%chk=000262384.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262384

0 1
Br 0.067293 -2.889648 -0.166289
Br 0.086754 2.862512 -0.186189
S 2.182142 -0.015516 1.337716
O 1.224996 -0.016960 -0.128371
O 1.898064 -1.265432 1.978660
O 1.885768 1.229221 1.983208
C 3.705787 -0.006828 0.573372
C -2.938047 -0.003324 -0.151222
C -0.132212 -0.012596 -0.083907
C -4.418975 0.001631 -0.165305
C -2.242969 -1.221956 -0.144523
C -2.234792 1.210626 -0.152626
C 4.320205 1.210351 0.246473
C 4.337302 -1.216870 0.252578
C 6.200092 0.007515 -0.706385
C -0.848363 -1.227073 -0.119858
C -0.840197 1.206369 -0.128063
C 5.561802 1.219680 -0.385470
C 5.578921 -1.211901 -0.379325
C -5.108312 0.000872 -1.386871
C -5.129496 0.007083 1.044105
C 7.533084 0.015183 -1.373428
C -6.505796 0.005573 -1.394835
C -6.526855 0.011770 1.027685
C -7.215801 0.011022 -0.189686
H -2.800852 -2.162355 -0.160298
H -2.786267 2.154669 -0.174564
H 3.825003 2.158073 0.491735
H 3.855442 -2.170222 0.502608
H 6.036163 2.167782 -0.634351
H 6.066608 -2.154472 -0.623423
H -4.554179 -0.003387 -2.324292
H -4.591424 0.007660 1.991288
H 7.692910 -0.867556 -2.009226
H 7.681360 0.897808 -2.012166
H 8.342687 0.021725 -0.625719
H -7.042126 0.004982 -2.342533
H -7.079507 0.016013 1.966084
H -8.304215 0.014677 -0.199086


%chk=000262384-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262384

0 1
Br -0.783176 -3.528915 1.551859
Br 0.721951 0.895550 -1.923320
S 2.309750 -1.233710 1.364609
O 1.032849 -1.775744 -0.300499
O 2.807840 -2.578896 2.133610
O 1.488860 -0.055224 2.140296
C 3.811142 -0.487000 0.514530
C -2.948152 -0.318551 -0.177237
C -0.212210 -1.280204 -0.208186
C -4.350837 0.171063 -0.167801
C -2.576855 -1.484334 0.552810
C -1.941155 0.370062 -0.914871
C 3.819849 0.893424 0.260077
C 4.870604 -1.347456 0.182542
C 6.072915 0.614960 -0.709474
C -1.254631 -1.941504 0.540568
C -0.620477 -0.089495 -0.911650
C 4.969693 1.436236 -0.352352
C 6.004957 -0.777073 -0.434517
C -4.889343 0.867964 -1.287091
C -5.193054 -0.044731 0.960280
C 7.311412 1.217453 -1.345417
C -6.221245 1.329725 -1.279463
C -6.523794 0.420289 0.968679
C -7.045850 1.109006 -0.151360
H -3.334538 -2.048593 1.102484
H -2.190797 1.287851 -1.453613
H 2.967324 1.519978 0.539135
H 4.816177 -2.416102 0.411652
H 5.007428 2.512471 -0.556264
H 6.847093 -1.424105 -0.704801
H -4.275754 1.017247 -2.182526
H -4.794651 -0.545195 1.849693
H 7.821455 0.495158 -2.005857
H 7.067610 2.114835 -1.939746
H 8.039710 1.524528 -0.569841
H -6.619044 1.852969 -2.155739
H -7.150604 0.254078 1.851443
H -8.080452 1.468687 -0.145140


