%chk=000214116.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214116

0 1
Br 1.943583 -1.103861 -3.370239
O -0.358961 -0.734417 0.017040
N -4.278503 -1.207312 -0.276795
C -3.990556 -0.424185 0.978511
C -3.764350 -0.268342 -1.338265
C -4.347255 1.056989 0.645690
C -4.201293 1.159190 -0.887207
C -2.477853 -0.594864 1.236704
C -2.229544 -0.416379 -1.319592
C -1.645657 -0.055436 0.057851
C -5.719360 -1.544049 -0.440215
C 0.609876 -0.334869 1.007276
C 1.833187 -1.178606 0.704257
C 0.964046 1.139256 0.930877
C 2.477514 -1.125933 -0.548715
C 1.399529 1.735089 -0.267857
C 2.340702 -2.008928 1.715380
C 0.867437 1.916918 2.095134
C 1.959017 -0.274065 -1.624214
C 1.498347 0.979876 -1.525510
C 3.638980 -1.894449 -0.756571
C 1.725816 3.105091 -0.282197
C 3.488454 -2.770259 1.495083
C 1.200027 3.271515 2.074041
C 4.141512 -2.706966 0.258553
C 1.631192 3.865887 0.881738
H -4.573360 -0.806959 1.840911
H -4.162860 -0.527450 -2.340439
H -3.687145 1.763589 1.168930
H -5.372974 1.292727 0.966834
H -5.151687 1.444948 -1.362384
H -3.465235 1.921806 -1.180318
H -2.192173 -0.101265 2.178337
H -2.253395 -1.676335 1.358377
H -1.954152 -1.469914 -1.552194
H -1.761085 0.197807 -2.106496
H -1.472870 1.036264 0.154829
H -5.846496 -2.101291 -1.382625
H -6.403906 -0.683871 -0.449991
H -6.019527 -2.219806 0.376786
H 0.182006 -0.587137 2.007295
H 1.835019 -2.063713 2.678597
H 0.533424 1.460569 3.026487
H 1.150324 1.528418 -2.408504
H 4.156757 -1.854941 -1.716602
H 2.064610 3.569113 -1.207874
H 3.875426 -3.414094 2.283326
H 1.125371 3.866100 2.982661
H 5.041099 -3.296365 0.087476
H 1.893341 4.922810 0.864619


%chk=000214116-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214116

0 1
Br 2.808325 -0.637887 -3.508175
O -0.267762 -0.899984 -0.129861
N -4.421383 -1.093364 -0.098198
C -3.893561 -0.257576 1.028301
C -3.837925 -0.384807 -1.285264
C -4.100764 1.234641 0.563916
C -4.074154 1.145938 -1.000533
C -2.392253 -0.605943 1.206006
C -2.332230 -0.740250 -1.346159
C -1.601001 -0.254792 -0.078955
C -5.899292 -1.192894 -0.126629
C 0.700971 -0.453072 0.899779
C 1.979916 -1.228837 0.639981
C 0.908933 1.057891 0.911832
C 2.708570 -1.126962 -0.591730
C 1.364800 1.755969 -0.250347
C 2.434181 -2.119725 1.641581
C 0.572728 1.792791 2.074078
C 2.340740 -0.147860 -1.629140
C 1.783685 1.095769 -1.492670
C 3.851817 -1.960836 -0.768116
C 1.404484 3.181771 -0.217932
C 3.577749 -2.922226 1.458318
C 0.654639 3.201169 2.105376
C 4.286066 -2.842884 0.237295
C 1.062038 3.899522 0.943101
H -4.442838 -0.489094 1.958084
H -4.337548 -0.724683 -2.209197
H -3.312999 1.899498 0.961598
H -5.070403 1.622503 0.923847
H -5.033811 1.479777 -1.433681
H -3.278451 1.770726 -1.444183
H -1.986621 -0.058194 2.079265
H -2.304840 -1.691445 1.396907
H -2.230410 -1.837957 -1.413983
H -1.857241 -0.295689 -2.240466
H -1.461539 0.845557 -0.130891
H -6.202102 -1.804302 -0.995361
H -6.436547 -0.215498 -0.190251
H -6.244197 -1.711015 0.786145
H 0.320517 -0.747080 1.900785
H 1.860560 -2.198687 2.572533
H 0.228109 1.249163 2.962873
H 1.697186 1.709490 -2.397421
H 4.409065 -1.900080 -1.707390
H 1.735639 3.721273 -1.113420
H 3.901276 -3.611384 2.245627
H 0.387507 3.749526 3.015174
H 5.172652 -3.463753 0.070065
H 1.114119 4.993685 0.946283


