%chk=000179078.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179078

0 1
Br 0.251066 0.911521 -2.164367
Cl 1.875213 -2.453501 -0.463952
Cl 6.609632 0.068560 -0.513266
O -3.086221 1.629763 -1.009830
N -3.782283 -0.262670 0.072245
N 0.755581 0.189157 0.450204
N 0.241792 -0.090927 1.688522
C -5.163079 -0.122506 -0.368543
C -5.949956 -1.374167 -0.735334
C -6.274973 -0.623842 0.543630
C -2.811470 0.675031 -0.305813
C -1.465741 0.394377 0.231950
C -0.255185 0.494812 -0.456086
C -1.106759 0.026786 1.574384
C 2.178943 0.152732 0.211664
C 2.799424 -1.036781 -0.215247
C 2.940719 1.314442 0.423507
C 4.177249 -1.071260 -0.444413
C 4.317236 1.287397 0.196572
C 4.914322 0.097227 -0.234048
H -5.316356 0.804046 -0.953219
H -5.484600 -2.354743 -0.678280
H -6.641482 -1.337623 -1.574492
H -7.198098 -0.052467 0.615521
H -6.039787 -1.074817 1.504099
H -3.540570 -1.090571 0.606166
H -1.775327 -0.125254 2.408581
H 2.453518 2.232096 0.765859
H 4.663857 -1.991906 -0.777083
H 4.920635 2.183686 0.355866


%chk=000179078-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179078

0 1
Br 0.099871 0.351354 -2.442730
Cl 1.884599 -2.544284 -0.537424
Cl 6.760914 0.074235 -0.382136
O -3.082769 0.937342 -1.598140
N -3.870221 -0.086779 0.339813
N 0.753528 0.197750 0.375568
N 0.240720 0.190376 1.686123
C -5.261058 0.021847 -0.043545
C -5.904380 -1.055574 -0.929416
C -6.262830 -0.960278 0.564127
C -2.851978 0.412742 -0.466535
C -1.486790 0.297359 0.122155
C -0.261246 0.276114 -0.569844
C -1.108359 0.243607 1.505328
C 2.172162 0.153204 0.174193
C 2.828891 -1.028991 -0.243835
C 2.942531 1.307550 0.442046
C 4.225252 -1.064094 -0.423558
C 4.342675 1.296919 0.279970
C 4.959372 0.107938 -0.157498
H -5.590688 1.051212 -0.217767
H -5.264644 -1.883112 -1.247066
H -6.637149 -0.729051 -1.671456
H -7.246373 -0.577353 0.848517
H -5.878984 -1.746388 1.223468
H -3.636265 -0.548710 1.219846
H -1.747923 0.282139 2.386708
H 2.429806 2.212210 0.781443
H 4.721570 -1.981123 -0.749656
H 4.937066 2.190438 0.486097


