%chk=000231552.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231552

0 1
Br 4.656460 -1.034841 0.018040
N -1.868217 0.398775 -0.270645
C 0.587999 0.280441 -0.338578
C -0.691548 -0.418583 0.153024
C 1.838429 -0.468685 0.141698
C -3.162015 -0.066375 0.316120
C 3.112959 0.196228 -0.372439
C -3.589904 -1.466123 -0.159510
C -4.233848 0.973452 -0.040534
C 3.408381 1.538453 0.260745
H 0.595351 1.326643 0.031513
H 0.583760 0.352894 -1.442817
H -0.726927 -1.464141 -0.221936
H -0.685980 -0.477687 1.264029
H 1.850674 -0.517919 1.249963
H 1.790674 -1.524538 -0.198823
H -3.034457 -0.087510 1.430954
H -1.927591 0.423423 -1.293090
H 3.110558 0.266254 -1.483011
H -4.558761 -1.746591 0.267715
H -3.693947 -1.515138 -1.247923
H -2.870348 -2.234202 0.139616
H -3.902497 1.983234 0.237244
H -5.169767 0.771864 0.489433
H -4.456073 0.989737 -1.112253
H 4.345399 1.975221 -0.111570
H 3.498670 1.474650 1.354354
H 2.605566 2.259564 0.047581


%chk=000231552-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231552

0 1
Br 4.714205 -1.104969 0.033370
N -1.899606 0.374788 -0.237394
C 0.584617 0.341862 -0.244367
C -0.707590 -0.401010 0.160350
C 1.853339 -0.452337 0.163866
C -3.209721 -0.077395 0.302614
C 3.143150 0.183930 -0.374767
C -3.633238 -1.503860 -0.149555
C -4.284097 0.963232 -0.073858
C 3.495060 1.555455 0.206577
H 0.569048 1.342421 0.224658
H 0.582862 0.500433 -1.343988
H -0.675060 -1.435058 -0.265993
H -0.732682 -0.515869 1.262854
H 1.913640 -0.523523 1.267237
H 1.772902 -1.486435 -0.221955
H -3.103896 -0.083569 1.407341
H -1.944359 0.507959 -1.258991
H 3.148646 0.198228 -1.478439
H -4.581902 -1.804985 0.332965
H -3.784272 -1.533655 -1.246321
H -2.867708 -2.256564 0.113364
H -3.993749 1.963369 0.290885
H -5.264984 0.695303 0.358530
H -4.406236 1.019397 -1.173864
H 4.453132 1.928115 -0.191908
H 3.567321 1.510592 1.307160
H 2.704177 2.282645 -0.061474


