%chk=000275175.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275175

0 1
Br -8.111231 1.955858 0.647543
O 1.978956 -0.727344 -1.828872
O -0.231900 -0.475408 -0.756857
O 0.395837 -0.819441 1.386786
O -1.269821 1.917714 -0.142064
C 2.121280 -0.600956 -0.413566
C 2.942709 -1.861441 -0.020745
C 2.780024 0.757973 -0.039561
C 2.202629 -3.145866 -0.444459
C 3.272977 -1.896972 1.481068
C 1.901010 1.941712 -0.487788
C 4.178457 0.865138 -0.678253
C 3.041478 -4.386144 -0.112501
C 4.104433 -3.141420 1.821486
C 2.563319 3.281876 -0.146079
C 4.842498 2.206470 -0.342229
C 3.395846 -4.430040 1.380659
C 3.962464 3.389747 -0.766299
C 0.719294 -0.653479 0.237777
C -1.616465 -0.449031 -0.354588
C -2.048584 0.995015 -0.126488
C -3.518479 1.192928 0.076938
C -4.300460 0.265616 0.779089
C -4.105401 2.359960 -0.436555
C -5.668631 0.491994 0.954351
C -5.473999 2.590860 -0.273123
C -6.239203 1.650331 0.420047
H 3.898178 -1.807392 -0.604963
H 2.886440 0.796030 1.073716
H 1.222813 -3.213110 0.064681
H 1.985980 -3.102850 -1.531077
H 2.334379 -1.896420 2.075674
H 3.823373 -0.986365 1.781664
H 0.897687 1.896013 -0.010489
H 1.715102 1.883720 -1.578272
H 4.089653 0.746814 -1.777120
H 4.823554 0.034542 -0.334155
H 3.966925 -4.389215 -0.719740
H 2.487184 -5.299868 -0.396836
H 4.297128 -3.172212 2.910436
H 5.096911 -3.075398 1.335985
H 2.627785 3.398575 0.953072
H 1.924392 4.112228 -0.502250
H 5.827106 2.269974 -0.842337
H 5.046736 2.263179 0.744349
H 4.037215 -5.305133 1.592129
H 2.474660 -4.571264 1.978509
H 4.437531 4.341966 -0.466616
H 3.882040 3.420410 -1.869788
H 1.443150 0.019871 -2.193883
H -2.136536 -0.906654 -1.218785
H -1.762559 -1.069676 0.553913
H -3.850201 -0.631608 1.206476
H -3.483239 3.092116 -0.959909
H -6.276281 -0.228936 1.504359
H -5.928843 3.496812 -0.678162


%chk=000275175-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275175

0 1
Br -8.241852 1.856209 1.009023
O 2.073164 -0.637767 -1.968488
O -0.281790 -0.623618 -0.875507
O 0.441146 -0.380640 1.326416
O -1.431490 1.840248 -0.562358
C 2.131224 -0.513948 -0.500193
C 2.880957 -1.807404 -0.013123
C 2.847387 0.832427 -0.115385
C 2.062131 -3.087925 -0.325837
C 3.316655 -1.798958 1.473982
C 2.087007 2.053676 -0.698709
C 4.324193 0.856967 -0.585355
C 2.867688 -4.364530 0.009275
C 4.122077 -3.077735 1.816347
C 2.768805 3.385248 -0.308473
C 5.014405 2.191591 -0.210992
C 3.327596 -4.363271 1.486295
C 4.245596 3.413687 -0.764517
C 0.720282 -0.488005 0.114915
C -1.667779 -0.581347 -0.402729
C -2.198445 0.863648 -0.345525
C -3.647162 1.054628 -0.017897
C -4.522704 -0.029319 0.262384
C -4.158604 2.380666 0.016560
C -5.880053 0.201517 0.567304
C -5.510781 2.626607 0.318829
C -6.358954 1.529129 0.590458
H 3.792694 -1.841499 -0.645308
H 2.818010 0.908873 0.991790
H 1.131851 -3.089655 0.282581
H 1.765495 -3.079981 -1.389940
H 2.421120 -1.736684 2.121799
H 3.934240 -0.909218 1.697598
H 1.032780 2.062079 -0.363477
H 2.073057 1.966518 -1.804254
H 4.344674 0.714021 -1.683813
H 4.893177 0.019002 -0.140325
H 3.757507 -4.419138 -0.651848
H 2.256994 -5.263982 -0.202797
H 4.403496 -3.066059 2.887383
H 5.068518 -3.079088 1.235772
H 2.722215 3.512707 0.793393
H 2.211978 4.233880 -0.751173
H 6.056114 2.190482 -0.587834
H 5.075108 2.273451 0.894783
H 3.942905 -5.259197 1.699453
H 2.436346 -4.419773 2.145430
H 4.733897 4.353129 -0.439013
H 4.283873 3.396552 -1.873559
H 1.177466 -0.343955 -2.275388
H -2.242274 -1.187314 -1.122979
H -1.728048 -1.034372 0.606443
H -4.161940 -1.063094 0.253318
H -3.473428 3.207615 -0.196652
H -6.551564 -0.633461 0.784432
H -5.899657 3.648173 0.343780


