%chk=000283148.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283148

0 1
Br -2.209367 4.921171 -0.022599
S 1.084013 -1.454629 -0.306035
O 0.440732 -1.178403 -1.568915
O 1.196807 -2.815721 0.183376
O -2.619968 -1.964167 2.777719
N 0.231656 -0.613424 0.959146
C -0.371212 0.664266 0.675028
C -0.460739 -1.402682 1.995371
C -1.649301 0.780301 0.080877
C -2.401290 -0.411110 -0.368588
C -2.549700 -1.546896 0.446313
C -1.960185 -1.643628 1.813814
C 2.620165 -0.680023 -0.273709
C 0.357730 1.811973 1.032079
C -2.192563 2.060726 -0.113615
C -2.980796 -0.406037 -1.649966
C -3.298630 -2.644220 -0.007342
C -0.183071 3.080227 0.817012
C -1.457187 3.187427 0.253973
C 3.603356 -1.106860 0.626520
C 2.893668 0.370213 -1.158672
C -3.704178 -1.510451 -2.103190
C -3.870722 -2.629488 -1.280001
C 5.124729 0.579849 -0.227609
C 4.849254 -0.481183 0.653330
C 4.136812 1.000352 -1.136454
C 6.460851 1.241452 -0.211904
H -0.305597 -0.898454 2.982886
H 0.034595 -2.408335 2.090753
H 1.343961 1.705444 1.487710
H -3.190638 2.164606 -0.547688
H -2.840700 0.454504 -2.304393
H -3.430598 -3.511014 0.644131
H 0.383177 3.970499 1.095703
H 3.399492 -1.940862 1.307628
H 2.131629 0.693732 -1.878303
H -4.137149 -1.501324 -3.103607
H -4.440920 -3.487899 -1.631790
H 5.610745 -0.819507 1.353956
H 4.344162 1.814839 -1.828533
H 6.414901 2.295548 -0.520093
H 6.932786 1.218816 0.780557
H 7.152190 0.735869 -0.905773


%chk=000283148-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000283148

0 1
Br -2.368511 4.948024 -0.353581
S 1.107906 -1.378378 -0.349490
O 0.454516 -0.967491 -1.787450
O 1.250204 -2.935764 0.129713
O -2.564871 -2.435729 2.738997
N 0.195541 -0.479928 1.179290
C -0.462020 0.721492 0.778028
C -0.488445 -1.469869 2.023909
C -1.723906 0.763125 0.097203
C -2.474827 -0.453472 -0.333032
C -2.617512 -1.628685 0.469007
C -1.964915 -1.833077 1.802863
C 2.807613 -0.576152 -0.270664
C 0.232770 1.927315 1.058951
C -2.265809 2.039462 -0.218621
C -3.152186 -0.413652 -1.583177
C -3.460169 -2.686399 0.031733
C -0.305320 3.185718 0.729707
C -1.565204 3.217339 0.096233
C 3.745181 -1.083236 0.642996
C 3.078195 0.479905 -1.154521
C -3.950828 -1.484675 -2.026354
C -4.118500 -2.627497 -1.209515
C 5.350050 0.594464 -0.196146
C 5.022753 -0.483409 0.670760
C 4.363756 1.063667 -1.103591
C 6.738681 1.206028 -0.177137
H -0.366785 -1.160550 3.080653
H 0.069018 -2.428480 1.914199
H 1.201195 1.848428 1.562331
H -3.247856 2.104011 -0.694858
H -3.014464 0.456007 -2.233710
H -3.576733 -3.553461 0.689650
H 0.231665 4.107464 0.968070
H 3.492365 -1.926354 1.293550
H 2.316087 0.816449 -1.864561
H -4.436637 -1.430358 -3.006424
H -4.745575 -3.461213 -1.541747
H 5.776009 -0.860048 1.372191
H 4.602743 1.891001 -1.781429
H 6.722894 2.261807 -0.498106
H 7.190194 1.158543 0.828997
H 7.414635 0.663128 -0.865811


