%chk=000263880.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000263880

0 1
Br 2.928433 0.833416 2.307927
S -0.638892 -1.305236 -0.488472
O -0.089063 -1.956007 0.688362
O -0.933928 -2.081131 -1.675298
N 0.497273 -0.133240 -1.021109
C 1.275093 0.674592 -0.047895
C 2.309702 -0.196380 0.710212
C 1.956972 1.846980 -0.784799
C 3.503378 -0.600553 -0.141924
C 3.136390 1.399023 -1.655754
C 4.158984 0.593863 -0.845030
C -2.005616 -0.363909 -0.014497
C -2.895966 0.112119 -0.981834
C -2.224081 -0.089755 1.340122
C -4.002814 0.874387 -0.595266
C -3.329604 0.672210 1.727362
C -4.217095 1.154881 0.758516
H 0.540677 1.098951 0.692327
H 1.817436 -1.101053 1.156882
H 2.308181 2.582979 -0.032507
H 1.209301 2.379491 -1.404615
H 3.166015 -1.344839 -0.894854
H 4.256009 -1.133401 0.475541
H 3.626231 2.287153 -2.100118
H 2.773443 0.798564 -2.511808
H 4.972740 0.239475 -1.505247
H 4.643128 1.250790 -0.093581
H 1.011519 -0.323412 -1.890426
H -2.735176 -0.116333 -2.040680
H -1.535535 -0.480378 2.099371
H -4.697697 1.245566 -1.347299
H -3.501312 0.886397 2.781536
H -5.080523 1.749492 1.060654


%chk=000263880-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000263880

0 1
Br 3.083946 0.771658 2.363075
S -0.639260 -1.384054 -0.408320
O -0.136570 -2.102439 0.973289
O -0.960218 -2.256834 -1.743491
N 0.559733 -0.101492 -1.026565
C 1.350748 0.658114 -0.012712
C 2.419715 -0.234023 0.682979
C 1.987338 1.870897 -0.743645
C 3.613766 -0.584103 -0.219127
C 3.139737 1.452700 -1.689445
C 4.222476 0.643368 -0.934946
C -2.119653 -0.310914 0.043150
C -2.926482 0.171365 -1.000397
C -2.372863 -0.087101 1.405715
C -4.054423 0.945839 -0.645458
C -3.505742 0.692488 1.738165
C -4.338197 1.207372 0.717070
H 0.633331 1.023521 0.744893
H 1.949163 -1.124103 1.130150
H 2.379437 2.558895 0.028841
H 1.193071 2.401190 -1.298065
H 3.248687 -1.312947 -0.977267
H 4.377316 -1.118773 0.372643
H 3.587418 2.358325 -2.139602
H 2.743423 0.853295 -2.535507
H 5.010432 0.308786 -1.635429
H 4.710423 1.293704 -0.183756
H 1.120444 -0.588290 -1.749941
H -2.690542 -0.061438 -2.043412
H -1.721658 -0.525406 2.169330
H -4.709422 1.339113 -1.429630
H -3.736544 0.889131 2.790095
H -5.215428 1.806861 0.983118


