%chk=000220432.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220432

0 1
Br 2.572049 2.748946 -0.322495
O 0.514162 -2.109977 0.550487
O 2.773168 -0.301627 0.175422
O -2.653480 2.980712 -0.246778
O -3.187666 -0.894876 0.175342
O -1.770783 -2.471326 0.567291
N -2.043295 -1.312645 0.318246
C -1.215067 1.029561 -0.057134
C -0.950121 -0.345121 0.171703
C 0.397547 -0.798289 0.258932
C 1.461254 0.130004 0.057233
C -0.156770 1.923517 -0.211722
C 1.166563 1.477739 -0.147599
C -2.629373 1.555222 -0.139637
C 1.829484 -2.689108 0.799332
C 3.446416 -0.507166 -1.101061
H -0.379687 2.980826 -0.407331
H -3.125443 1.214611 -1.078107
H -3.252804 1.227168 0.718873
H 2.350148 -2.822266 -0.151699
H 1.544678 -3.651745 1.246967
H 2.408916 -2.069882 1.493472
H 3.420896 0.396990 -1.714586
H 2.993782 -1.352864 -1.624669
H 4.470254 -0.727873 -0.775646
H -2.504827 3.392165 0.631765


%chk=000220432-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220432

0 1
Br 2.592826 3.018753 -0.377856
O 0.920044 -2.051824 -0.085532
O 2.946344 -0.080468 -0.157073
O -2.738653 2.958031 0.314836
O -2.885396 -1.233733 -0.537633
O -1.623118 -2.248039 1.070331
N -1.817167 -1.328940 0.186991
C -1.165742 1.069662 -0.077345
C -0.779251 -0.294041 0.013202
C 0.581539 -0.698939 -0.033942
C 1.597981 0.291980 -0.155853
C -0.141247 2.037998 -0.173248
C 1.213479 1.653327 -0.211644
C -2.622144 1.544766 -0.053810
C 1.534357 -2.612954 1.149476
C 3.425331 -0.709827 -1.417457
H -0.430460 3.090389 -0.232764
H -3.054586 1.480082 -1.065355
H -3.241903 0.903709 0.603049
H 2.430893 -2.031262 1.426616
H 1.806505 -3.645575 0.887454
H 0.782049 -2.610310 1.956113
H 3.347563 0.012246 -2.250601
H 2.843613 -1.622014 -1.636558
H 4.480400 -0.957159 -1.230897
H -2.523259 3.066840 1.276103


