%chk=000284657.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284657

0 1
Br 2.012609 2.255190 1.621306
S -1.614913 1.816872 0.365615
O -1.668485 2.816692 -0.675025
O -1.712679 2.152475 1.765008
O 1.227414 -1.503998 1.846178
N -0.073865 1.010600 0.207343
C 0.400550 0.627988 -1.147218
C 1.840125 1.050629 -1.456099
C 0.744810 0.744320 1.335290
C 2.912730 0.175773 -0.873445
C 2.779365 -0.555877 0.319935
C 1.579381 -0.548191 1.190430
C -2.723098 0.559007 -0.022355
C 4.127337 0.095691 -1.584963
C 3.843280 -1.368465 0.765891
C -2.955225 -0.482834 0.884843
C -3.414599 0.586510 -1.239602
C 5.178298 -0.693809 -1.124725
C 5.036703 -1.437090 0.054561
C -3.859119 -1.496665 0.573074
C -4.320591 -0.423922 -1.557819
C -4.549113 -1.475931 -0.652972
C -5.518862 -2.560672 -0.976842
H -0.273855 1.103671 -1.900591
H 0.298264 -0.477808 -1.265442
H 2.009947 2.104827 -1.124113
H 1.952309 1.098391 -2.562559
H 0.147996 0.714984 2.292694
H 4.250387 0.665296 -2.505301
H 3.716713 -1.947251 1.686094
H -2.431707 -0.504657 1.847024
H -3.248700 1.410553 -1.944919
H 6.113367 -0.736120 -1.684181
H 5.854236 -2.060543 0.411140
H -4.033153 -2.305225 1.282015
H -4.855216 -0.393827 -2.505749
H -5.899113 -2.507497 -2.006103
H -5.070705 -3.558259 -0.852004
H -6.395022 -2.520127 -0.310013


%chk=000284657-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000284657

0 1
Br 1.919455 3.363036 1.696506
S -1.722343 1.856560 0.640414
O -2.043677 3.109570 -0.349118
O -1.851438 1.943329 2.259314
O 2.338981 0.059228 2.846676
N 0.144661 1.251991 0.327685
C 0.552840 1.570823 -1.058342
C 2.084932 1.488093 -1.254175
C 0.943258 1.416405 1.456933
C 2.721431 0.169516 -0.855089
C 2.748932 -0.295741 0.497539
C 2.080431 0.382522 1.654078
C -2.691463 0.367111 0.029978
C 3.383654 -0.600559 -1.842866
C 3.443337 -1.498417 0.814141
C -2.832849 -0.732681 0.893052
C -3.262843 0.433246 -1.249392
C 4.058345 -1.798444 -1.522003
C 4.092625 -2.248865 -0.181441
C -3.583961 -1.831883 0.428181
C -4.010230 -0.683473 -1.688630
C -4.178769 -1.826297 -0.864136
C -4.994195 -3.015525 -1.335623
H 0.221268 2.599731 -1.309443
H 0.036600 0.862052 -1.732585
H 2.553107 2.318349 -0.694262
H 2.271091 1.678152 -2.326843
H 0.333842 1.454090 2.377402
H 3.377183 -0.246229 -2.880421
H 3.454975 -1.819529 1.860686
H -2.390814 -0.722527 1.894260
H -3.148437 1.331339 -1.865073
H 4.559336 -2.371287 -2.310213
H 4.619730 -3.172146 0.080325
H -3.713718 -2.704343 1.078669
H -4.472259 -0.660544 -2.681703
H -5.297516 -2.910318 -2.390522
H -4.424079 -3.957221 -1.236675
H -5.913624 -3.128412 -0.730882


