%chk=000215631.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215631

0 1
Br -5.947945 1.557863 -0.051084
O -0.815666 -2.810797 0.782309
N -0.292150 -0.804718 -0.274718
N 1.357647 -2.498667 0.232431
C 2.159744 -0.183427 -0.278013
C 0.763631 0.014976 -0.932371
C 2.478898 -1.702634 -0.302067
C 2.172063 0.341206 1.176143
C 3.196505 0.568956 -1.150531
C 0.023657 -2.078141 0.273663
C 1.908179 1.816736 1.269710
C 4.591235 0.512682 -0.599572
C -1.627804 -0.281331 -0.231535
C -2.507495 -0.638857 0.812626
C -2.059504 0.611093 -1.234741
C 0.725908 2.334075 1.596593
C 5.343274 1.591424 -0.391715
C -3.789861 -0.097695 0.859708
C -3.343952 1.156354 -1.177273
C -4.195331 0.803164 -0.130245
H 0.483134 1.093291 -0.865604
H 0.806989 -0.254701 -2.012057
H 2.694219 -2.029211 -1.346845
H 3.392439 -1.918470 0.295980
H 3.154291 0.117304 1.642661
H 1.429108 -0.223675 1.779158
H 2.869429 1.624351 -1.269874
H 3.205826 0.153521 -2.180929
H 1.567528 -3.412664 0.629461
H 2.774018 2.446774 1.056598
H 4.966511 -0.490929 -0.392209
H -2.196174 -1.361676 1.575266
H -1.415505 0.872492 -2.070677
H 0.543866 3.395953 1.677063
H -0.152129 1.739885 1.813911
H 6.354784 1.542968 -0.013356
H 5.016875 2.603725 -0.581389
H -4.467295 -0.380304 1.668360
H -3.672146 1.848504 -1.954638


%chk=000215631-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215631

0 1
Br -6.062506 1.545635 -0.275428
O -0.831631 -2.866765 0.849018
N -0.285884 -0.800659 -0.182644
N 1.366862 -2.452868 0.282072
C 2.167796 -0.178740 -0.268405
C 0.756509 -0.008758 -0.887176
C 2.488775 -1.694148 -0.286475
C 2.201772 0.356948 1.204795
C 3.173137 0.588593 -1.186379
C 0.025349 -2.080796 0.337049
C 1.916721 1.838684 1.346111
C 4.620878 0.516363 -0.745210
C -1.633839 -0.304806 -0.204159
C -2.583268 -0.657649 0.795965
C -2.032671 0.594355 -1.231493
C 0.769635 2.363240 1.848226
C 5.412783 1.589643 -0.499317
C -3.884662 -0.116031 0.771338
C -3.332882 1.143282 -1.255751
C -4.248963 0.784425 -0.250163
H 0.473425 1.055614 -0.819239
H 0.795450 -0.287894 -1.962500
H 2.696606 -2.012958 -1.331641
H 3.394723 -1.906529 0.311478
H 3.211345 0.143732 1.609960
H 1.477078 -0.218652 1.808109
H 2.862408 1.648036 -1.258628
H 3.088297 0.164673 -2.210872
H 1.532019 -3.386154 0.660264
H 2.719365 2.521919 1.029153
H 5.055859 -0.490736 -0.649540
H -2.309660 -1.372978 1.571701
H -1.345142 0.864132 -2.037775
H 0.622447 3.445816 1.937322
H -0.055756 1.723784 2.186534
H 6.462316 1.475897 -0.205786
H 5.035985 2.616330 -0.592526
H -4.602405 -0.395492 1.548015
H -3.621471 1.830909 -2.055804


