%chk=000252438.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252438

0 1
Br -3.668770 3.086363 -0.173556
O -3.452757 -0.496818 -0.537483
O -3.025154 0.254752 1.560365
C 2.438506 0.181312 -0.249663
C 1.416139 1.266302 0.114717
C 3.853915 0.575335 0.193661
C 0.001883 0.870204 -0.329324
C 4.877123 -0.508306 -0.171480
C -1.014550 1.961970 0.035574
C 6.293921 -0.115209 0.270320
C -2.418373 1.586896 -0.430255
C 7.316707 -1.190235 -0.090445
C -2.969595 0.424141 0.371305
C -4.005606 -1.746656 -0.016121
C -2.961568 -2.738190 0.060519
C -2.087389 -3.564808 0.123525
H 2.151898 -0.779688 0.220185
H 2.423748 -0.000777 -1.341638
H 1.705635 2.227577 -0.352470
H 1.432047 1.444672 1.208090
H 3.870044 0.754588 1.286231
H 4.141554 1.536895 -0.273620
H -0.011806 0.683876 -1.421025
H -0.283340 -0.090338 0.145572
H 4.592503 -1.470176 0.296738
H 4.862369 -0.690266 -1.263238
H -0.710940 2.927408 -0.421298
H -1.009961 2.136715 1.134174
H 6.311027 0.064675 1.363161
H 6.581431 0.846164 -0.198618
H -2.436389 1.355587 -1.525483
H 7.352808 -1.366968 -1.171396
H 8.324359 -0.900784 0.228230
H 7.083278 -2.147165 0.390042
H -4.479493 -1.555963 0.972898
H -4.774144 -1.988270 -0.782332
H -1.340358 -4.277616 0.181638


%chk=000252438-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252438

0 1
Br -3.703644 3.002076 -0.224509
O -3.770802 -0.481497 -0.471763
O -2.701589 0.051238 1.543291
C 2.593727 0.195902 -0.210729
C 1.513124 1.262547 0.075914
C 4.018207 0.654002 0.176205
C 0.092368 0.802605 -0.324812
C 5.100295 -0.412681 -0.106074
C -0.972660 1.888614 -0.017146
C 6.526431 0.047539 0.273787
C -2.368534 1.456447 -0.467055
C 7.600975 -1.024501 -0.009555
C -2.937068 0.295360 0.341651
C -4.431985 -1.655916 0.190420
C -3.706358 -2.900107 -0.083783
C -3.122348 -3.961656 -0.307056
H 2.345441 -0.734726 0.340748
H 2.574547 -0.066686 -1.289257
H 1.764985 2.196572 -0.468270
H 1.523815 1.515832 1.155919
H 4.037878 0.919323 1.253959
H 4.267490 1.583704 -0.377191
H 0.079023 0.557920 -1.407122
H -0.155705 -0.129306 0.220347
H 4.855636 -1.341215 0.451300
H 5.078865 -0.682548 -1.182907
H -0.706939 2.826923 -0.538094
H -0.990784 2.097588 1.067762
H 6.546843 0.318700 1.349170
H 6.770460 0.974424 -0.284615
H -2.435133 1.237735 -1.543450
H 7.620257 -1.291758 -1.083156
H 8.610905 -0.670933 0.268648
H 7.397454 -1.949995 0.561750
H -4.484482 -1.463568 1.277495
H -5.443739 -1.675551 -0.245965
H -2.606255 -4.885208 -0.498361


