%chk=000192795.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192795

0 1
Br -6.424898 0.312851 -2.189417
O -4.329354 1.661857 0.884162
N 2.117359 -1.338253 0.095216
N 3.404268 -0.695042 -1.699563
N 2.707696 0.530254 1.666829
N -4.213282 -0.308165 -0.325677
N 4.319076 2.094919 0.686791
N 5.197369 1.854519 -1.494690
C 1.113176 -2.075412 0.886118
C -0.282417 -1.601005 0.568850
C 2.765693 -0.163129 0.479310
C 3.578264 0.217601 -0.648171
C 2.526484 -1.601923 -1.251632
C -1.138891 -2.381718 -0.219236
C -0.728917 -0.367338 1.067169
C -2.875106 -0.705006 0.006190
C -2.432020 -1.945222 -0.501857
C -2.018045 0.084613 0.792458
C 4.373373 1.395926 -0.501087
C 3.503025 1.630300 1.688899
C -4.837565 0.865135 0.122939
C -6.240641 1.067937 -0.413279
H 1.231911 -3.166329 0.693253
H 1.335495 -1.918044 1.974432
H 2.152349 -2.452756 -1.802316
H -0.800322 -3.338189 -0.616515
H -0.056691 0.249276 1.673731
H -3.085336 -2.562121 -1.114495
H -2.354255 1.049932 1.189250
H -4.723260 -0.975090 -0.916127
H 3.499589 2.230961 2.615143
H 5.235439 1.378998 -2.382791
H 5.731856 2.699658 -1.371710
H -6.470576 2.154096 -0.462033
H -6.995047 0.611410 0.256858


%chk=000192795-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000192795

0 1
Br -7.241314 -0.502161 -1.415795
O -4.429771 1.845927 0.694905
N 2.167292 -1.289333 -0.011602
N 3.552489 -0.629028 -1.723450
N 2.733091 0.456944 1.664199
N -4.279424 -0.291453 -0.294909
N 4.439544 2.019110 0.823741
N 5.386151 1.854332 -1.335496
C 1.142576 -2.039971 0.749332
C -0.281573 -1.569641 0.478135
C 2.847378 -0.157611 0.450205
C 3.700463 0.230771 -0.618258
C 2.625289 -1.518329 -1.318203
C -1.194933 -2.384391 -0.233053
C -0.718509 -0.303509 0.943784
C -2.935031 -0.673663 -0.012803
C -2.510496 -1.945241 -0.478473
C -2.029376 0.153343 0.705309
C 4.520891 1.374962 -0.389448
C 3.568932 1.534771 1.762677
C -4.926518 0.873484 0.047322
C -6.389112 1.039641 -0.384133
H 1.253727 -3.111022 0.504475
H 1.397212 -1.901579 1.815400
H 2.251125 -2.342804 -1.921907
H -0.881720 -3.370494 -0.596898
H -0.018645 0.329913 1.501974
H -3.208552 -2.588646 -1.028845
H -2.359884 1.128739 1.066756
H -4.843773 -0.969076 -0.821153
H 3.540989 2.082495 2.709364
H 5.457371 1.391284 -2.238944
H 5.946251 2.676533 -1.120390
H -6.477448 1.915202 -1.044456
H -7.018892 1.175999 0.507638


