%chk=000206144.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206144

0 1
Br 3.533456 -3.671363 -0.150883
O 1.442000 1.977398 0.228830
O -1.245470 2.266069 2.523005
O 2.003158 0.378008 -3.348352
O 0.388944 1.508474 -2.296475
N -4.399239 0.090241 -0.226849
N -1.258306 2.125857 0.228421
C -2.923734 0.307351 -0.104977
C -4.728447 -1.024275 -1.161508
C -5.041400 -0.062972 1.120774
C -2.704360 1.819981 0.125693
C -4.213419 -2.412623 -0.771140
C -6.544174 0.200896 1.018103
C -0.652591 2.284570 1.455251
C 0.858114 2.559064 1.420026
C 1.819809 0.660493 0.250192
C 1.870599 0.054615 -1.026425
C 2.212356 -0.039193 1.405045
C 2.410570 -1.238995 -1.140232
C 2.712943 -1.330274 1.278153
C 2.820752 -1.916112 0.005315
C 1.326043 0.743599 -2.207449
H -2.415161 -0.002892 -1.042990
H -2.455423 -0.278849 0.713639
H -5.837094 -1.050610 -1.264438
H -4.334093 -0.741897 -2.163542
H -4.585977 0.684017 1.811050
H -4.858441 -1.062075 1.572335
H -3.137111 2.405519 -0.716469
H -3.227063 2.152634 1.054474
H -3.120522 -2.444957 -0.716761
H -4.598979 -2.726770 0.205720
H -4.526617 -3.166146 -1.501869
H -6.742714 1.133063 0.471867
H -7.067100 -0.601878 0.487352
H -6.993129 0.293878 2.012423
H -0.705324 2.091203 -0.642699
H 1.350525 2.208721 2.343251
H 1.066855 3.639047 1.272285
H 2.132031 0.428436 2.386816
H 2.492456 -1.696166 -2.134211
H 3.026352 -1.883453 2.169101
H 1.639224 0.824867 -4.162853


%chk=000206144-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206144

0 1
Br 7.103122 0.083681 -0.882208
O 1.127949 0.099962 0.595997
O -1.642895 1.237281 2.617163
O 2.406348 -0.363619 -3.383084
O 0.583816 0.087287 -2.038285
N -5.038133 0.171701 -0.253609
N -1.333301 0.817920 0.326326
C -3.624960 -0.170473 0.025019
C -5.770379 -0.836327 -1.058240
C -5.758180 0.677315 0.944036
C -2.728304 1.095129 -0.049295
C -6.056124 -2.198723 -0.365588
C -7.035277 1.465343 0.597513
C -0.917593 0.902185 1.627014
C 0.572153 0.592921 1.865557
C 2.478131 0.146578 0.313941
C 2.851391 -0.000890 -1.061100
C 3.475639 0.292359 1.310010
C 4.231663 -0.027025 -1.399291
C 4.838800 0.279258 0.956542
C 5.204358 0.113366 -0.397504
C 1.826615 -0.081814 -2.134148
H -3.275175 -0.899920 -0.729902
H -3.484614 -0.642469 1.025522
H -6.726687 -0.388327 -1.386937
H -5.181716 -1.015174 -1.978767
H -5.065264 1.345477 1.487627
H -6.010408 -0.146378 1.658132
H -2.753998 1.499362 -1.075626
H -3.121544 1.863828 0.638233
H -5.118748 -2.690364 -0.045806
H -6.698702 -2.076490 0.525225
H -6.576093 -2.880606 -1.064474
H -6.798677 2.283686 -0.105417
H -7.807474 0.824949 0.133627
H -7.473121 1.902377 1.513919
H -0.654635 0.520349 -0.391725
H 0.662781 -0.174338 2.656108
H 1.083706 1.520170 2.188704
H 3.193730 0.397926 2.361526
H 4.510594 -0.146352 -2.448081
H 5.605449 0.388759 1.728901
H 1.686056 -0.383381 -4.068555


