%chk=000179823.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179823

0 1
Br -0.973203 -1.976786 1.798111
Br -0.870621 2.402531 -1.676711
Br -4.367184 -1.627533 -0.227152
S 1.791138 -0.302073 -0.570668
O 0.859413 1.069502 1.519524
N -0.741587 0.183766 0.069307
N -2.720763 0.392024 -1.054448
C 3.421146 0.146867 0.203292
C 3.576425 -0.613332 1.500383
C 4.428364 -0.232772 -0.862236
C 0.628894 0.442598 0.535085
C -1.597514 -0.849490 0.506224
C -1.499156 0.909309 -0.874679
C -2.789275 -0.705647 -0.199491
H 3.423955 1.248774 0.388034
H 4.565939 -0.435185 1.946998
H 2.834730 -0.301754 2.252743
H 3.479422 -1.700455 1.375688
H 5.450629 0.004478 -0.528340
H 4.275304 0.310332 -1.806092
H 4.424042 -1.307352 -1.095771


%chk=000179823-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179823

0 1
Br -1.457692 -1.694213 2.216892
Br -0.563132 1.942134 -2.293698
Br -4.660885 -1.252407 0.225115
S 1.809763 -0.371387 -0.703236
O 0.842061 0.770297 1.592316
N -0.777691 0.109496 -0.002885
N -2.707926 0.372295 -1.179143
C 3.427423 0.079764 0.258797
C 3.673928 -0.949828 1.371263
C 4.555471 0.163720 -0.780854
C 0.594454 0.277555 0.475748
C -1.787614 -0.640263 0.663958
C -1.417750 0.700385 -1.112022
C -2.943903 -0.470409 -0.093851
H 3.204334 1.070252 0.692482
H 4.587573 -0.669986 1.930162
H 2.835169 -0.976349 2.086556
H 3.823083 -1.961466 0.954281
H 5.492625 0.454651 -0.270987
H 4.341108 0.914869 -1.560360
H 4.729698 -0.811306 -1.270734


