%chk=000211678.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211678

0 1
Br -4.908019 0.811185 -0.495314
Cl -2.512354 0.618982 -2.778972
S 3.304649 -1.063082 1.576245
S 0.645273 -2.069260 2.171014
N 2.949851 0.581105 -0.551818
N 1.047935 0.230970 0.892211
C 1.968172 1.273407 0.336293
C 4.032908 -0.052414 0.233227
C -0.359162 0.334725 0.550487
C 1.548144 -0.900831 1.468352
C 3.490172 1.487691 -1.603277
C -0.736048 0.392801 -0.799708
C -1.319484 0.398551 1.574070
C -2.090303 0.537065 -1.116118
C -2.667119 0.530719 1.236523
C -3.057624 0.609690 -0.106759
H 1.376100 2.019330 -0.246420
H 2.431127 1.812094 1.201882
H 4.593644 -0.743608 -0.438556
H 4.759979 0.648387 0.695384
H 2.658019 1.847534 -2.232702
H 4.155799 0.908546 -2.267917
H 4.049549 2.356850 -1.226387
H 0.012569 0.299998 -1.591473
H -1.019214 0.327997 2.622854
H -3.418364 0.570068 2.030779


%chk=000211678-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211678

0 1
Br -4.938153 0.983418 -0.281381
Cl -2.684937 1.044390 -2.822091
S 3.532955 -1.158960 1.244012
S 0.823318 -2.448982 1.258268
N 3.258143 1.283613 -0.212731
N 1.171720 0.187958 0.596278
C 1.975930 1.474640 0.439460
C 4.203165 0.619004 0.641614
C -0.257709 0.315826 0.389482
C 1.715952 -1.021795 1.002121
C 3.198084 0.830646 -1.620360
C -0.743001 0.548919 -0.915865
C -1.154715 0.277331 1.482393
C -2.123331 0.749583 -1.124733
C -2.532046 0.471723 1.264703
C -3.025569 0.712739 -0.039655
H 1.341249 2.160368 -0.143271
H 2.146460 1.907531 1.443307
H 5.144962 0.395785 0.120690
H 4.383334 1.188817 1.564465
H 2.562503 1.525824 -2.195805
H 2.795682 -0.199287 -1.727516
H 4.211929 0.858572 -2.052625
H -0.059452 0.547402 -1.769834
H -0.778493 0.076836 2.488839
H -3.231783 0.436599 2.104135


