%chk=000187299.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187299

0 1
Br -5.511783 -2.266115 0.630941
Br -4.714697 -0.544485 -2.052050
O 1.742880 -0.928755 -0.095724
O 0.692220 0.120065 -1.909670
O 5.152180 -0.184647 -1.555118
O 5.325195 1.299478 0.904172
C -1.284548 1.179723 0.390601
C -0.468105 -0.142598 0.241380
C -1.912454 -0.039107 -0.323737
C -0.938398 2.393326 -0.468428
C -1.724854 1.529968 1.811762
C 0.657982 -0.267762 -0.718389
C -2.988976 -0.857615 0.291378
C -4.181032 -1.160488 -0.280913
C 2.955959 -1.125411 -0.930938
C 3.958563 0.019171 -0.699429
C 4.403486 0.173409 0.765392
H -0.322981 -0.718495 1.159826
H -1.956664 0.048622 -1.415311
H -0.150947 3.000772 0.016914
H -0.580822 2.105350 -1.470565
H -1.833671 3.031574 -0.586172
H -1.920902 0.638273 2.432642
H -0.942988 2.126689 2.316490
H -2.651076 2.133763 1.785126
H -2.812451 -1.268219 1.294467
H 3.369806 -2.096042 -0.599122
H 2.674771 -1.167662 -1.997297
H 3.540390 0.972659 -1.062181
H 4.870063 -0.777643 1.115763
H 3.539270 0.397745 1.410609
H 5.539293 -1.080572 -1.367866
H 5.969192 1.242231 0.148549


%chk=000187299-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187299

0 1
Br -5.429604 -2.367516 0.509162
Br -4.233300 -1.278388 -2.345077
O 1.692330 -0.946945 -0.093911
O 0.683196 0.211632 -1.860774
O 5.086331 -0.229795 -1.610762
O 5.322608 1.259253 0.831225
C -1.279420 1.239130 0.452183
C -0.484350 -0.092072 0.278217
C -1.932246 0.061808 -0.299042
C -0.899855 2.467656 -0.371901
C -1.720678 1.566085 1.879115
C 0.634563 -0.224159 -0.685249
C -3.030605 -0.744249 0.278045
C -4.035227 -1.346476 -0.407712
C 2.896586 -1.156095 -0.942868
C 3.907986 -0.015673 -0.733416
C 4.383232 0.145206 0.719935
H -0.365689 -0.695744 1.182076
H -1.946400 0.174630 -1.388739
H -0.087013 3.031804 0.122951
H -0.562117 2.198347 -1.385861
H -1.773729 3.139307 -0.460330
H -1.885638 0.666869 2.498424
H -0.949196 2.176766 2.382408
H -2.660851 2.148428 1.866844
H -3.046795 -0.869214 1.368759
H 3.303850 -2.126468 -0.604463
H 2.602140 -1.204072 -2.005094
H 3.489053 0.936565 -1.097950
H 4.845888 -0.808968 1.067415
H 3.537840 0.384527 1.384826
H 5.490963 -1.112659 -1.399687
H 5.940048 1.197682 0.054355


