%chk=000224113.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224113

0 1
Br -2.116768 3.080759 0.403547
O 1.665141 -2.856153 -0.040414
N -2.899032 0.206926 0.411248
C 1.254117 0.677823 0.077239
C 0.673791 -0.630639 0.092782
C 2.714537 0.544280 -0.043024
C 3.043186 -0.848114 -0.102542
C -1.530201 0.309446 0.292499
C 1.788122 -1.659354 -0.021294
C -0.675146 -0.840191 0.196231
C -3.597891 -1.104548 0.407573
C -5.116232 -0.908234 0.502947
C 0.442802 1.796104 0.168856
C -0.938388 1.596511 0.274393
C -5.730826 -0.402533 -0.809146
C 3.712753 1.502008 -0.100184
C 4.354377 -1.267651 -0.217568
C 5.048969 1.066299 -0.217613
C 5.367653 -0.288265 -0.275420
C -7.237285 -0.196188 -0.679906
H -3.336561 -1.670063 -0.517570
H -3.241404 -1.713520 1.272133
H -1.082788 -1.848465 0.206075
H -5.367692 -0.217938 1.333475
H -5.582068 -1.875544 0.783098
H 0.861207 2.803184 0.159196
H -3.493020 1.032666 0.460390
H -5.519829 -1.122190 -1.625466
H -5.248245 0.545924 -1.118118
H 3.482182 2.562717 -0.056377
H 4.600551 -2.329073 -0.262538
H 5.844213 1.811559 -0.263541
H 6.406210 -0.600920 -0.366042
H -7.482762 0.545227 0.089183
H -7.669258 0.158908 -1.623339
H -7.754416 -1.125962 -0.415765


%chk=000224113-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224113

0 1
Br -2.110271 3.212340 0.312139
O 1.669012 -2.886093 0.001740
N -2.931433 0.166107 0.352791
C 1.280528 0.698900 0.055561
C 0.697767 -0.601408 0.087813
C 2.753609 0.558403 -0.049610
C 3.071547 -0.836167 -0.081961
C -1.561707 0.323853 0.255788
C 1.797574 -1.629842 0.002192
C -0.679131 -0.807087 0.185250
C -3.608749 -1.136591 0.400316
C -5.138308 -0.962039 0.488406
C 0.442800 1.826636 0.123492
C -0.948459 1.620901 0.220756
C -5.781389 -0.328257 -0.769001
C 3.784434 1.512757 -0.114671
C 4.395479 -1.289392 -0.177841
C 5.126981 1.056635 -0.211631
C 5.435166 -0.325407 -0.243222
C -7.316901 -0.222621 -0.650690
H -3.357653 -1.728783 -0.505937
H -3.249882 -1.717049 1.276905
H -1.076226 -1.825738 0.207651
H -5.388997 -0.356722 1.384173
H -5.585369 -1.961559 0.653574
H 0.840884 2.845239 0.102521
H -3.505431 1.009179 0.403838
H -5.514611 -0.937744 -1.655642
H -5.358967 0.680038 -0.951971
H 3.570288 2.586866 -0.091586
H 4.609111 -2.363229 -0.200759
H 5.940515 1.789283 -0.262863
H 6.479203 -0.647131 -0.318361
H -7.607713 0.408516 0.210141
H -7.760557 0.221770 -1.559728
H -7.773142 -1.219771 -0.504578


