%chk=000179268.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179268

0 1
Br -7.230119 2.525837 0.831863
Br 8.126729 0.247594 0.759438
N -0.327120 -0.151628 -0.454381
N -4.672173 -1.954755 -0.766636
N 3.415580 2.148155 -1.076887
N 1.066939 -1.763323 0.335830
C -2.558199 -1.263562 -0.246731
C 2.131887 0.377668 -0.418109
C -1.127646 -1.254443 -0.091678
C -3.473834 -0.201152 0.104581
C 3.499122 0.108661 -0.029654
C 1.015930 -0.504685 -0.177969
C -4.792409 -0.659481 -0.238219
C 4.281840 1.234722 -0.453767
C -3.312213 -2.312310 -0.766132
C 2.114270 1.618975 -1.052380
C -0.244004 -2.229856 0.390594
C -3.320027 1.069684 0.689024
C 4.131674 -0.964481 0.627444
C -5.938732 0.136175 -0.033512
C 5.673029 1.306903 -0.231570
C -4.441477 1.855521 0.895398
C 5.497066 -0.900328 0.848684
C -5.724481 1.380332 0.527403
C 6.238638 0.227133 0.418412
H -0.667944 0.704386 -0.847257
H -2.974496 -3.269249 -1.129677
H 1.285998 2.152471 -1.483658
H -5.428417 -2.530833 -1.083783
H 3.679384 3.027384 -1.477526
H -0.473414 -3.208568 0.773079
H -2.331347 1.414500 0.987918
H 3.535726 -1.826062 0.947169
H -6.928721 -0.222499 -0.303781
H 6.252410 2.165741 -0.557656
H -4.343575 2.842470 1.349207
H 6.007329 -1.720197 1.355619


%chk=000179268-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179268

0 1
Br -7.359395 2.604686 0.471746
Br 8.282269 0.142515 0.438214
N -0.327645 -0.158390 -0.306876
N -4.692893 -2.038363 -0.591040
N 3.395854 2.261037 -0.769563
N 1.104336 -1.765384 0.378195
C -2.570364 -1.296445 -0.163189
C 2.129175 0.423428 -0.267640
C -1.122236 -1.282669 -0.007471
C -3.505127 -0.197882 0.059650
C 3.529480 0.105837 -0.021698
C 1.012753 -0.481952 -0.068484
C -4.825718 -0.695335 -0.227328
C 4.296443 1.276450 -0.345305
C -3.339906 -2.396806 -0.558263
C 2.093283 1.749731 -0.722960
C -0.201625 -2.254854 0.416130
C -3.367354 1.143322 0.504807
C 4.198885 -1.055188 0.441584
C -5.985697 0.102999 -0.116725
C 5.703308 1.325452 -0.222545
C -4.510609 1.957384 0.624256
C 5.601197 -1.028382 0.571621
C -5.791464 1.429075 0.304389
C 6.322027 0.151778 0.239672
H -0.681333 0.710384 -0.704008
H -3.012254 -3.395863 -0.837716
H 1.248941 2.370854 -1.018451
H -5.456699 -2.657244 -0.853700
H 3.645712 3.201521 -1.066461
H -0.415682 -3.260845 0.770403
H -2.390499 1.547854 0.791131
H 3.617394 -1.947023 0.689743
H -6.984033 -0.283018 -0.340760
H 6.284101 2.218430 -0.469306
H -4.421988 2.990314 0.971470
H 6.140567 -1.910507 0.927179


