%chk=000198665.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198665

0 1
S 2.435329 -0.281420 -1.136112
P 0.933235 -0.150164 0.333699
O 0.936461 1.444514 0.815845
O 1.161864 -1.011185 1.518015
C -0.590032 -0.426693 -0.708813
C -1.818466 -0.159567 0.157642
C -3.110453 -0.344518 -0.656978
C -4.350414 -0.083817 0.193977
C 3.907254 -0.642173 -0.124698
C 0.733982 2.457704 -0.184303
H -0.588529 0.205274 -1.616192
H -0.597792 -1.474098 -1.080770
H -1.844319 -0.846449 1.033141
H -1.803264 0.866461 0.582992
H -3.106805 0.333211 -1.532337
H -3.149721 -1.371793 -1.070035
H -5.267734 -0.221203 -0.389901
H -4.404144 -0.766619 1.050600
H -4.364509 0.937700 0.590931
H 3.702733 -1.376096 0.671581
H 4.302407 0.270370 0.338285
H 4.670659 -1.063730 -0.790360
H 0.828632 3.384660 0.404818
H -0.270869 2.400460 -0.617676
H 1.515794 2.437172 -0.954352


%chk=000198665-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198665

0 1
S 2.625205 -0.013203 -1.285336
P 0.899482 0.122268 0.278826
O 0.735081 1.802406 0.750684
O 1.163779 -0.804805 1.551853
C -0.662698 -0.241728 -0.692654
C -1.933025 -0.158872 0.180124
C -3.199660 -0.514768 -0.634897
C -4.480796 -0.457223 0.224883
C 3.843679 -0.909565 -0.143638
C 1.086346 2.885111 -0.184920
H -0.694912 0.474177 -1.534984
H -0.526002 -1.255820 -1.109841
H -1.837271 -0.853190 1.037192
H -2.034367 0.859242 0.603359
H -3.295332 0.180928 -1.493225
H -3.086393 -1.530771 -1.064211
H -5.375183 -0.714135 -0.371265
H -4.422157 -1.167059 1.070747
H -4.632750 0.554344 0.645368
H 3.299890 -1.221944 0.766909
H 4.665532 -0.226866 0.113215
H 4.213213 -1.791754 -0.686105
H 1.065530 3.803549 0.421053
H 0.347720 2.968271 -1.006728
H 2.096385 2.729408 -0.607408


