%chk=000241188.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241188

0 1
Br -0.764217 -4.300560 -1.381993
Cl 3.816810 -3.850452 -0.919169
Cl 3.581372 -0.190105 4.081459
Cl -2.227896 5.522276 -4.173378
S -1.223913 1.467386 1.180921
N 1.287373 -2.775955 0.230355
N 0.013932 -0.771455 0.639942
N -2.238199 -0.581869 -0.272735
C -2.695894 2.984099 -0.480924
C -2.852556 2.140947 0.738884
C 2.469902 -2.354110 0.917093
C 0.129572 -2.026907 0.084013
C -2.887218 2.419297 -1.753912
C -2.356471 4.342626 -0.363900
C 3.722088 -2.839373 0.469914
C 2.434523 -1.524701 2.051332
C -1.160694 -0.116333 0.430637
C -0.958651 -2.582913 -0.658498
C -2.742193 3.200616 -2.901582
C -2.208872 5.134029 -1.505574
C 3.632614 -1.205888 2.691202
C 4.907716 -2.511694 1.129870
C -2.405415 4.548731 -2.757939
C 4.870978 -1.684178 2.254139
C -2.122310 -1.826699 -0.812722
H -3.602321 1.330595 0.593263
H -3.203225 2.720817 1.618464
H 1.354078 -3.673393 -0.274822
H -3.144567 1.361230 -1.845665
H -2.201348 4.787042 0.618554
H 1.486096 -1.118749 2.424173
H -2.887349 2.767368 -3.890875
H -1.943703 6.187523 -1.420681
H 5.861398 -2.898386 0.762872
H 5.788976 -1.415582 2.777071
H -2.989517 -2.203581 -1.373487


%chk=000241188-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241188

0 1
Br -0.609278 -4.248049 -1.737217
Cl 3.491451 -4.911523 -0.010829
Cl 4.142721 0.514000 3.361428
Cl -2.703561 5.899361 -4.133518
S -1.165787 1.469631 1.256221
N 1.446089 -2.709877 0.168459
N 0.104770 -0.776555 0.583826
N -2.106882 -0.533863 -0.398761
C -2.840855 3.042267 -0.474168
C -2.894628 2.111996 0.711595
C 2.597400 -2.409022 0.929064
C 0.280580 -1.990911 -0.014436
C -2.963347 2.533194 -1.793822
C -2.678660 4.440626 -0.294845
C 3.662310 -3.357061 0.946764
C 2.766020 -1.214874 1.683874
C -1.065345 -0.111864 0.371489
C -0.774323 -2.514854 -0.842347
C -2.921206 3.394799 -2.911373
C -2.633726 5.317763 -1.400722
C 3.955894 -1.023053 2.404006
C 4.843975 -3.148467 1.671745
C -2.756079 4.776733 -2.695081
C 5.005952 -1.960372 2.420047
C -1.937603 -1.753902 -1.001138
H -3.478612 1.201924 0.507508
H -3.267866 2.606997 1.622215
H 1.482841 -3.612266 -0.323675
H -3.083719 1.454482 -1.938933
H -2.583726 4.852952 0.716736
H 1.962719 -0.477457 1.683218
H -3.017466 3.001460 -3.927447
H -2.509796 6.395243 -1.259188
H 5.634375 -3.903588 1.656163
H 5.919340 -1.779581 2.991555
H -2.763073 -2.114591 -1.622112


