%chk=000266636.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266636

0 1
Br -6.898006 0.250651 -0.561178
O -1.234864 1.147320 -1.881153
N -1.176311 -0.752921 1.171560
N 1.406809 -2.427880 -2.188425
N 1.323069 2.527464 2.201924
C -0.356697 -0.062818 0.099034
C 0.506395 -1.060341 -0.600119
C 0.426677 1.053668 0.708454
C -1.460378 0.538771 -0.869965
C -2.758622 0.142018 -0.296057
C -2.538430 -0.683178 0.846213
C 1.577256 -1.810764 0.013732
C 1.335415 1.918955 -0.009135
C 0.434637 -1.447424 -1.932746
C 0.432642 1.449662 2.039096
C 2.122492 -2.667406 -1.000436
C 1.888155 2.831950 0.949503
C -4.049260 0.434703 -0.724842
C -3.617783 -1.253814 1.543227
C 2.136902 -1.837839 1.305689
C 1.723346 2.025063 -1.358315
C 3.187029 -3.553184 -0.738376
C 2.824870 3.820904 0.587810
C -5.112735 -0.123305 -0.009694
C -4.905996 -0.956699 1.103723
C 3.182700 -2.707883 1.558535
C 2.642705 2.997865 -1.710535
C 3.699777 -3.559981 0.546392
C 3.189955 3.884056 -0.745477
H -0.785213 -1.594477 1.583251
H -0.225130 -1.085504 -2.707924
H -0.130490 1.051108 2.866357
H 1.578514 -2.863098 -3.073787
H 1.502851 3.011418 3.058594
H -4.209824 1.077343 -1.594670
H -3.453979 -1.894012 2.404296
H 1.755715 -1.165409 2.072272
H 1.280834 1.354929 -2.096226
H 3.584394 -4.195636 -1.516797
H 3.234822 4.499887 1.326391
H -5.764638 -1.379524 1.633202
H 3.634059 -2.745370 2.548268
H 2.956767 3.100057 -2.747111
H 4.523871 -4.226604 0.798514
H 3.910896 4.631081 -1.075169


%chk=000266636-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266636

0 1
Br -7.027721 0.211676 -0.504338
O -1.294123 1.110223 -1.953098
N -1.185653 -0.765586 1.133156
N 1.324539 -2.518160 -2.218251
N 1.095285 2.679565 2.154032
C -0.378289 -0.078177 0.074998
C 0.501985 -1.082826 -0.649209
C 0.396986 1.087404 0.676837
C -1.510416 0.488544 -0.879054
C -2.797821 0.123627 -0.270074
C -2.544235 -0.671951 0.890300
C 1.609517 -1.821177 -0.060662
C 1.385875 1.924174 0.013425
C 0.362345 -1.535322 -1.960713
C 0.241843 1.585128 1.971194
C 2.101346 -2.722458 -1.070344
C 1.811692 2.910953 0.971921
C -4.112416 0.402522 -0.705052
C -3.626719 -1.228934 1.621207
C 2.238683 -1.811397 1.214118
C 1.949675 1.950797 -1.290430
C 3.177653 -3.606647 -0.839283
C 2.778189 3.896943 0.673309
C -5.170985 -0.141490 0.039571
C -4.937988 -0.952609 1.184772
C 3.310657 -2.692655 1.451485
C 2.914092 2.929139 -1.594032
C 3.773584 -3.583350 0.437893
C 3.327072 3.890932 -0.624150
H -0.759550 -1.474556 1.729023
H -0.336703 -1.210617 -2.728023
H -0.417533 1.238375 2.763141
H 1.447612 -2.997250 -3.107363
H 1.179167 3.222834 3.009924
H -4.278049 1.016209 -1.595209
H -3.462048 -1.853177 2.505199
H 1.917828 -1.105312 1.988181
H 1.622143 1.231853 -2.046021
H 3.542236 -4.285526 -1.618262
H 3.090046 4.640656 1.415241
H -5.789575 -1.366097 1.734014
H 3.809638 -2.689953 2.426877
H 3.354004 2.961550 -2.596904
H 4.612191 -4.254577 0.653687
H 4.079139 4.640501 -0.895131


