%chk=000221855.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221855

0 1
Br -0.748936 0.820868 2.145625
O 0.330960 1.007939 -0.788313
O 3.732390 3.046500 -0.662554
O 1.702620 2.873803 -1.395745
O 4.807754 -2.527930 1.834916
O 5.942440 -0.745688 1.361892
N 2.680458 2.447516 -0.814439
N 4.914710 -1.399551 1.383149
C -5.081371 -0.862069 -0.611782
C -3.611802 -0.425413 -0.650512
C -5.466195 -1.662696 -1.869010
C -5.934754 0.417378 -0.531782
C -5.342177 -1.749668 0.619958
C -2.959838 -0.078703 0.548358
C -2.912647 -0.312921 -1.862969
C -1.633500 0.349763 0.536004
C -1.581688 0.111589 -1.894961
C -0.960447 0.436857 -0.688750
C 1.387917 0.358043 -0.231935
C 2.605301 1.089711 -0.249359
C 1.342973 -0.952093 0.298125
C 3.763673 0.508598 0.289777
C 3.703057 -0.782650 0.818187
C 2.490218 -1.516010 0.821076
H -6.505234 -2.008900 -1.810157
H -5.387534 -1.063374 -2.782510
H -4.837693 -2.551615 -1.990478
H -5.768921 1.068352 -1.397547
H -7.004020 0.180524 -0.501609
H -5.706481 1.004727 0.364420
H -6.373485 -2.121619 0.626458
H -4.681732 -2.623522 0.632706
H -5.197744 -1.208043 1.561214
H -3.500183 -0.139223 1.498239
H -3.406802 -0.552763 -2.807597
H -1.036672 0.210873 -2.834903
H 0.403436 -1.508825 0.298143
H 4.712458 1.075971 0.292232
H 2.482791 -2.531039 1.242833


%chk=000221855-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221855

0 1
Br -1.053221 1.565114 2.085579
O 0.334132 1.142586 -0.746972
O 3.806616 3.184886 -0.313678
O 2.182125 2.779222 -1.866489
O 4.741183 -2.687372 1.857240
O 6.019358 -0.867623 1.336229
N 2.893847 2.443173 -0.849499
N 4.895495 -1.500913 1.369143
C -5.113569 -0.899574 -0.616615
C -3.652071 -0.395786 -0.666213
C -5.557844 -1.535406 -1.958912
C -6.060459 0.298593 -0.303744
C -5.250377 -1.973910 0.504833
C -3.090423 0.217883 0.488007
C -2.835077 -0.504380 -1.820741
C -1.767835 0.696513 0.489481
C -1.507244 -0.026037 -1.826089
C -0.969489 0.566713 -0.669786
C 1.426209 0.448365 -0.247406
C 2.699756 1.093283 -0.263349
C 1.327987 -0.856706 0.302986
C 3.833738 0.468344 0.282440
C 3.702348 -0.827848 0.811092
C 2.458700 -1.499909 0.824236
H -6.603471 -1.881464 -1.872136
H -5.516844 -0.809614 -2.791961
H -4.939216 -2.412324 -2.225565
H -5.986736 1.075645 -1.086013
H -7.108790 -0.050096 -0.260470
H -5.822745 0.770149 0.666644
H -6.295256 -2.331103 0.558895
H -4.598154 -2.843252 0.303174
H -4.981675 -1.569940 1.497358
H -3.688782 0.332959 1.396577
H -3.229311 -0.958735 -2.732733
H -0.881407 -0.089523 -2.721589
H 0.354749 -1.354266 0.323053
H 4.797994 0.982997 0.292338
H 2.399059 -2.505947 1.247054


