%chk=000262322.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262322

0 1
Br -8.729886 0.250812 -0.228004
S 2.569469 -1.173676 0.592516
O 1.588051 0.129063 0.037040
O 2.248042 -2.297468 -0.247282
O 2.357701 -1.234378 2.010463
C 4.085844 -0.497424 0.200007
C -2.558699 0.117080 -0.058854
C 0.217351 0.052343 0.028719
C -4.035213 0.149010 -0.099913
C -1.836025 1.293751 0.208378
C -1.872853 -1.087097 -0.286691
C 4.771203 0.284991 1.140174
C 4.648625 -0.719103 -1.064855
C 6.574812 0.622035 -0.448045
C -0.444890 1.271240 0.259090
C -0.478799 -1.130734 -0.251375
C 6.008369 0.840459 0.821310
C 5.885588 -0.165758 -1.388317
C -4.698563 1.017700 -0.982540
C -4.782611 -0.689408 0.744087
C 7.903326 1.205666 -0.787774
C -6.094754 1.050089 -1.024417
C -6.179049 -0.661480 0.709658
C -6.817809 0.209117 -0.175904
H -2.369337 2.227845 0.387783
H -2.432855 -1.998044 -0.503428
H 4.336673 0.456569 2.132627
H 4.118343 -1.334829 -1.801487
H 0.134441 2.167032 0.469524
H 0.048823 -2.067784 -0.453920
H 6.536878 1.445282 1.556893
H 6.318481 -0.343544 -2.371804
H -4.121490 1.664073 -1.643575
H -4.270572 -1.359818 1.434751
H 8.009634 1.420232 -1.860971
H 8.101914 2.146257 -0.254044
H 8.714722 0.509252 -0.519740
H -6.605632 1.723890 -1.713186
H -6.755253 -1.312243 1.368604


%chk=000262322-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262322

0 1
Br -8.957872 -0.312738 -0.236816
S 2.569161 -0.461028 1.213727
O 1.517817 0.619179 -0.179902
O 2.171256 -2.029263 1.025147
O 2.461803 0.247884 2.674664
C 4.265869 -0.147432 0.491002
C -2.693170 0.210493 -0.152222
C 0.149948 0.457001 -0.131502
C -4.174524 0.087080 -0.170587
C -2.056400 1.297338 0.519223
C -1.868992 -0.755707 -0.802333
C 4.994589 0.955567 0.964312
C 4.739049 -1.027127 -0.495868
C 6.807652 0.315975 -0.583600
C -0.658367 1.416919 0.545175
C -0.470079 -0.644451 -0.791639
C 6.276071 1.175627 0.414654
C 6.023820 -0.783074 -1.026757
C -5.008944 1.239857 -0.141279
C -4.805489 -1.187948 -0.218633
C 8.198133 0.549006 -1.143652
C -6.414964 1.132697 -0.161085
C -6.209663 -1.314431 -0.236835
C -7.002827 -0.148480 -0.208809
H -2.665481 2.030260 1.059438
H -2.334015 -1.583687 -1.347918
H 4.580815 1.606447 1.740706
H 4.132809 -1.877066 -0.824005
H -0.165188 2.237193 1.076185
H 0.163570 -1.381486 -1.294312
H 6.868834 2.027841 0.765687
H 6.420563 -1.454167 -1.796918
H -4.559144 2.238374 -0.137091
H -4.197533 -2.098692 -0.206011
H 8.284875 0.183473 -2.181349
H 8.467110 1.619267 -1.132170
H 8.957308 0.012889 -0.541754
H -7.038875 2.030896 -0.149647
H -6.675524 -2.303490 -0.261729


