%chk=000244159.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244159

0 1
Br -1.245022 -2.886129 -0.001757
O -3.000105 -0.539298 -0.001411
N 2.313076 1.116298 0.000343
N 0.294429 3.035521 0.001959
C 0.636651 -0.693847 -0.000394
C 0.996058 0.685372 0.000146
C -0.050881 1.702612 0.000487
C -0.733587 -1.058915 -0.000968
C -1.715897 -0.064841 -0.000879
C -1.390983 1.309513 -0.000126
C 1.717066 -1.641376 -0.000350
C 3.014950 -1.203645 -0.000088
C 3.279536 0.205693 0.000159
C -4.093580 0.413281 -0.000285
H -2.177427 2.053817 0.000186
H 1.490134 -2.709912 -0.000517
H 3.851246 -1.900193 -0.000022
H 4.312561 0.569852 0.000190
H -0.400855 3.756595 0.000283
H 1.265295 3.316046 0.001209
H -4.962760 -0.259292 0.000262
H -4.068741 1.021860 -0.908157
H -4.067464 1.021587 0.907729


%chk=000244159-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244159

0 1
Br -1.258904 -2.983700 -0.001421
O -3.062167 -0.563906 -0.000914
N 2.288529 1.149188 0.000474
N 0.337428 3.011272 0.000977
C 0.643449 -0.720239 -0.000365
C 0.987908 0.687502 0.000162
C -0.059435 1.690507 0.000385
C -0.732458 -1.095870 -0.000690
C -1.741648 -0.111531 -0.000502
C -1.403559 1.276025 0.000038
C 1.746650 -1.640510 -0.000528
C 3.057622 -1.160317 -0.000199
C 3.291162 0.249945 0.000294
C -4.140062 0.428442 -0.000346
H -2.196888 2.029397 0.000198
H 1.542339 -2.715375 -0.000915
H 3.907989 -1.849105 -0.000317
H 4.311304 0.649831 0.000543
H -0.326327 3.778459 0.000691
H 1.344975 3.180866 0.001088
H -5.065176 -0.165890 -0.000555
H -4.104597 1.063235 -0.906569
H -4.104435 1.062375 0.906470


