%chk=000188497.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188497

0 1
S -2.055942 0.145062 -0.825323
O -2.377287 1.493187 -1.255277
O -2.363147 -0.980020 -1.689200
O 4.372299 -1.264964 0.289268
O 4.538542 0.909164 0.785747
C -2.790915 -0.135873 0.752039
C -4.318558 -0.125401 0.628015
C -0.340451 0.090000 -0.461472
C 0.328743 1.262322 -0.106835
C 0.346823 -1.120333 -0.559171
C -4.998536 -0.365887 1.973439
C 1.695526 1.222929 0.185796
C 1.714613 -1.171513 -0.269444
C 2.381442 0.001333 0.108834
C 3.831997 -0.005916 0.431873
H -2.480472 0.625797 1.494960
H -2.467721 -1.099681 1.193612
H -4.658081 0.848137 0.210774
H -4.645213 -0.904014 -0.095992
H -0.206952 2.218495 -0.074334
H -0.175438 -2.029603 -0.880201
H -6.090727 -0.354636 1.867383
H -4.724238 -1.336667 2.401839
H -4.736044 0.404869 2.707110
H 2.233471 2.133263 0.466806
H 2.266377 -2.113330 -0.341653
H 5.347189 -1.281822 0.497709


%chk=000188497-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188497

0 1
S -2.071685 0.160625 -0.815479
O -2.414195 1.699931 -1.260361
O -2.416797 -1.125151 -1.771235
O 4.544299 -1.293147 0.253418
O 4.662854 0.987057 0.682078
C -2.956787 -0.150610 0.891014
C -4.469425 -0.119825 0.668777
C -0.208318 0.086352 -0.421378
C 0.446109 1.287442 -0.100854
C 0.437905 -1.155512 -0.531817
C -5.221382 -0.388906 1.994679
C 1.831228 1.228590 0.158653
C 1.824261 -1.201358 -0.269804
C 2.515640 -0.013002 0.082944
C 3.979503 -0.015792 0.369035
H -2.581953 0.660849 1.536501
H -2.572709 -1.133249 1.211517
H -4.760540 0.865774 0.260795
H -4.743959 -0.882697 -0.083376
H -0.106882 2.232541 -0.088083
H -0.122166 -2.043767 -0.842632
H -6.311934 -0.365488 1.822309
H -4.965727 -1.381006 2.410122
H -4.983379 0.374666 2.758013
H 2.398744 2.129145 0.413575
H 2.376835 -2.141650 -0.341408
H 5.517760 -1.236912 0.449298


