%chk=000296886.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296886

0 1
Br -6.187086 -1.254551 1.084072
S -0.574305 1.139970 -0.871386
O 0.397025 0.543386 0.366528
O -0.137947 0.507953 -2.090927
O -0.543659 2.575415 -0.746762
C 2.892219 -1.100474 -0.053506
C 2.632128 0.281313 -0.702952
C 3.521139 -0.522595 1.241869
C 1.985931 -2.301814 -0.140465
C 3.362901 -2.333353 -0.784114
C 1.772028 0.965856 0.417825
C 2.342488 0.371759 1.737389
C 4.026069 0.892907 -0.540176
C 4.549722 0.421968 0.608446
C -2.086691 0.498000 -0.349854
C -2.902673 1.248213 0.503574
C -2.489408 -0.770178 -0.781590
C -4.128473 0.730745 0.934133
C -3.712958 -1.298392 -0.357609
C -4.515458 -0.538973 0.497716
H 2.194593 0.287901 -1.708170
H 3.902695 -1.233317 1.977223
H 1.101901 -2.253551 -0.773108
H 1.791835 -2.897225 0.747104
H 4.145242 -2.951296 -0.351945
H 3.446628 -2.314467 -1.868631
H 1.799375 2.071182 0.376640
H 1.571868 -0.231469 2.248526
H 2.671716 1.151203 2.435901
H 4.437343 1.570975 -1.259577
H 5.496921 0.623302 1.064133
H -2.589657 2.246920 0.833084
H -1.852764 -1.352657 -1.459160
H -4.766567 1.315289 1.599605
H -4.028722 -2.287747 -0.694034


%chk=000296886-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296886

0 1
Br -6.570471 -0.751906 1.258509
S -0.609544 0.847456 -1.044265
O 0.389029 0.189399 0.395218
O -0.312249 -0.042152 -2.368912
O -0.450615 2.462575 -1.083431
C 3.122280 -1.092992 -0.090806
C 2.731256 0.294240 -0.646816
C 3.659260 -0.552526 1.255149
C 2.322217 -2.373602 -0.280881
C 3.731979 -2.222893 -0.902864
C 1.749565 0.784354 0.488526
C 2.362105 0.167600 1.793177
C 4.030325 1.072570 -0.388686
C 4.589205 0.564197 0.748262
C -2.295768 0.385388 -0.369126
C -2.958812 1.313252 0.449219
C -2.831946 -0.858719 -0.735399
C -4.240939 0.970769 0.933767
C -4.113760 -1.197522 -0.246498
C -4.796022 -0.280442 0.583327
H 2.309980 0.344510 -1.661715
H 4.093922 -1.279889 1.957495
H 1.459714 -2.340889 -0.952995
H 2.206240 -3.051221 0.571813
H 4.552107 -2.797180 -0.460322
H 3.802380 -2.105163 -1.988616
H 1.653816 1.884292 0.512506
H 1.652145 -0.567150 2.213391
H 2.575209 0.935032 2.554721
H 4.370846 1.927659 -0.977683
H 5.482790 0.919172 1.268806
H -2.501957 2.278746 0.687238
H -2.278068 -1.534471 -1.394328
H -4.793044 1.666177 1.571257
H -4.567774 -2.156475 -0.509233


