%chk=000264098.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264098

0 1
Br 1.210197 3.451455 0.009481
S -2.079377 0.236063 0.012853
O -3.171504 0.370159 0.973972
O -2.405307 0.366629 -1.407067
C -1.392818 -1.408284 0.269392
C -0.063989 -1.665664 -0.499152
C -0.911156 1.571606 0.401130
C 0.333998 1.625515 -0.511523
C 1.109158 -0.822802 0.042443
C 1.372470 0.538914 -0.246982
C -1.211730 -1.630144 1.771527
C -2.526155 -2.317614 -0.236311
C 0.272344 -3.180614 -0.384937
C -0.183552 -1.419244 -2.014257
C -0.531500 1.443798 1.875142
C -1.808693 2.810451 0.221540
C 0.050245 1.815002 -1.985209
C 2.102241 -1.532265 0.754956
C 2.726829 0.943780 -0.229888
C 3.393016 -1.045010 0.934005
C 3.733371 0.174413 0.345680
H -2.106368 -1.327483 2.341325
H -0.348612 -1.086436 2.182221
H -1.051791 -2.693241 1.997062
H -3.459224 -2.159484 0.327920
H -2.275653 -3.379958 -0.124265
H -2.753324 -2.148851 -1.300305
H 1.198005 -3.421135 -0.921453
H 0.384038 -3.509454 0.653929
H -0.519546 -3.794810 -0.831024
H -0.698172 -0.480482 -2.286719
H 0.803628 -1.398866 -2.489658
H -0.764999 -2.207878 -2.507850
H 0.142200 0.598744 2.077135
H -0.012803 2.343382 2.242134
H -1.422017 1.339528 2.516076
H -1.360969 3.721211 0.642209
H -2.031317 3.016539 -0.834613
H -2.772555 2.705586 0.750009
H -0.502323 2.741970 -2.204882
H 0.968512 1.834800 -2.585636
H -0.596784 1.006575 -2.395985
H 1.868176 -2.512774 1.177179
H 3.024176 1.897489 -0.678395
H 4.129962 -1.618913 1.491938
H 4.761172 0.531497 0.356956


%chk=000264098-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264098

0 1
Br 1.493489 3.603307 -0.456320
S -2.101879 0.269823 0.219071
O -3.048353 0.365372 1.560634
O -2.877529 0.406263 -1.228705
C -1.248958 -1.631220 0.300864
C -0.048704 -1.762273 -0.716487
C -0.797019 1.983168 0.394496
C 0.391263 1.643627 -0.510360
C 1.207075 -0.928262 -0.221660
C 1.339460 0.511308 0.004809
C -0.884508 -1.770948 1.782644
C -2.506268 -2.449890 -0.050776
C 0.265509 -3.307394 -0.710183
C -0.467107 -1.490801 -2.208803
C -0.545853 2.059686 1.894931
C -1.787810 3.037563 -0.105585
C 0.084557 1.623527 -2.014391
C 2.328991 -1.722182 0.166510
C 2.475345 0.949566 0.747672
C 3.479269 -1.239943 0.816119
C 3.528535 0.117683 1.163730
H -1.741126 -1.467747 2.409875
H -0.002074 -1.175865 2.066655
H -0.662803 -2.832393 2.002837
H -3.361184 -2.111387 0.561818
H -2.335128 -3.514515 0.190076
H -2.786526 -2.357912 -1.111492
H 1.070682 -3.530424 -1.432310
H 0.547537 -3.707802 0.278156
H -0.625704 -3.853920 -1.054871
H -1.328546 -0.811596 -2.297086
H 0.384289 -1.082914 -2.775738
H -0.761401 -2.436840 -2.695614
H 0.195729 1.326175 2.248211
H -0.174186 3.072723 2.137956
H -1.496391 1.900383 2.435925
H -1.284407 4.019656 -0.145903
H -2.189260 2.797902 -1.103357
H -2.638532 3.108772 0.594306
H -0.220902 2.619510 -2.365586
H 0.974661 1.313656 -2.583150
H -0.754234 0.945571 -2.229704
H 2.310347 -2.791970 -0.030532
H 2.554699 2.011762 0.978944
H 4.295888 -1.926389 1.064052
H 4.370566 0.541287 1.720424


