%chk=000285030.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285030

0 1
Br -4.551831 -3.384717 -2.115147
O 0.142486 -1.347519 2.194550
O -2.674099 2.396364 1.084199
N 0.271182 0.713336 1.240554
C 0.914777 1.655136 0.392097
C 2.077277 1.263180 -0.322497
C 2.607003 -0.092068 -0.186132
C 1.955932 -1.001109 0.670381
C 0.753929 -0.617330 1.425824
C -0.922809 1.110160 2.021816
C 0.411417 2.971830 0.253172
C 2.702495 2.213176 -1.160932
C 3.756460 -0.529566 -0.883652
C 2.444214 -2.316308 0.828093
C -2.163411 1.297476 1.136183
C 1.052788 3.876641 -0.578404
C 2.205243 3.500391 -1.291448
C 4.229171 -1.825223 -0.723986
C 3.573819 -2.726634 0.135352
C -2.706484 0.137397 0.379221
C -2.514599 -1.188361 0.790197
C -3.463072 0.409825 -0.775222
C -3.065472 -2.239970 0.050821
C -4.010988 -0.633675 -1.523221
C -3.803138 -1.948378 -1.097540
H -0.721549 2.056637 2.580006
H -1.131685 0.334795 2.807186
H -0.486857 3.289126 0.789026
H 3.597684 1.919877 -1.715754
H 4.273782 0.158971 -1.552644
H 1.915808 -2.997122 1.503240
H 0.660232 4.889696 -0.682881
H 2.698780 4.220116 -1.941379
H 5.116809 -2.152434 -1.267652
H 3.955270 -3.739583 0.251956
H -1.927456 -1.418182 1.689811
H -3.623036 1.448741 -1.079803
H -2.911721 -3.270926 0.374977
H -4.592854 -0.418966 -2.420668


%chk=000285030-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285030

0 1
Br -5.027455 -3.322591 -2.098285
O 0.224352 -1.417597 2.226828
O -2.674954 2.443077 1.025206
N 0.314347 0.668457 1.173758
C 0.969179 1.618059 0.339880
C 2.181340 1.258408 -0.338403
C 2.741470 -0.087653 -0.151056
C 2.077639 -0.996020 0.729002
C 0.832514 -0.623794 1.429558
C -0.908413 1.052433 1.921218
C 0.430786 2.926053 0.184340
C 2.805785 2.236193 -1.161850
C 3.929701 -0.536708 -0.798667
C 2.593896 -2.300337 0.954831
C -2.172917 1.278505 1.058772
C 1.078434 3.867336 -0.633859
C 2.271070 3.524620 -1.316156
C 4.433163 -1.828185 -0.573373
C 3.766732 -2.719643 0.309952
C -2.804655 0.147192 0.315761
C -2.458757 -1.213660 0.536648
C -3.823601 0.460940 -0.627224
C -3.118517 -2.240709 -0.171448
C -4.480338 -0.553358 -1.346572
C -4.116913 -1.898613 -1.107064
H -0.727525 1.987595 2.477482
H -1.083964 0.233716 2.642872
H -0.495469 3.215442 0.685673
H 3.731750 1.983782 -1.686583
H 4.466011 0.124887 -1.484741
H 2.047107 -2.953307 1.641967
H 0.648586 4.868865 -0.740457
H 2.773640 4.256573 -1.956249
H 5.348011 -2.148942 -1.083774
H 4.165610 -3.724354 0.483270
H -1.688167 -1.487598 1.266836
H -4.088416 1.512328 -0.778806
H -2.857348 -3.287556 0.005570
H -5.258221 -0.309036 -2.075156


