%chk=000260146.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260146

0 1
Br -0.462812 2.706654 -0.453629
Br 4.387139 -2.169948 1.880287
S -0.022624 -1.460848 1.177457
O 0.103975 -1.955382 -0.184890
O -1.011206 -2.026749 2.065838
C -0.263116 0.296647 1.115687
C 1.554514 -1.675549 1.973374
C -0.728146 0.728883 -0.264038
C 2.693922 -1.614556 0.975510
C -2.166278 0.390291 -0.536108
C 2.890823 -0.250413 0.377514
C -2.450442 -0.664123 -1.418927
C 2.630129 -0.066636 -0.989433
C -3.218078 1.087497 0.076770
C 3.313938 0.837027 1.157893
C -3.776512 -1.008515 -1.692459
C 2.776708 1.198271 -1.565324
C -4.542054 0.738706 -0.201144
C 3.457490 2.098796 0.577088
C -4.823506 -0.306557 -1.087270
C 3.186717 2.282366 -0.783570
H 0.662151 0.848735 1.397709
H -1.002202 0.619935 1.884955
H 1.561277 -2.658428 2.506511
H 1.710104 -0.962188 2.807962
H -0.055244 0.309669 -1.059473
H 2.554265 -2.391606 0.176708
H -1.634004 -1.234661 -1.871849
H 2.301641 -0.909661 -1.602343
H -3.010236 1.907156 0.764495
H 3.550285 0.696410 2.212761
H -3.991889 -1.829732 -2.374897
H 2.567943 1.339030 -2.625802
H -5.356638 1.282894 0.274209
H 3.785628 2.941825 1.184139
H -5.856471 -0.575552 -1.302190
H 3.293806 3.269110 -1.232822


%chk=000260146-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260146

0 1
Br -0.907833 2.904306 -0.903700
Br 4.356044 -2.316147 2.303845
S -0.099549 -1.280862 1.152691
O 0.128583 -2.044806 -0.281935
O -1.284040 -1.738457 2.180431
C -0.320443 0.665822 0.781277
C 1.606807 -1.474680 2.174433
C -1.038645 0.819156 -0.541947
C 2.758333 -1.560063 1.192761
C -2.463476 0.366673 -0.641683
C 3.147258 -0.273060 0.513553
C -2.919791 -0.162082 -1.878410
C 3.161947 -0.222108 -0.904404
C -3.365751 0.439309 0.452208
C 3.456448 0.899999 1.253336
C -4.248708 -0.608188 -2.021937
C 3.465139 0.985744 -1.572218
C -4.695168 -0.006730 0.308806
C 3.762832 2.103672 0.585407
C -5.141582 -0.529550 -0.927331
C 3.762816 2.151109 -0.830062
H 0.710956 1.045558 0.752021
H -0.871782 1.013222 1.666552
H 1.403033 -2.411854 2.714709
H 1.622987 -0.610426 2.855290
H -0.425715 0.430240 -1.368574
H 2.577941 -2.365787 0.464360
H -2.224347 -0.230928 -2.723299
H 2.919507 -1.123280 -1.478554
H -3.039935 0.839332 1.418045
H 3.492919 0.860850 2.348745
H -4.586231 -1.021260 -2.978367
H 3.465366 1.017223 -2.666904
H -5.380751 0.044944 1.161150
H 4.005672 3.002127 1.162797
H -6.174617 -0.878238 -1.034734
H 3.994773 3.088017 -1.347659


