%chk=000239381.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239381

0 1
Br -3.298563 1.678599 2.693664
O -1.875815 -1.165219 -1.389861
O -0.192485 1.509960 2.991126
N -3.798894 0.308188 0.122479
C -4.621399 -0.782405 -0.491768
C -4.972645 -0.209024 0.878209
C 1.061167 -0.771819 -1.038448
C 1.864448 0.500143 1.115596
C -0.064291 -0.258027 -0.142872
C 0.350587 0.396568 0.964453
C -2.459332 0.198242 0.496781
C 1.932164 -1.630926 -0.122796
C 1.911331 0.459062 -1.349333
C 2.366990 -0.941169 1.045919
C 2.346156 1.149393 -0.180968
C -5.418792 -0.405531 -1.723713
C -1.489898 -0.483363 -0.470898
C -0.584956 0.982226 1.978432
C -2.010626 0.841971 1.603231
C 2.303688 -2.946287 -0.342640
C 2.264938 0.914275 -2.608053
C 3.166743 -1.575220 1.981293
C 3.127823 2.287279 -0.285138
C -4.771243 -0.964575 -2.986698
C 3.118157 -3.587515 0.611164
C 3.061037 2.071894 -2.709622
C 3.542168 -2.913657 1.753601
C 3.484955 2.746940 -1.567812
H -4.191607 -1.797847 -0.543280
H -5.794957 0.505999 0.996065
H -4.839837 -0.812118 1.779750
H 0.691036 -1.303191 -1.935769
H 2.169895 1.040968 2.033056
H -5.508759 0.699504 -1.804380
H -6.454484 -0.787344 -1.616005
H 1.978449 -3.482302 -1.231530
H 1.939102 0.395450 -3.506806
H 3.502978 -1.058129 2.877723
H 3.463273 2.823159 0.600438
H -3.696405 -0.727447 -3.019525
H -4.858961 -2.055249 -3.045343
H -5.229526 -0.545633 -3.888960
H 3.415891 -4.622105 0.446702
H 3.343867 2.437950 -3.695588
H 4.171403 -3.420800 2.483758
H 4.099234 3.641633 -1.659933


%chk=000239381-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239381

0 1
Br -3.254178 1.805518 2.846965
O -1.899880 -0.988587 -1.529116
O -0.142537 1.672405 2.952790
N -3.823229 0.173016 0.129916
C -4.650071 -0.920631 -0.451239
C -5.000169 -0.295019 0.908399
C 1.064067 -0.735890 -1.061257
C 1.864657 0.521100 1.099767
C -0.072773 -0.194747 -0.190201
C 0.347411 0.462422 0.936784
C -2.494916 0.255464 0.481767
C 1.905290 -1.627093 -0.123986
C 1.957484 0.482042 -1.370745
C 2.334193 -0.947762 1.047729
C 2.386646 1.164934 -0.201616
C -5.499831 -0.614566 -1.677649
C -1.495891 -0.357808 -0.502598
C -0.594609 1.072346 1.921616
C -2.023648 0.930319 1.608688
C 2.258299 -2.969320 -0.340832
C 2.355597 0.924987 -2.642978
C 3.113382 -1.607807 2.012488
C 3.211352 2.298201 -0.296901
C -4.766499 -0.829043 -3.019166
C 3.047516 -3.639443 0.630274
C 3.190655 2.068181 -2.744069
C 3.470952 -2.964449 1.797542
C 3.614846 2.749341 -1.580592
H -4.188439 -1.917401 -0.433873
H -5.838250 0.406618 0.973141
H -4.797270 -0.867421 1.820851
H 0.696052 -1.257464 -1.957149
H 2.161469 1.054967 2.014043
H -5.859765 0.429771 -1.605007
H -6.395217 -1.267440 -1.629543
H 1.927824 -3.493223 -1.244912
H 2.024260 0.398385 -3.545080
H 3.439243 -1.084253 2.918182
H 3.537567 2.826934 0.605631
H -3.890093 -0.165189 -3.098901
H -4.399443 -1.866729 -3.114549
H -5.446213 -0.623279 -3.865996
H 3.327668 -4.687196 0.474595
H 3.505573 2.426272 -3.730502
H 4.077661 -3.491348 2.542275
H 4.257263 3.632383 -1.669285


