%chk=000237584.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237584

0 1
Br 3.294665 -1.750426 -1.963014
Br -3.277736 -1.759493 1.951508
O 3.269993 1.580221 -0.473767
O -3.266932 1.578395 0.478274
N 1.430879 0.242854 -0.408111
N -1.427848 0.242604 0.390877
C 0.751085 -0.952372 0.161083
C 0.561368 1.451678 -0.531978
C -0.750901 -0.949504 -0.187856
C -0.558095 1.451157 0.516273
C 2.816567 0.454687 -0.353817
C -2.813919 0.453673 0.349238
C 3.690401 -0.793513 -0.278691
C -3.687694 -0.794625 0.275084
C 5.176880 -0.466033 -0.187664
C -5.175028 -0.467521 0.197788
C 5.534109 0.123574 1.186504
C -5.543735 0.128659 -1.170500
C 7.036749 0.355123 1.313579
C -7.047480 0.359982 -1.284204
H 1.199320 -1.884801 -0.251439
H 0.879713 -0.977564 1.268743
H 1.181545 2.378101 -0.431819
H 0.144491 1.462414 -1.565051
H -1.200880 -1.884510 0.216694
H -0.879789 -0.965350 -1.295687
H -1.178097 2.377809 0.417487
H -0.141037 1.460391 1.549317
H 3.389119 -1.470349 0.551153
H -3.392826 -1.467225 -0.560479
H 5.455366 0.260856 -0.983363
H 5.781471 -1.375346 -0.379337
H -5.447390 0.255298 0.999297
H -5.777576 -1.378095 0.389897
H 4.995714 1.086751 1.321720
H 5.188467 -0.545390 1.997058
H -5.204342 -0.536095 -1.987133
H -5.006959 1.092799 -1.305315
H 7.604954 -0.576538 1.214929
H 7.286949 0.791312 2.287941
H 7.403760 1.047646 0.545684
H -7.614376 -0.572474 -1.185542
H -7.305829 0.800841 -2.254328
H -7.408593 1.048498 -0.509933


%chk=000237584-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237584

0 1
Br 3.400676 -2.156814 -1.938880
Br -3.402278 -2.168052 1.929097
O 3.294072 1.434757 -1.037111
O -3.296402 1.428295 1.045504
N 1.431261 0.273780 -0.283688
N -1.432940 0.271692 0.286987
C 0.739091 -0.938631 0.215074
C 0.592576 1.485645 -0.479680
C -0.740211 -0.937864 -0.217881
C -0.594799 1.482941 0.489103
C 2.782231 0.360909 -0.587788
C -2.784027 0.356818 0.591153
C 3.656579 -0.878121 -0.324951
C -3.657943 -0.881124 0.321721
C 5.141477 -0.545948 -0.176350
C -5.142881 -0.548500 0.174442
C 5.427414 0.225570 1.140581
C -5.428829 0.229327 -1.138751
C 6.937382 0.499804 1.312600
C -6.938682 0.505346 -1.308911
H 1.211366 -1.840723 -0.208945
H 0.794835 -0.997305 1.321314
H 1.229364 2.370608 -0.313501
H 0.238554 1.534904 -1.528827
H -1.212099 -1.842303 0.201529
H -0.795874 -0.990939 -1.324410
H -1.232003 2.368435 0.327398
H -0.240844 1.527068 1.538501
H 3.290049 -1.487621 0.518010
H -3.290984 -1.486144 -0.524276
H 5.459096 0.068623 -1.036563
H 5.724032 -1.485855 -0.186723
H -5.460719 0.061859 1.037571
H -5.725274 -1.488554 0.180255
H 4.875447 1.183413 1.126557
H 5.056533 -0.358707 2.008061
H -5.058631 -0.351112 -2.009088
H -4.876312 1.186799 -1.120517
H 7.514007 -0.443599 1.345875
H 7.137396 1.053282 2.247917
H 7.324826 1.104199 0.471936
H -7.515964 -0.437484 -1.346632
H -7.138629 1.063539 -2.241437
H -7.325436 1.105884 -0.465171


