%chk=000293154.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293154

0 1
Br 1.447945 -2.123612 1.232315
O -0.777692 -0.166677 -0.001120
O -0.430147 1.345377 1.664601
O 2.018266 4.000300 -0.626188
O 0.160542 2.926874 -0.937907
O 4.672461 -2.068877 1.404576
O 4.062808 -2.776086 -0.555854
N 1.340057 2.991994 -0.660264
N 4.123561 -1.951670 0.330539
C -3.023251 0.183970 -0.826816
C -2.214587 -0.349468 0.367545
C -4.491189 -0.246332 -0.644560
C -3.801818 -2.275479 0.715733
C -2.324784 -1.860351 0.561201
C -4.622312 -1.765385 -0.485556
C -2.852985 1.718179 -0.989817
C -3.918035 -3.796256 0.850482
C -3.561225 2.212838 -2.256700
C -3.319927 2.506855 0.236855
C -0.031898 0.688541 0.734708
C 1.392771 0.623914 0.242895
C 2.053319 1.704811 -0.367244
C 2.119697 -0.549633 0.444402
C 3.464156 -0.629369 0.057863
C 3.401782 1.626997 -0.739747
C 4.124440 0.444581 -0.529589
H -2.623734 -0.296370 -1.756020
H -2.411909 0.217780 1.303275
H -5.083092 0.090230 -1.517541
H -4.930973 0.268945 0.231537
H -4.205593 -1.805119 1.646990
H -1.738530 -2.175163 1.444356
H -1.862946 -2.383106 -0.300746
H -5.686293 -2.037944 -0.356428
H -4.291911 -2.272823 -1.411861
H -1.752233 1.909249 -1.119521
H -3.355729 -4.166763 1.714675
H -4.960846 -4.105371 0.984763
H -3.536197 -4.316606 -0.035118
H -3.256794 1.642205 -3.139956
H -3.319516 3.264890 -2.449938
H -4.650531 2.142175 -2.171673
H -2.720598 2.259636 1.124308
H -3.206501 3.585391 0.073956
H -4.371423 2.321724 0.474503
H 3.894711 2.499566 -1.190376
H 5.176785 0.376638 -0.820342


%chk=000293154-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000293154

0 1
Br 1.579230 -2.546431 0.631875
O -0.806289 -0.060722 -0.098773
O -0.183304 0.187972 2.147828
O 1.836161 3.985012 0.101627
O -0.014918 2.724847 0.516090
O 5.787668 -1.652021 0.031146
O 4.143359 -2.793393 -1.071554
N 1.241277 2.853965 0.262470
N 4.584261 -1.781320 -0.415531
C -3.107200 0.167265 -0.928029
C -2.262619 -0.287238 0.278070
C -4.593532 -0.187802 -0.636919
C -3.917991 -2.126277 0.892486
C -2.431983 -1.776131 0.619924
C -4.785699 -1.687001 -0.312437
C -2.872657 1.665299 -1.308729
C -4.080759 -3.627896 1.207555
C -3.474094 1.988321 -2.698041
C -3.383407 2.672154 -0.248687
C 0.074072 0.178549 0.923733
C 1.489584 0.344783 0.386137
C 2.065456 1.615389 0.136382
C 2.314409 -0.799899 0.219947
C 3.662538 -0.633965 -0.182682
C 3.414840 1.783029 -0.238640
C 4.220347 0.646814 -0.388767
H -2.779351 -0.445729 -1.796525
H -2.460449 0.337082 1.170222
H -5.211168 0.091353 -1.510515
H -4.960690 0.415485 0.217613
H -4.251096 -1.545788 1.780710
H -1.812104 -2.026754 1.500719
H -2.064899 -2.381355 -0.233767
H -5.852852 -1.894071 -0.099981
H -4.509622 -2.299628 -1.196553
H -1.774628 1.795852 -1.384149
H -3.475351 -3.924057 2.084397
H -5.136092 -3.877056 1.424619
H -3.757747 -4.246836 0.348247
H -3.101582 1.289958 -3.471559
H -3.201993 3.013935 -3.009023
H -4.578876 1.929320 -2.689234
H -2.961740 2.475908 0.753577
H -3.081553 3.697949 -0.527666
H -4.486609 2.658839 -0.171316
H 3.802316 2.790672 -0.402543
H 5.275439 0.726817 -0.662557


