%chk=000221821.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221821

0 1
Br -7.092158 -0.408292 0.385593
O -1.056020 -0.111502 0.125027
O -0.682662 1.143056 -1.747402
O 6.103647 0.400606 -0.107912
O 5.555443 -1.035418 1.416653
N 5.289487 -0.245526 0.527768
C 1.175686 0.301405 -0.433406
C 2.153749 1.021255 -1.138958
C 1.534906 -0.596156 0.582040
C 3.850981 -0.054228 0.191003
C 3.502279 0.844797 -0.826386
C 2.882682 -0.777977 0.899355
C -2.456386 -0.104647 0.076571
C -0.248904 0.524884 -0.811699
C -3.224383 0.292332 -1.019133
C -3.023022 -0.588021 1.268688
C -4.616855 0.199009 -0.917648
C -4.411205 -0.677160 1.353119
C -5.193510 -0.283085 0.259562
H 1.854557 1.715642 -1.932251
H 0.758914 -1.149274 1.122382
H 4.283125 1.396381 -1.363915
H 3.186904 -1.474594 1.689774
H -2.760758 0.674501 -1.933051
H -2.382942 -0.882847 2.098335
H -5.239722 0.504825 -1.761825
H -4.878233 -1.050466 2.267314


%chk=000221821-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221821

0 1
Br -7.244174 -0.417823 0.340061
O -1.076787 -0.114487 0.149586
O -0.610992 1.154433 -1.780000
O 6.222517 0.324652 -0.286603
O 5.666206 -0.906204 1.552084
N 5.360047 -0.217788 0.504665
C 1.205329 0.296601 -0.404248
C 2.192368 0.876537 -1.244727
C 1.592189 -0.453020 0.737666
C 3.916476 -0.037838 0.188254
C 3.557916 0.712675 -0.953065
C 2.955578 -0.624624 1.040356
C -2.503169 -0.114003 0.087649
C -0.226457 0.509664 -0.778433
C -3.285859 0.470640 -0.935910
C -3.103414 -0.783010 1.177862
C -4.693974 0.373951 -0.850535
C -4.507107 -0.875801 1.257689
C -5.290371 -0.293641 0.237447
H 1.867661 1.449223 -2.118743
H 0.823018 -0.894012 1.375368
H 4.339970 1.146570 -1.580952
H 3.286385 -1.196212 1.911030
H -2.818391 0.987613 -1.773739
H -2.469198 -1.224022 1.952054
H -5.312204 0.821100 -1.633883
H -4.977962 -1.391675 2.098665


