%chk=000182384.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182384

0 1
Br 5.333683 -1.434501 0.396390
O -0.624307 2.335187 -0.667683
O -1.826400 -2.812669 -0.487455
C 0.228023 0.151977 -0.183743
C -0.122820 -1.187904 -0.177160
C 1.608937 0.526497 -0.055980
C -2.254917 0.749018 -0.069388
C 2.596128 -0.498376 0.072067
C -2.597130 -0.613516 -0.048293
C -0.847815 1.188298 -0.337865
C -1.549011 -1.652650 -0.269674
C 0.867300 -2.200950 -0.071023
C 2.192916 -1.866192 0.051808
C 2.038131 1.895376 -0.043635
C 3.968112 -0.104857 0.212647
C -3.242233 1.717544 0.136761
C -3.921285 -1.001357 0.175593
C 3.360183 2.225724 0.091055
C 4.351390 1.210345 0.223453
C -4.567158 1.326235 0.373259
C -4.905936 -0.027699 0.391532
H 0.544444 -3.247940 -0.094274
H 2.943774 -2.657431 0.132864
H 1.286540 2.688842 -0.156742
H -2.972364 2.777435 0.104498
H -4.178144 -2.064923 0.176493
H 3.678754 3.269001 0.097859
H 5.397009 1.506814 0.330068
H -5.333212 2.084909 0.538185
H -5.937791 -0.332337 0.570285


%chk=000182384-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182384

0 1
Br 5.437205 -1.510239 -0.028245
O -0.651810 2.483639 0.076004
O -1.821583 -2.893889 0.033338
C 0.231078 0.200056 0.044773
C -0.128881 -1.173605 0.033465
C 1.642408 0.566905 0.035347
C -2.292976 0.753847 0.073652
C 2.643834 -0.497963 0.013212
C -2.630012 -0.626547 0.063222
C -0.867455 1.226982 0.065342
C -1.553521 -1.649829 0.042772
C 0.870248 -2.191848 0.012316
C 2.219383 -1.864902 0.002067
C 2.099888 1.928749 0.046982
C 4.032345 -0.127634 0.003467
C -3.327800 1.721788 0.092588
C -3.987834 -1.029593 0.071964
C 3.462522 2.230070 0.037389
C 4.449406 1.200614 0.015211
C -4.678256 1.318039 0.101183
C -5.010564 -0.060866 0.090939
H 0.531849 -3.231811 0.004456
H 2.977054 -2.653342 -0.014752
H 1.357075 2.725640 0.063339
H -3.046525 2.778922 0.100321
H -4.210333 -2.101094 0.063548
H 3.788642 3.275287 0.046898
H 5.513273 1.452516 0.007520
H -5.473142 2.071237 0.115837
H -6.060717 -0.371227 0.097746


