%chk=000231259.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231259

0 1
Br 7.676371 0.240507 -0.095141
O -1.317094 -2.329422 1.199616
O 1.030221 -1.546166 0.798916
O -5.255997 -1.755407 0.846885
O -3.629062 -3.005952 1.540031
O -2.383389 3.074035 -1.737719
O -4.422045 2.418109 -1.403470
N 1.558681 0.423155 -0.259709
N -4.074636 -2.017195 1.000678
N -3.216901 2.285935 -1.319591
C -0.797795 -0.242119 0.074258
C -1.706018 -1.227144 0.598289
C -1.317728 0.889386 -0.544122
C -3.116532 -1.023191 0.472952
C -2.706763 1.073196 -0.657822
C 0.652542 -0.508854 0.234058
C -3.608221 0.121225 -0.151676
C 2.993667 0.325166 -0.191458
C 3.655774 -0.759642 0.403248
C 3.725310 1.389688 -0.760298
C 5.052703 -0.780673 0.429665
C 5.118708 1.360072 -0.729254
C 5.771859 0.274995 -0.134413
H -0.657525 1.666979 -0.958815
H -4.700195 0.278892 -0.248235
H 1.200996 1.267479 -0.719874
H 3.093623 -1.590123 0.846971
H 3.220620 2.235851 -1.224191
H 5.569816 -1.625366 0.892763
H 5.689622 2.181943 -1.168346
H -0.245910 -2.433060 1.266204


%chk=000231259-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231259

0 1
Br 7.764049 0.357523 -0.180719
O -1.307277 -2.414475 1.190158
O 1.021476 -1.707613 0.777362
O -5.253786 -2.053096 0.388793
O -3.887601 -2.527943 2.159040
O -2.287480 3.106752 -1.809378
O -4.448153 2.454556 -1.449245
N 1.564521 0.345511 -0.189105
N -4.149079 -1.934820 1.051044
N -3.174629 2.282446 -1.350949
C -0.804751 -0.287976 0.088019
C -1.735417 -1.265994 0.624066
C -1.303094 0.865107 -0.547647
C -3.138271 -1.000491 0.494716
C -2.689844 1.065741 -0.669446
C 0.652489 -0.585337 0.240755
C -3.619800 0.136248 -0.162642
C 2.991772 0.283218 -0.157151
C 3.718100 -0.826258 0.349131
C 3.688747 1.410134 -0.668678
C 5.128611 -0.796623 0.338196
C 5.096178 1.437931 -0.678410
C 5.807247 0.328687 -0.172307
H -0.663452 1.640015 -0.983076
H -4.694576 0.298441 -0.281020
H 1.190053 1.210899 -0.583273
H 3.184919 -1.691495 0.743465
H 3.137123 2.272970 -1.063000
H 5.689007 -1.650798 0.728177
H 5.626452 2.308319 -1.073567
H -0.248832 -2.399282 1.147094


