%chk=000259640.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259640

0 1
Br 6.596144 2.878448 1.133303
S 1.368892 0.153717 -1.369057
O 0.907875 -0.751117 0.007569
O 0.326558 1.119326 -1.589004
O 1.712310 -0.809778 -2.379637
O -4.783561 -1.397111 1.407225
C -0.298772 -2.806910 -0.402611
C 0.952739 -3.510853 -0.831599
C -0.294305 -1.439617 -0.049924
C 1.919538 -3.699162 0.349018
C -1.527108 -3.481051 -0.341103
C -2.663992 -1.453022 0.368352
C -1.452276 -0.755151 0.335408
C -2.694612 -2.817365 0.042852
C 3.202107 -4.403295 -0.082981
C -3.939950 -0.784868 0.782892
C 2.773904 0.887675 -0.701668
C -4.141684 0.647347 0.406799
C 3.993773 0.201832 -0.722815
C 2.689389 2.164764 -0.135078
C -3.611952 1.185260 -0.774438
C -4.918757 1.452560 1.255356
C 5.138042 0.791666 -0.177339
C 3.827208 2.764275 0.412862
C 5.038298 2.067110 0.385256
C -3.845358 2.525620 -1.095021
C -5.144766 2.792696 0.934333
C -4.607075 3.329494 -0.240718
H 1.451086 -2.923937 -1.641502
H 0.719619 -4.492286 -1.289984
H 1.421101 -4.277193 1.151790
H 2.155198 -2.708746 0.791601
H -1.570830 -4.541047 -0.593226
H -1.395181 0.301985 0.602753
H -3.642488 -3.359479 0.099259
H 3.897346 -4.508237 0.757553
H 3.720262 -3.851627 -0.875519
H 3.000699 -5.410167 -0.467393
H 4.060558 -0.797366 -1.170837
H 1.733253 2.703526 -0.123065
H -3.018149 0.564266 -1.448789
H -5.348021 1.018414 2.161572
H 6.090503 0.257776 -0.193594
H 3.762545 3.760893 0.854711
H -3.427661 2.942116 -2.010977
H -5.743367 3.416735 1.595532
H -4.784483 4.374584 -0.492013


%chk=000259640-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259640

0 1
Br 6.006004 3.957450 1.102889
S 1.464418 0.048656 -1.632773
O 1.080086 -1.144214 0.021164
O 0.093916 0.900351 -1.881141
O 2.159798 -0.780281 -2.849725
O -4.828562 -1.299671 1.181466
C -0.313349 -3.103993 -0.361134
C 0.897006 -3.931506 -0.733220
C -0.172242 -1.716479 -0.010905
C 1.752062 -4.330285 0.507429
C -1.615096 -3.656362 -0.300854
C -2.598550 -1.480502 0.317303
C -1.304791 -0.918064 0.315973
C -2.737312 -2.868684 0.030322
C 2.975416 -5.181644 0.110554
C -3.833691 -0.695712 0.666779
C 2.752880 1.159575 -0.849435
C -3.900309 0.782287 0.403059
C 4.105679 0.864710 -1.084351
C 2.313209 2.237763 -0.063835
C -3.138538 1.427118 -0.611674
C -4.827140 1.545618 1.166122
C 5.078466 1.706573 -0.500153
C 3.290276 3.075818 0.517544
C 4.657389 2.795753 0.294572
C -3.299389 2.811088 -0.844538
C -4.974662 2.927307 0.939618
C -4.209470 3.564959 -0.068070
H 1.542301 -3.361069 -1.428048
H 0.571990 -4.850183 -1.257574
H 1.119017 -4.888080 1.225078
H 2.081334 -3.405796 1.017569
H -1.751121 -4.717461 -0.539314
H -1.138924 0.130151 0.578268
H -3.741283 -3.304384 0.067472
H 3.577179 -5.451045 0.997666
H 3.630473 -4.630436 -0.589735
H 2.666954 -6.121048 -0.386035
H 4.393156 0.018725 -1.716254
H 1.246023 2.433975 0.077347
H -2.442225 0.860477 -1.238227
H -5.424135 1.028383 1.924612
H 6.142014 1.513830 -0.663342
H 2.988838 3.928185 1.131954
H -2.717436 3.294205 -1.636673
H -5.684521 3.507632 1.539134
H -4.328537 4.639010 -0.250781


