%chk=000267208.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267208

0 1
Br -0.773943 2.722127 -2.508731
P -3.191926 -0.223204 0.085380
O -3.385856 -1.249275 -1.166253
O -4.552156 0.707781 -0.025151
O 1.934744 -1.700009 2.275087
O -2.861335 -0.890737 1.351678
N -2.063230 0.995412 -0.476623
C 2.135531 0.701341 -0.346807
C 1.333658 -0.089790 0.539635
C 3.557057 0.412037 -0.084071
C 3.637054 -0.556564 0.964994
C 2.252933 -0.923810 1.415386
C -0.036152 -0.036057 0.539413
C -0.669412 0.846003 -0.392987
C 1.536641 1.556319 -1.251475
C 0.133277 1.607544 -1.263187
C 4.707669 0.911389 -0.667938
C 4.856944 -1.016141 1.419937
C 5.951920 0.437947 -0.199050
C 6.028851 -0.504909 0.822032
C -3.814258 -0.689406 -2.448717
C -5.277669 0.975669 1.208327
C -4.298881 -1.905484 -3.214258
C -5.913175 -0.276497 1.777364
H -0.620565 -0.644549 1.247392
H 2.123180 2.167275 -1.937431
H 4.665481 1.647656 -1.465918
H -2.430098 1.858100 -0.923836
H 4.914713 -1.754975 2.220257
H 6.866724 0.823443 -0.650969
H 6.999415 -0.856556 1.168419
H -4.619019 0.055268 -2.296306
H -2.927726 -0.224419 -2.922601
H -4.605060 1.478488 1.928773
H -6.035281 1.699237 0.840568
H -4.513519 -1.666593 -4.261248
H -3.541725 -2.704685 -3.193512
H -5.205396 -2.330060 -2.762609
H -6.666291 -0.029036 2.535702
H -6.413682 -0.870928 1.001060
H -5.177640 -0.939152 2.267274


%chk=000267208-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267208

0 1
Br -0.668141 3.940453 -1.238014
P -3.288215 0.371288 0.707201
O -3.205998 -1.112620 -0.174545
O -4.646894 1.279376 0.128697
O 1.746287 -2.419379 1.063073
O -3.242007 0.086041 2.264241
N -2.111795 1.429321 -0.034101
C 2.106289 0.894888 -0.311651
C 1.269956 -0.133023 0.215009
C 3.513971 0.421830 -0.292441
C 3.534574 -0.902411 0.244159
C 2.129353 -1.317984 0.583810
C -0.114243 0.011342 0.327388
C -0.723198 1.231052 -0.105889
C 1.531008 2.101924 -0.738148
C 0.129576 2.248846 -0.629778
C 4.712965 1.037418 -0.691684
C 4.730973 -1.620908 0.387907
C 5.927067 0.312886 -0.547248
C 5.941409 -0.999538 -0.014850
C -3.246768 -1.102298 -1.670809
C -5.908278 1.207210 0.932258
C -3.112729 -2.559687 -2.100854
C -6.630978 -0.127626 0.737771
H -0.719902 -0.801994 0.742833
H 2.132980 2.918631 -1.146597
H 4.725435 2.051912 -1.104979
H -2.480037 2.331746 -0.353068
H 4.718967 -2.634571 0.801950
H 6.870441 0.778888 -0.853384
H 6.892181 -1.533557 0.085018
H -4.205321 -0.657404 -1.997991
H -2.411604 -0.483092 -2.050917
H -5.661186 1.381434 1.996045
H -6.492898 2.056889 0.544281
H -3.135427 -2.628643 -3.204391
H -2.160692 -2.985216 -1.741884
H -3.940497 -3.164145 -1.693773
H -7.596390 -0.109697 1.277023
H -6.834949 -0.313915 -0.330977
H -6.033486 -0.965467 1.138313


