%chk=000190103.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190103

0 1
Br -6.644088 -0.190377 0.171756
O 0.490909 -0.957900 0.898621
O -0.376048 1.385627 -1.761431
C -0.542984 0.821546 -0.449383
C -0.073133 1.819998 0.635022
C 0.234894 -0.470189 -0.413844
C -2.037972 0.556892 -0.314074
C 1.328147 2.316637 0.415984
C 0.741575 -1.293759 -1.373517
C 1.379905 -2.399809 -0.685588
C 1.198364 -2.153326 0.705330
C -2.509530 -0.260326 0.723788
C -2.939718 1.143592 -1.211294
C 2.424755 1.550414 0.840399
C 1.546799 3.551804 -0.213090
C 2.069514 -3.552085 -1.077923
C 1.666500 -2.991980 1.714924
C -3.880288 -0.485278 0.871809
C -4.313392 0.921497 -1.072479
C -4.765205 0.111725 -0.029426
C 3.725220 2.017690 0.638851
C 2.850654 4.015013 -0.411491
C 2.546851 -4.404295 -0.083170
C 2.349170 -4.129980 1.287106
C 3.941288 3.250343 0.013179
H -0.155463 1.333858 1.632724
H -0.786811 2.671339 0.665756
H 0.682452 -1.172888 -2.440011
H 0.543242 1.723351 -1.880081
H -1.804079 -0.731869 1.413536
H -2.561995 1.769459 -2.026049
H 2.257367 0.585237 1.322682
H 0.702115 4.154961 -0.542453
H 2.224254 -3.771328 -2.132060
H 1.505279 -2.768835 2.764422
H -4.245933 -1.121241 1.678829
H -5.013431 1.376912 -1.773951
H 4.573161 1.419514 0.969969
H 3.015701 4.975770 -0.897038
H 3.086288 -5.307980 -0.364130
H 2.740963 -4.828225 2.027080
H 4.955504 3.613091 -0.141182


%chk=000190103-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190103

0 1
Br -6.779508 -0.095937 0.236480
O 0.447569 -1.055085 0.909546
O -0.346116 1.387321 -1.782984
C -0.555738 0.804865 -0.450042
C -0.089644 1.822035 0.665183
C 0.241403 -0.486231 -0.385596
C -2.068284 0.550468 -0.308347
C 1.326121 2.335040 0.451651
C 0.825026 -1.264211 -1.362127
C 1.443665 -2.402139 -0.698373
C 1.188712 -2.241017 0.695045
C -2.568254 -0.202286 0.783028
C -2.978010 1.104979 -1.238417
C 2.448165 1.645921 0.984139
C 1.553396 3.507549 -0.319463
C 2.180762 -3.535459 -1.125049
C 1.620020 -3.133517 1.684645
C -3.956892 -0.397205 0.949704
C -4.370686 0.916401 -1.085787
C -4.842763 0.168729 0.010610
C 3.759460 2.115735 0.752736
C 2.866592 3.978720 -0.553113
C 2.628178 -4.451634 -0.149142
C 2.353772 -4.256076 1.234620
C 3.974120 3.282042 -0.018983
H -0.183573 1.319473 1.643461
H -0.810470 2.658859 0.641554
H 0.798621 -1.050357 -2.427512
H 0.576707 1.757194 -1.809695
H -1.877943 -0.653575 1.503037
H -2.588271 1.675680 -2.084537
H 2.287833 0.741069 1.580972
H 0.695669 4.068454 -0.710654
H 2.397155 -3.698878 -2.185761
H 1.399222 -2.971782 2.743414
H -4.336871 -0.980511 1.793106
H -5.069838 1.344346 -1.809926
H 4.613421 1.573777 1.174202
H 3.022713 4.888424 -1.143721
H 3.198020 -5.334629 -0.458116
H 2.715260 -4.988371 1.964285
H 4.992079 3.646421 -0.195970


