%chk=000236673.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236673

0 1
Br -0.390990 -2.707249 -1.129053
O 5.618421 0.047148 0.122967
O 0.579458 1.743983 -1.138913
O -4.157392 1.783888 0.264628
O -5.034611 -0.415698 0.085063
N 2.770117 -0.089070 0.015638
C 1.342602 0.009283 0.460333
C 0.499686 0.338667 -0.813424
C 3.552418 -1.044260 0.867708
C 3.484052 1.226385 -0.049426
C 1.057959 0.997092 1.592058
C 4.945372 -1.223434 0.241640
C 4.870751 0.990112 -0.670939
C -0.972070 0.066151 -0.585087
C -1.811039 1.167841 -0.261409
C -1.506929 -1.217831 -0.688125
C -3.142412 0.896022 -0.060929
C -3.671555 -0.427713 -0.167940
C -2.877288 -1.505866 -0.480832
C -5.382750 0.983879 0.356100
H 1.032281 -1.017732 0.802328
H 0.890456 -0.224928 -1.696885
H 3.021738 -2.020463 0.885508
H 3.651901 -0.700710 1.919791
H 3.598704 1.710614 0.944843
H 2.891014 1.924251 -0.686370
H 0.054328 0.836777 2.006287
H 1.773248 0.897408 2.414076
H 1.082398 2.037230 1.239337
H 5.627933 -1.792334 0.896668
H 4.887684 -1.692913 -0.756320
H 4.799731 0.613329 -1.706463
H 5.506515 1.891687 -0.631176
H -1.392895 2.176198 -0.199437
H 1.512909 1.966217 -1.381151
H -3.277356 -2.514989 -0.567057
H -5.748892 1.045065 1.389298
H -6.065495 1.320163 -0.435536


%chk=000236673-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236673

0 1
Br -0.688003 -3.057165 0.728143
O 5.701405 0.193492 -0.173771
O 0.856016 0.757429 -1.535217
O -4.023699 1.894576 -0.688036
O -5.131348 0.008404 0.299640
N 2.800868 0.243760 0.152612
C 1.427820 -0.065937 0.700126
C 0.528755 -0.302209 -0.587241
C 3.527243 -0.997385 -0.259914
C 3.693679 1.086057 0.998738
C 0.866954 1.060433 1.583738
C 4.821237 -0.640055 -1.006768
C 4.982625 1.413002 0.224725
C -0.969926 -0.301849 -0.319825
C -1.723457 0.855263 -0.681910
C -1.655467 -1.400705 0.252532
C -3.094085 0.851025 -0.441009
C -3.749025 -0.255292 0.140551
C -3.053929 -1.409379 0.503076
C -5.355751 1.292372 -0.423788
H 1.452148 -1.006126 1.292780
H 0.798308 -1.290936 -1.018075
H 2.879559 -1.598152 -0.922851
H 3.773599 -1.617683 0.633566
H 3.959907 0.567190 1.949793
H 3.184949 2.031299 1.250374
H -0.135468 0.776088 1.943957
H 1.496552 1.237039 2.472510
H 0.765434 2.005699 1.020140
H 5.404357 -1.545741 -1.240647
H 4.575790 -0.103556 -1.949253
H 4.731737 2.012962 -0.677617
H 5.686117 1.977601 0.858528
H -1.198059 1.685749 -1.157027
H 1.828757 0.942292 -1.305234
H -3.556531 -2.270631 0.946311
H -5.935295 1.968965 0.222029
H -5.853772 1.076301 -1.387887


