%chk=000202688.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202688

0 1
Br -5.461557 0.599703 -0.413308
S -1.193371 -0.666315 0.110037
O 2.077859 -2.363731 -0.949430
N 2.603599 1.847623 0.108816
N 1.114836 -2.479237 1.100897
C 0.219290 0.374282 0.112503
C 1.454091 -0.287182 0.077137
C -2.637548 0.446251 -0.016170
C 0.175664 1.767166 0.152957
C 2.628418 0.491513 0.064188
C -3.809309 -0.464838 -0.291209
C 1.571691 -1.776584 -0.011221
C 1.395474 2.467393 0.151310
H -2.764879 1.017560 0.925766
H -2.491342 1.184334 -0.831907
H -0.759470 2.319855 0.184673
H 3.620260 0.019142 0.012625
H -3.713911 -1.007873 -1.252428
H -3.976993 -1.209012 0.510980
H 1.418674 3.564691 0.183316
H 0.641136 -2.043941 1.872949
H 1.123287 -3.488501 1.089118


%chk=000202688-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202688

0 1
Br -5.509666 0.917994 0.109948
S -1.223311 -0.802592 -0.300117
O 3.067649 -2.174911 -0.099017
N 2.566862 1.941020 0.233410
N 0.978778 -2.651588 0.773474
C 0.257336 0.267325 -0.040257
C 1.546049 -0.309178 0.166464
C -2.655307 0.446638 -0.130664
C 0.156684 1.679567 -0.100705
C 2.649759 0.583910 0.279045
C -3.944499 -0.363578 -0.040057
C 1.914280 -1.777893 0.251265
C 1.318913 2.464183 0.048174
H -2.490291 1.038947 0.783320
H -2.658672 1.100642 -1.016454
H -0.796026 2.184378 -0.276134
H 3.647056 0.150622 0.406066
H -4.144464 -0.958532 -0.943635
H -3.993297 -0.991524 0.861450
H 1.254913 3.557226 0.004413
H 0.053945 -2.354261 1.088434
H 1.239207 -3.636098 0.833177


