%chk=000230969.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230969

0 1
Br -1.922521 -3.573421 0.250554
Br 2.382990 -2.694952 -1.848462
O -1.214561 -0.548805 0.019092
O 2.579676 2.389774 1.372880
O 4.573413 1.638011 0.323843
O -4.090122 1.208909 -1.197166
O -2.002169 -0.551300 -2.110602
C -0.118608 -1.440430 -0.363191
C 1.169549 -0.662136 -0.207519
C -0.202753 -2.632161 0.607166
C 1.150331 0.527678 0.569992
C 2.334518 1.215107 0.679471
C 2.350885 -1.090970 -0.812743
C 3.536459 0.762621 0.049282
C -0.139735 -2.236005 2.064893
C 3.574807 -0.388609 -0.702433
C 3.997968 2.699146 1.159507
C -2.144748 -0.218790 -0.962439
C -3.207153 0.552352 -0.315443
C -3.575432 0.783407 0.991640
C -4.740129 1.621470 0.948452
C -5.010677 1.851260 -0.380429
H -0.276982 -1.755347 -1.432222
H 0.584853 -3.382943 0.358033
H 0.224813 0.866599 1.039907
H 0.831673 -1.782089 2.310743
H -0.915569 -1.496517 2.317096
H -0.278264 -3.095835 2.734465
H 4.487776 -0.735780 -1.185663
H 4.057413 3.640422 0.596629
H 4.500172 2.667995 2.135453
H -3.091865 0.407750 1.877007
H -5.279893 1.984513 1.802894
H -5.748614 2.397474 -0.930188


%chk=000230969-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230969

0 1
Br -1.722681 -3.963774 0.363754
Br 2.230497 -2.638023 -2.096321
O -1.336114 -0.708907 0.188074
O 2.649124 2.307228 1.501953
O 4.556837 1.680953 0.183956
O -3.833687 1.545674 -1.228566
O -1.554593 -0.007746 -2.047142
C -0.176427 -1.541832 -0.206192
C 1.112868 -0.718601 -0.152214
C -0.124076 -2.739488 0.766053
C 1.175170 0.428842 0.695570
C 2.359189 1.159416 0.725615
C 2.257430 -1.069386 -0.910203
C 3.482832 0.792721 -0.045667
C -0.123589 -2.395613 2.256892
C 3.467051 -0.325614 -0.878882
C 3.989681 2.760827 1.042042
C -1.963771 -0.001072 -0.866583
C -3.132225 0.704939 -0.337521
C -3.756656 0.721782 0.907924
C -4.889726 1.604111 0.800824
C -4.900888 2.081112 -0.504431
H -0.337816 -1.904339 -1.237033
H 0.733304 -3.373525 0.486876
H 0.301174 0.721038 1.281552
H 0.766274 -1.783254 2.497025
H -1.026096 -1.825490 2.529590
H -0.085947 -3.314306 2.864286
H 4.334065 -0.610266 -1.477397
H 3.872774 3.676147 0.433558
H 4.641741 2.900072 1.917689
H -3.436703 0.153710 1.778010
H -5.605023 1.851077 1.582195
H -5.546492 2.759985 -1.054785


