%chk=000266203.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266203

0 1
Br -5.346003 4.601934 0.355755
Br 7.304704 2.092479 -0.284052
N -1.056264 0.238482 0.129005
N -2.450765 -1.653167 -0.030095
N -1.534693 -3.928072 -0.143668
N 1.663753 -0.241949 0.018834
N 0.739136 -4.342027 -0.199806
N -3.862958 -3.536392 -0.135394
C -1.175647 -1.133900 0.023169
C -0.007997 -1.984287 -0.040359
C -2.119923 1.199950 0.173946
C -0.271485 -3.394805 -0.109168
C 1.358132 -1.508903 -0.074236
C -1.830670 2.475750 -0.359899
C -3.368875 0.948182 0.767063
C -2.584908 -3.022947 -0.118287
C -2.790409 3.484964 -0.303846
C -4.327310 1.962563 0.816381
C 3.009305 0.223684 -0.052739
C -4.030910 3.218174 0.282623
C 3.865856 -0.116616 -1.117600
C 3.435992 1.129113 0.940567
C 5.142447 0.445270 -1.188030
C 4.713168 1.683139 0.869251
C 5.553963 1.333849 -0.192727
H -0.089763 0.640770 0.101971
H 2.129051 -2.298014 -0.178424
H -0.864628 2.676885 -0.823007
H -3.599304 -0.035609 1.184527
H -2.568614 4.469899 -0.718753
H -5.298339 1.765918 1.274538
H 3.530164 -0.797485 -1.897345
H 2.763737 1.393466 1.757200
H 1.680543 -4.111105 0.069392
H 0.488147 -5.322601 -0.154100
H 5.805264 0.187834 -2.016102
H 5.047346 2.383230 1.637417
H -4.651788 -2.914508 -0.226866
H -4.005854 -4.520147 -0.304638


%chk=000266203-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266203

0 1
Br -4.937284 4.934456 0.501800
Br 7.141490 2.320026 -0.560714
N -1.087994 0.080383 0.161114
N -2.514147 -1.825810 0.022683
N -1.531566 -4.070424 -0.119575
N 1.517648 -0.236042 0.060590
N 0.743013 -4.446966 -0.092210
N -3.835793 -3.740322 -0.151834
C -1.261672 -1.278264 0.056250
C -0.053267 -2.099314 -0.023635
C -2.030651 1.130833 0.233396
C -0.281802 -3.525708 -0.077101
C 1.270214 -1.539667 -0.066957
C -1.498792 2.452104 0.289521
C -3.442378 0.956912 0.256465
C -2.580758 -3.188654 -0.084171
C -2.346182 3.573471 0.368563
C -4.293431 2.079955 0.335563
C 2.820402 0.295728 -0.101586
C -3.742735 3.375280 0.391671
C 3.783527 -0.242137 -1.004994
C 3.159912 1.461860 0.639234
C 5.056722 0.350029 -1.139762
C 4.431205 2.056782 0.515849
C 5.371533 1.490330 -0.371825
H -0.053256 0.335846 0.176842
H 2.119351 -2.236802 -0.205958
H -0.412842 2.601030 0.264621
H -3.846019 -0.054732 0.209794
H -1.924675 4.581827 0.409122
H -5.378304 1.939110 0.353081
H 3.526669 -1.098595 -1.638541
H 2.419328 1.882621 1.327146
H 1.718196 -4.196147 0.032300
H 0.476689 -5.428786 -0.139393
H 5.784823 -0.061386 -1.845011
H 4.684060 2.946237 1.099950
H -4.649537 -3.132085 -0.125220
H -3.928094 -4.749980 -0.224570


