%chk=000291478.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291478

0 1
Br -2.206728 3.172157 0.637921
S 1.474041 -1.959417 0.262573
O 2.329755 -2.781910 1.095783
O 0.942155 -2.515854 -0.966459
N 0.165009 -1.545957 1.309398
C -0.961985 -0.827616 0.766340
C -1.034292 0.569874 0.980464
C -1.992727 -1.500677 0.063979
C -3.141850 0.626024 -0.284495
C -2.117912 1.271974 0.425632
C -3.066454 -0.763771 -0.447988
C 2.228355 -0.444038 -0.071141
C 0.001248 1.295517 1.770474
C -1.940307 -2.973365 -0.154518
C -4.291866 1.382244 -0.857693
C 3.284104 -0.003510 0.733970
C 1.785233 0.337467 -1.142942
C 3.891739 1.227887 0.473393
C 2.391046 1.570690 -1.402537
C 3.442353 2.014742 -0.593362
H -0.106878 -2.222238 2.035001
H -3.857381 -1.280312 -0.990664
H 0.573781 1.990473 1.136474
H -0.451993 1.888315 2.580682
H 0.727121 0.621655 2.249213
H -1.809461 -3.534266 0.779172
H -2.840441 -3.367475 -0.642740
H -1.084089 -3.235678 -0.815913
H -4.849750 1.919779 -0.073821
H -3.953737 2.139991 -1.582669
H -5.010509 0.736597 -1.378710
H 3.640690 -0.625486 1.563183
H 0.969288 -0.015027 -1.783825
H 4.715098 1.572096 1.097587
H 2.044602 2.182441 -2.234670
H 3.915441 2.976674 -0.796093


%chk=000291478-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291478

0 1
Br -2.745929 3.215284 0.341705
S 1.408785 -1.738950 -0.170558
O 2.199817 -3.015112 0.471932
O 0.696221 -1.819999 -1.641157
N 0.046327 -1.269216 1.279794
C -1.161801 -0.719990 0.767641
C -1.306655 0.711536 0.805979
C -2.212848 -1.553147 0.255961
C -3.590568 0.464112 -0.174671
C -2.520198 1.252040 0.322488
C -3.402582 -0.942381 -0.183371
C 2.569959 -0.253593 -0.203974
C -0.208221 1.579414 1.377648
C -2.042834 -3.057468 0.174269
C -4.883931 1.060421 -0.683907
C 3.549594 -0.158355 0.797697
C 2.418933 0.670069 -1.250259
C 4.426276 0.950288 0.748131
C 3.306521 1.770876 -1.281050
C 4.300371 1.911239 -0.283685
H -0.075434 -2.248675 1.612464
H -4.213543 -1.570481 -0.569302
H 0.246306 2.217451 0.596747
H -0.610811 2.261463 2.148153
H 0.575632 0.950463 1.823311
H -1.855627 -3.516943 1.165052
H -2.948255 -3.531918 -0.238230
H -1.193770 -3.321217 -0.483660
H -5.384936 1.660692 0.098097
H -4.702736 1.744055 -1.534073
H -5.578394 0.270980 -1.015227
H 3.635030 -0.928302 1.570862
H 1.651245 0.518412 -2.016134
H 5.204682 1.059056 1.510437
H 3.222458 2.511048 -2.083513
H 4.983613 2.766851 -0.314600


