%chk=000221279.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221279

0 1
Br 3.658702 0.586486 -1.673174
O 0.672778 -0.682001 -0.317897
O 1.881899 0.303946 1.324838
C -0.605581 -0.230941 0.284457
C -0.853582 1.203104 -0.186009
C -1.609296 -1.239400 -0.277934
C -2.290491 1.625347 0.141830
C -3.039511 -0.796510 0.054570
C -3.310981 0.633400 -0.434161
C 1.839879 -0.313721 0.289085
C 2.989445 -0.835891 -0.529062
H -0.499719 -0.297705 1.387696
H -0.666864 1.276468 -1.275803
H -0.126965 1.889325 0.292428
H -1.406416 -2.248443 0.126004
H -1.474285 -1.323453 -1.375596
H -2.480760 2.639113 -0.258945
H -2.418043 1.703703 1.239283
H -3.209013 -0.859202 1.147194
H -3.761546 -1.496851 -0.406560
H -4.335261 0.939867 -0.151046
H -3.276921 0.662966 -1.540576
H 2.685041 -1.683792 -1.176553
H 3.816091 -1.172115 0.128730


%chk=000221279-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221279

0 1
Br 3.711951 0.529087 -1.748507
O 0.720596 -0.707137 -0.401424
O 1.860661 0.237446 1.412639
C -0.604789 -0.248445 0.153451
C -0.875136 1.200246 -0.290906
C -1.653988 -1.232021 -0.378437
C -2.291192 1.635087 0.165502
C -3.070043 -0.795753 0.075652
C -3.375169 0.660177 -0.354173
C 1.858249 -0.368738 0.315910
C 3.099781 -0.860780 -0.404034
H -0.533681 -0.295016 1.258012
H -0.803537 1.252576 -1.395117
H -0.106741 1.873804 0.129841
H -1.425621 -2.254263 -0.024246
H -1.602429 -1.245258 -1.484699
H -2.492089 2.663327 -0.189478
H -2.326769 1.667900 1.273900
H -3.145789 -0.875143 1.179801
H -3.822685 -1.488688 -0.345331
H -4.372007 0.966086 0.016856
H -3.412742 0.713272 -1.461748
H 2.906809 -1.769489 -0.989350
H 3.934961 -0.974574 0.298685


