%chk=000250724.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250724

0 1
Br 1.659543 -3.244850 0.441642
O -0.844855 1.987651 -0.769918
O -2.789354 1.265648 1.297495
O 3.013882 -0.407774 0.031039
N -1.041308 -0.282196 -0.504873
N 1.124339 0.812650 -0.380955
N -1.225960 -2.649975 -0.037584
C -2.504613 -0.126376 -0.723683
C -0.255847 0.941814 -0.549000
C -0.450644 -1.509115 -0.147194
C 1.931827 2.081059 -0.390809
C 1.811881 -0.446833 -0.081736
C 0.921495 -1.572657 0.030403
C -3.271909 0.130241 0.584432
C 1.906119 2.758790 0.972361
H -2.909121 -1.007861 -1.265494
H -2.649631 0.745643 -1.418151
H 2.976157 1.806818 -0.677769
H 1.521965 2.754157 -1.177929
H -3.162016 -0.688844 1.320846
H -4.347969 0.289842 0.369658
H 0.888272 3.046163 1.267599
H 2.306544 2.105482 1.759387
H 2.515464 3.670845 0.965733
H -2.230013 -2.598068 0.000692
H -0.818694 -3.516656 0.301826
H -2.494858 1.980503 0.675583


%chk=000250724-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250724

0 1
Br 1.821058 -3.249345 0.423986
O -0.921480 2.053568 -0.562118
O -3.075605 1.407061 1.139346
O 3.065409 -0.373821 -0.060782
N -1.045505 -0.273181 -0.384956
N 1.070802 0.839772 -0.337577
N -1.246450 -2.608585 0.042081
C -2.493874 -0.165672 -0.717627
C -0.309904 0.942598 -0.424559
C -0.435457 -1.501846 -0.091770
C 1.866494 2.101434 -0.389949
C 1.804014 -0.397153 -0.127981
C 0.954955 -1.559821 0.016144
C -3.404454 0.148080 0.488508
C 2.070917 2.710623 1.009806
H -2.809284 -1.095851 -1.223622
H -2.578412 0.658855 -1.446642
H 2.836147 1.835548 -0.840155
H 1.324625 2.800153 -1.047118
H -3.335850 -0.643983 1.261672
H -4.451240 0.168643 0.113003
H 1.104504 2.970496 1.474928
H 2.613088 2.008463 1.665693
H 2.671179 3.634498 0.926566
H -2.242784 -2.526389 0.223680
H -0.790410 -3.502474 0.224720
H -2.481786 1.944431 0.538326


