%chk=000230174.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230174

0 1
Br -2.510019 3.404571 0.172386
Br 0.923959 1.518653 -3.189791
O -1.434529 0.515431 0.547243
O 3.180029 -1.090706 1.750412
O 4.518122 -1.020495 -0.210314
C -0.647075 1.289531 -0.380572
C -2.966969 -1.147941 1.115551
C -3.874911 -2.332979 0.732369
C -2.137682 -0.613689 -0.048321
C 0.751528 0.694592 -0.427063
C -0.645716 2.690961 0.263495
C -4.927114 -1.929664 -0.307237
C -3.061159 -3.538185 0.245879
C 1.228486 0.087046 0.767959
C 1.549049 0.719877 -1.568246
C 2.490859 -0.450937 0.731344
C 0.285418 3.673397 -0.405572
C 3.297851 -0.410024 -0.449376
C 2.852791 0.167339 -1.615001
C 4.479645 -1.469836 1.186709
H -1.135156 1.291271 -1.382477
H -2.289738 -1.442517 1.941815
H -3.580010 -0.318631 1.527264
H -4.415714 -2.638557 1.666534
H -1.389590 -1.335795 -0.413903
H -2.760579 -0.247241 -0.881647
H -0.439711 2.598752 1.355939
H 0.587930 0.047410 1.652712
H -5.649056 -2.736741 -0.472527
H -4.477486 -1.694705 -1.277550
H -5.488897 -1.045646 0.014718
H -2.569651 -3.341615 -0.712534
H -3.702055 -4.415531 0.105145
H -2.281690 -3.811703 0.965021
H 1.328986 3.325972 -0.370890
H 0.036791 3.838948 -1.464339
H 0.257374 4.658280 0.082571
H 3.462903 0.195980 -2.516907
H 5.258229 -0.924786 1.736745
H 4.541857 -2.566184 1.189057


%chk=000230174-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230174

0 1
Br -2.378377 3.776318 0.299116
Br 0.620621 1.270953 -3.305543
O -1.571224 0.687464 0.658892
O 3.206060 -1.055477 1.749481
O 4.362384 -1.269448 -0.344561
C -0.704966 1.434819 -0.256496
C -3.097914 -1.124608 1.110380
C -3.871977 -2.395912 0.657839
C -2.191326 -0.503358 0.041848
C 0.654022 0.732322 -0.392444
C -0.550209 2.840796 0.366144
C -4.855498 -2.108331 -0.503769
C -2.926835 -3.572163 0.307271
C 1.232145 0.196487 0.801581
C 1.358177 0.582093 -1.611148
C 2.470969 -0.429759 0.712874
C 0.475567 3.757063 -0.305669
C 3.153101 -0.559482 -0.517088
C 2.618992 -0.068316 -1.707949
C 4.499673 -1.448454 1.129683
H -1.178913 1.526703 -1.254411
H -2.472961 -1.371952 1.991080
H -3.818626 -0.349691 1.435858
H -4.478355 -2.708773 1.533852
H -1.399582 -1.209508 -0.285228
H -2.770954 -0.182121 -0.848821
H -0.372208 2.738705 1.450160
H 0.674167 0.261926 1.739219
H -5.488256 -2.991720 -0.709117
H -4.318136 -1.862048 -1.439038
H -5.522708 -1.259810 -0.262361
H -2.342715 -3.363932 -0.608916
H -3.504238 -4.497935 0.126820
H -2.212212 -3.771726 1.127971
H 1.488267 3.321362 -0.213114
H 0.253989 3.894880 -1.377298
H 0.479392 4.746808 0.179218
H 3.138126 -0.182166 -2.661106
H 5.296952 -0.777292 1.498373
H 4.692886 -2.510811 1.343020


