%chk=000188730.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188730

0 1
Br -1.726622 2.884941 0.326769
O -1.346357 -2.172744 -0.560948
O 1.346640 2.410983 0.213853
N 2.839414 0.105349 -0.302506
N -2.809230 0.141459 0.187490
C 3.844071 -0.483399 0.647791
C -3.821018 -0.709807 -0.517573
C 3.736821 1.023588 0.453384
C -3.857967 0.813654 -0.628112
C 1.443720 0.044003 -0.106020
C -1.439058 0.150416 -0.065995
C 4.968739 -1.266899 0.030289
C -4.795788 -1.446685 0.356789
C 0.765623 -1.128969 -0.215132
C -0.715236 -1.175261 -0.291945
C 0.729560 1.384973 0.052552
C -0.739057 1.303940 0.051019
C 1.447836 -2.450629 -0.322996
H 3.481067 -0.910239 1.596518
H -3.490192 -1.297441 -1.392705
H 3.347895 1.670786 1.245311
H 4.462193 1.563719 -0.165221
H -3.603955 1.307516 -1.569026
H -4.583727 1.400483 -0.053742
H 5.202617 -0.924637 -0.989585
H 5.885359 -1.168841 0.627154
H 4.722452 -2.334256 -0.042325
H -5.747743 -1.606841 -0.165348
H -4.395532 -2.431227 0.642762
H -5.013069 -0.910180 1.291954
H 0.745468 -3.256157 -0.595451
H 1.920444 -2.738276 0.625964
H 2.235130 -2.431520 -1.093969


%chk=000188730-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188730

0 1
Br -1.612539 3.157887 0.156341
O -1.434152 -2.184493 -0.185542
O 1.419211 2.503907 0.058443
N 2.797577 0.130031 -0.102873
N -2.825607 0.154370 0.028638
C 3.900707 -0.523906 0.659833
C -3.846371 -0.700948 -0.610981
C 3.783602 1.007628 0.551294
C -3.960604 0.838354 -0.628839
C 1.423703 0.077432 -0.037528
C -1.465147 0.233910 -0.049022
C 4.948707 -1.305735 -0.109286
C -4.716085 -1.566269 0.280197
C 0.721573 -1.126070 -0.105783
C -0.732887 -1.114734 -0.114804
C 0.723529 1.435949 0.010461
C -0.730846 1.414741 0.010426
C 1.422509 -2.462313 -0.223755
H 3.602734 -0.950233 1.628832
H -3.529710 -1.172490 -1.550494
H 3.452242 1.583814 1.421198
H 4.458236 1.545063 -0.123947
H -3.752652 1.372144 -1.563331
H -4.672844 1.331139 0.041557
H 5.181703 -0.808418 -1.066395
H 5.878646 -1.378971 0.483438
H 4.599284 -2.330542 -0.328981
H -5.647103 -1.844008 -0.246503
H -4.168403 -2.486539 0.544363
H -4.981950 -1.035038 1.210496
H 0.679384 -3.248325 -0.430520
H 1.955679 -2.740210 0.705121
H 2.168372 -2.445323 -1.041056


