%chk=000267406.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267406

0 1
Cl -5.656195 -1.669152 -1.213711
S 0.342394 -0.332742 1.638952
O -0.480518 2.887709 -0.336497
N 1.277495 1.382299 -0.157967
N 2.779590 -0.442313 0.496544
N 3.824100 -0.049363 -0.322642
C -0.813825 0.973618 1.133342
C -2.014713 0.325629 0.532154
C -0.030489 1.879852 0.126056
C -3.201785 0.245934 1.280246
C -1.969458 -0.212662 -0.766044
C 1.631314 0.308347 0.494221
C -4.334025 -0.371446 0.743649
C -3.096091 -0.830164 -1.311933
C -4.262341 -0.902323 -0.545935
C 4.944540 -0.718226 -0.351247
C 5.989300 -0.185049 -1.282404
C 5.290233 -1.944613 0.437073
H -1.072244 1.603774 2.019990
H -3.248817 0.667255 2.284355
H -1.054925 -0.148176 -1.359019
H -5.257139 -0.435178 1.319867
H -3.067044 -1.245811 -2.319660
H 2.842683 -1.267190 1.105009
H 5.649018 0.718630 -1.820887
H 6.901492 0.093052 -0.735777
H 6.257478 -0.930055 -2.044726
H 5.257627 -1.759335 1.520389
H 4.615568 -2.782649 0.210260
H 6.307379 -2.304251 0.219540


%chk=000267406-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267406

0 1
Cl -5.992022 -1.431884 -1.265211
S 0.443883 -0.599505 1.671473
O -0.528603 2.746524 -0.290605
N 1.330365 1.288055 -0.137646
N 2.891729 -0.438245 0.437963
N 3.918093 0.059073 -0.383240
C -0.780963 0.773199 1.149428
C -2.058772 0.223174 0.552225
C 0.018183 1.715073 0.158544
C -3.285771 0.366478 1.243709
C -2.051740 -0.429949 -0.707340
C 1.684672 0.201469 0.512045
C -4.490451 -0.132327 0.698822
C -3.243059 -0.933703 -1.266530
C -4.447301 -0.778651 -0.549746
C 5.050524 -0.617426 -0.387312
C 6.144084 -0.073875 -1.274090
C 5.324958 -1.878745 0.420993
H -0.998945 1.360226 2.056902
H -3.310292 0.877440 2.213110
H -1.111755 -0.543385 -1.259409
H -5.437787 -0.018065 1.232959
H -3.239418 -1.432690 -2.239716
H 3.020932 -1.286363 1.006350
H 5.800143 0.835180 -1.790572
H 7.046381 0.168430 -0.679905
H 6.446199 -0.825424 -2.028966
H 5.222116 -1.700450 1.510528
H 4.634866 -2.702025 0.146330
H 6.350353 -2.236207 0.242107


