%chk=000252089.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252089

0 1
Br 1.189905 -3.961483 1.706617
O -2.410955 1.735491 -0.086502
O -2.165293 -0.482613 0.517755
O 2.152566 1.644132 -0.040748
O 3.813411 -2.571417 0.610258
N 0.709965 0.055052 0.830357
N 2.991492 -0.483180 0.297001
C -0.409800 1.029230 0.878501
C -1.520591 0.628517 -0.116394
C 1.984493 0.499192 0.326458
C 0.491318 -1.263540 1.231969
C -3.278293 1.894501 -1.246653
C -3.034472 -1.303631 -0.293855
C 1.492405 -2.184416 1.173701
C 2.839429 -1.865922 0.706497
C -4.064232 3.153173 -0.938577
C -2.238262 -2.175422 -1.247278
H -0.035782 2.056317 0.628960
H -0.832497 1.082239 1.910453
H -1.180667 0.378094 -1.136511
H -0.536249 -1.505619 1.575119
H -2.649412 1.993403 -2.147985
H -3.921288 0.995296 -1.320611
H -3.552711 -1.896157 0.486388
H -3.765321 -0.653771 -0.812678
H 3.919499 -0.186089 -0.043873
H -4.798518 3.372467 -1.721159
H -4.598883 3.060216 0.018096
H -3.400375 4.023365 -0.837838
H -2.866601 -2.960224 -1.687812
H -1.800065 -1.608770 -2.075707
H -1.411116 -2.681633 -0.728549


%chk=000252089-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252089

0 1
Br 1.791451 -3.711566 2.438556
O -2.755599 1.362459 -0.029768
O -2.176678 -0.835281 0.613741
O 1.727559 1.538225 -0.612050
O 4.059469 -2.333760 0.594442
N 0.663363 0.014677 0.839890
N 2.843987 -0.416788 0.041963
C -0.542382 0.871953 0.904963
C -1.682109 0.368577 -0.001349
C 1.749010 0.457879 0.039888
C 0.697524 -1.204056 1.514023
C -2.682305 2.289572 -1.184527
C -3.246169 -1.537646 -0.141745
C 1.793145 -2.033588 1.478233
C 2.993127 -1.675376 0.709846
C -3.896945 3.211296 -1.100881
C -2.708974 -2.304420 -1.358924
H -0.241711 1.881387 0.583966
H -0.916666 0.909383 1.941646
H -1.317823 0.184410 -1.039658
H -0.214997 -1.460641 2.055497
H -1.738188 2.871962 -1.145242
H -2.685310 1.701713 -2.128126
H -3.674652 -2.230632 0.600685
H -4.018561 -0.798590 -0.425134
H 3.648339 -0.116474 -0.518649
H -3.894504 3.923482 -1.945823
H -4.832610 2.627220 -1.136539
H -3.883589 3.785386 -0.158823
H -3.526358 -2.889310 -1.820291
H -2.306845 -1.628953 -2.135511
H -1.910897 -3.005704 -1.058900


