%chk=000200990.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200990

0 1
Cl -3.161563 2.222865 -0.283403
S 1.490206 0.008933 -2.766088
P 2.030822 0.279635 -0.988963
O 1.105792 -0.544212 0.173987
O 3.462889 -0.278939 -0.443430
O 1.964351 1.828832 -0.503751
O -4.957251 -1.476995 1.049300
O -5.093347 0.664732 0.818067
N -4.466354 -0.376593 0.837009
C -0.249592 -0.413311 0.237304
C 3.879045 -1.609343 -0.920023
C 2.433940 2.183968 0.837137
C -0.945630 0.764891 -0.066448
C -0.911591 -1.562604 0.728399
C -3.012204 -0.342146 0.609489
C -2.331009 0.783895 0.117289
C -2.281639 -1.519670 0.905897
C 5.279835 -1.736874 -0.357967
C 3.944292 2.264374 0.873259
H 3.184996 -2.361033 -0.498017
H 3.868592 -1.633049 -2.027462
H 1.956165 3.181557 0.945505
H 2.015699 1.485934 1.585416
H -0.440255 1.661355 -0.442075
H -0.330528 -2.457408 0.952374
H -2.827063 -2.399338 1.276325
H 5.725427 -2.706555 -0.613355
H 5.940962 -0.949023 -0.746139
H 5.282650 -1.641006 0.737074
H 4.294195 2.768998 1.782631
H 4.422451 1.271046 0.846741
H 4.336817 2.827486 0.013715


%chk=000200990-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200990

0 1
Cl -3.299982 2.164481 -0.680766
S 1.462061 0.232947 -2.962459
P 2.045840 0.352106 -1.010084
O 1.054238 -0.558560 0.174908
O 3.546309 -0.305126 -0.486778
O 2.099425 1.932492 -0.367969
O -5.135785 -1.617213 0.936787
O -5.262029 0.658984 0.892635
N -4.603360 -0.443374 0.805848
C -0.341326 -0.465473 0.257313
C 3.903128 -1.700264 -0.907353
C 2.659581 2.203893 1.007430
C -1.067215 0.664365 -0.188246
C -1.006143 -1.566658 0.850114
C -3.141121 -0.392048 0.575277
C -2.465849 0.701803 -0.025755
C -2.397516 -1.522794 1.000340
C 5.326592 -1.938193 -0.416969
C 4.116900 2.646571 0.905812
H 3.180254 -2.396172 -0.443724
H 3.824721 -1.765239 -2.008989
H 2.003305 3.007771 1.380067
H 2.537038 1.304539 1.638166
H -0.558933 1.513057 -0.654891
H -0.423554 -2.430697 1.178856
H -2.947014 -2.358666 1.440869
H 5.646971 -2.959139 -0.694969
H 6.024555 -1.217050 -0.874265
H 5.385926 -1.842385 0.680317
H 4.476808 2.959119 1.904503
H 4.752427 1.822211 0.543540
H 4.214847 3.505113 0.220232


