%chk=000216927.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216927

0 1
Cl 6.880008 0.526030 -0.011484
S -4.373629 -0.760961 0.001437
O -0.115009 -2.090273 -0.000999
O 2.391208 1.271318 -0.006328
N 1.963901 -0.984480 -0.003779
N -1.474099 -1.802555 -0.000105
C -1.629441 -0.462878 -0.001204
C 0.572839 -0.853424 -0.002727
C 4.299018 -0.228654 -0.006285
C -0.328251 0.182526 -0.002917
C -2.911358 0.188040 -0.000710
C 2.833224 0.145955 -0.005586
C 5.162585 1.026772 -0.010208
C -3.212078 1.524962 -0.001704
C -4.629135 1.780417 -0.000724
C -5.385614 0.644644 0.000993
H 4.543870 -0.861762 -0.889960
H 4.545551 -0.857366 0.880080
H -0.127952 1.238565 -0.004072
H 2.328734 -1.940965 -0.003170
H 4.986114 1.656464 0.885018
H 4.983645 1.652597 -0.907648
H -2.481800 2.323502 -0.003083
H -5.024421 2.787673 -0.001329
H -6.459609 0.562255 0.001995


%chk=000216927-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216927

0 1
Cl 6.992841 0.537221 -0.010709
S -4.466559 -0.828444 0.002189
O -0.085013 -2.113697 -0.000751
O 2.390962 1.329411 -0.006546
N 1.959979 -0.964043 -0.003994
N -1.535322 -1.858238 0.000370
C -1.635218 -0.495052 -0.001027
C 0.569766 -0.874313 -0.002743
C 4.311510 -0.224070 -0.006615
C -0.346014 0.160119 -0.002977
C -2.937940 0.147418 -0.000505
C 2.823113 0.141148 -0.005757
C 5.174395 1.040443 -0.009929
C -3.219887 1.512255 -0.001895
C -4.625083 1.815525 -0.000903
C -5.428069 0.684694 0.001259
H 4.546870 -0.841209 -0.895155
H 4.548570 -0.837676 0.883931
H -0.122256 1.220479 -0.004346
H 2.351726 -1.909940 -0.003453
H 5.025710 1.652397 0.889221
H 5.023991 1.648870 -0.911194
H -2.439531 2.277452 -0.003601
H -5.025666 2.831692 -0.001766
H -6.514572 0.615962 0.002398


