%chk=000180486.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180486

0 1
Br -0.073953 0.775692 -2.941509
Br 1.779020 0.716277 2.496792
O 1.975636 0.355917 -0.602579
O 0.860695 2.179786 -0.183219
O -2.013311 -2.141248 0.629476
O -5.008205 0.752983 -0.082446
N -4.624591 -1.484540 -0.140870
C -1.805109 -0.712036 0.665887
C 0.684159 0.761429 -0.168612
C -1.496258 -0.368760 -0.776873
C -0.683098 -0.385183 1.631851
C -0.404077 0.302621 -1.134950
C 0.409264 0.277677 1.259264
C -3.095086 -0.022884 1.147808
C 2.188526 -1.087405 -0.725044
C 3.690094 -1.179736 -0.977860
C 4.501593 -1.151399 0.323609
C -4.305285 -0.187333 0.243982
C -0.333151 2.954938 0.063962
C 6.001055 -1.240152 0.054296
H -2.239049 -0.726100 -1.497447
H -0.841640 -0.722178 2.658497
H -2.910471 1.070876 1.264893
H -3.367545 -0.376345 2.164466
H 1.592785 -1.446088 -1.582242
H 1.868175 -1.588922 0.201877
H 3.993297 -0.323050 -1.622055
H 3.914772 -2.093854 -1.558954
H 4.188574 -1.979312 0.987866
H 4.269779 -0.213693 0.872515
H -1.893264 -2.547908 1.512080
H -0.739069 2.737044 1.054674
H -1.070872 2.798728 -0.729530
H 0.065310 3.979206 0.022381
H 6.267438 -2.165802 -0.467425
H 6.348587 -0.403100 -0.563226
H 6.572232 -1.212952 0.989156
H -3.979607 -2.256360 -0.007923
H -5.391950 -1.638834 -0.778366


%chk=000180486-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180486

0 1
Br 0.110262 0.809594 -2.874641
Br 1.562217 0.777963 2.820850
O 2.032403 0.290869 -0.336064
O 0.947629 2.228987 -0.046526
O -2.136093 -2.141623 0.726567
O -5.297342 0.652049 -0.165680
N -4.594569 -1.556793 -0.393038
C -1.919429 -0.650146 0.667143
C 0.712725 0.791286 0.004055
C -1.508159 -0.270254 -0.743227
C -0.877365 -0.291884 1.708349
C -0.343043 0.357997 -1.024362
C 0.279058 0.343913 1.407056
C -3.291770 -0.036286 1.062993
C 2.179188 -1.184423 -0.371983
C 3.620662 -1.466045 -0.807319
C 4.681077 -0.946396 0.189504
C -4.477075 -0.274509 0.102606
C -0.228690 3.071115 0.233451
C 6.120514 -1.248445 -0.277088
H -2.218404 -0.532736 -1.534617
H -1.115775 -0.583609 2.737219
H -3.183154 1.056191 1.157089
H -3.566263 -0.436140 2.058797
H 1.457211 -1.614795 -1.097660
H 1.980182 -1.605238 0.636868
H 3.784756 -1.006423 -1.801240
H 3.730884 -2.563064 -0.934889
H 4.504771 -1.406859 1.183595
H 4.543403 0.142671 0.318506
H -1.276118 -2.590546 0.520366
H -0.619312 2.901628 1.255976
H -1.034020 2.909346 -0.508741
H 0.147372 4.101043 0.150147
H 6.286582 -2.336850 -0.393049
H 6.327645 -0.771291 -1.253604
H 6.864541 -0.868863 0.446742
H -3.902301 -2.265797 -0.126705
H -5.388803 -1.777640 -0.993244


