%chk=000210696.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210696

0 1
Br -4.080590 3.182153 0.704424
S 1.299996 -3.606325 0.205379
S -1.357225 -3.041570 1.204291
N 2.425589 -1.188156 -0.215136
N 0.010226 -1.283873 -0.256153
C 3.594193 -0.308077 -0.543488
C 1.221634 -0.890231 -1.044310
C 3.344298 1.098594 0.024293
C 2.771063 -2.624676 -0.275229
C 4.560163 2.006536 -0.200748
C -0.977705 -0.245263 -0.002771
C -0.058228 -2.488007 0.372622
C 4.318223 3.409376 0.350199
C -2.278865 -0.402055 -0.494224
C -0.595051 0.906036 0.705190
C -3.229838 0.610557 -0.283659
C -1.535329 1.916178 0.908713
C -2.832473 1.766318 0.411053
C -4.620883 0.448985 -0.790380
H 3.804615 -0.260555 -1.633115
H 4.501353 -0.740434 -0.063062
H 1.187885 -1.444775 -2.016168
H 1.172667 0.202997 -1.274461
H 3.117112 1.024110 1.108189
H 2.443967 1.550159 -0.435718
H 3.120252 -2.990008 -1.263612
H 3.565095 -2.836419 0.477686
H 4.796880 2.066446 -1.281294
H 5.455555 1.567431 0.282816
H 5.192525 4.052228 0.193971
H 3.464519 3.896154 -0.135183
H 4.115651 3.392177 1.427803
H -2.563197 -1.317831 -1.016955
H 0.412416 0.996010 1.112192
H -1.253276 2.814172 1.462743
H -4.891684 1.249698 -1.496559
H -4.780470 -0.507936 -1.305377
H -5.352262 0.491579 0.034438


%chk=000210696-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210696

0 1
Br -4.455025 3.176691 -0.634358
S 2.027909 -2.679441 0.912597
S -0.194045 -1.346054 2.414205
N 2.476475 -1.128134 -1.449731
N 0.321544 -0.784873 -0.224358
C 3.293091 0.088576 -1.198721
C 1.042590 -0.999842 -1.556276
C 3.385164 0.604713 0.261109
C 2.880656 -2.372939 -0.865385
C 4.283838 1.859811 0.354062
C -0.799908 0.136570 -0.267064
C 0.620192 -1.495470 0.924102
C 4.406926 2.393933 1.797353
C -2.123593 -0.342613 -0.143938
C -0.564448 1.509949 -0.500608
C -3.241725 0.522255 -0.240888
C -1.658207 2.395389 -0.610936
C -2.968450 1.895577 -0.480782
C -4.646280 -0.020447 -0.085985
H 2.882060 0.887081 -1.848170
H 4.315874 -0.121082 -1.569784
H 0.633278 -1.922843 -2.012257
H 0.771419 -0.139647 -2.187272
H 3.791887 -0.189812 0.915843
H 2.377621 0.840068 0.653216
H 2.561093 -3.234739 -1.470910
H 3.962051 -2.403874 -0.668956
H 3.876197 2.657431 -0.301809
H 5.293452 1.620283 -0.039683
H 5.049039 3.292565 1.841716
H 3.415718 2.663834 2.206547
H 4.845179 1.630035 2.466016
H -2.288631 -1.406073 0.054445
H 0.459217 1.892362 -0.571773
H -1.489601 3.461790 -0.784143
H -5.261347 0.188895 -0.980485
H -4.631039 -1.109934 0.080541
H -5.161369 0.451712 0.770918


