746749
H 3.380631 -2.263674 0.296274
H 3.132299 -1.179413 1.704245
H 3.259676 1.398227 1.326560
H 3.528374 2.020745 -0.332084
H 4.788457 -0.143658 0.151840
H 3.648660 -0.313778 -1.222832
H 0.748664 -2.512028 1.821984
H 1.363324 -3.340666 0.348933
H -0.196578 -2.477056 0.292608
H -0.046837 2.534275 0.129197
H 1.536800 3.305427 -0.182138
H 1.148214 2.689052 1.463733
H -1.426230 -0.394727 2.098864
H -2.367071 0.337217 -2.776915
H -4.256017 -0.214579 -1.200994
H 0.997624 0.859510 -1.503717


