%chk=000290069.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290069

0 1
S 0.741816 1.128835 1.103965
O -0.243219 1.144086 -0.286543
O -3.177422 -0.419472 0.862727
O 0.014820 0.355200 2.080337
O 1.080463 2.505282 1.361295
C -2.260034 2.267027 0.730463
C -3.127588 2.711370 -1.330027
C -1.664926 1.135841 -0.175298
C -3.674564 2.408498 0.094362
C -2.216571 1.478727 -1.593882
C -1.616354 3.625400 0.343875
C -2.211808 3.936317 -1.055928
C -2.137133 -0.279427 0.258350
C -1.318134 -1.467684 -0.136761
C 2.094863 0.281745 0.490698
C -0.571896 -1.503085 -1.322273
C -1.349076 -2.592806 0.703411
C 0.128307 -2.661477 -1.671417
C -0.636898 -3.744030 0.357884
C 3.157696 0.989661 -0.088990
C 2.153108 -1.114663 0.576428
C 0.095724 -3.780947 -0.833103
C 4.268454 0.308455 -0.580030
C 3.264367 -1.801873 0.087534
C 4.329991 -1.095740 -0.495188
C 5.526168 -1.816762 -1.017363
H -2.236805 2.033502 1.803039
H -3.880891 2.875706 -2.107849
H -4.264158 3.225369 0.526449
H -4.283809 1.495615 0.166075
H -2.781242 0.646538 -2.037498
H -1.384316 1.713573 -2.278372
H -0.513482 3.583302 0.321793
H -1.878745 4.399454 1.080785
H -2.789815 4.871804 -1.050910
H -1.428126 4.048508 -1.818069
H -0.526891 -0.623254 -1.967425
H -1.936634 -2.555708 1.625605
H 0.699287 -2.690580 -2.597484
H -0.662957 -4.614473 1.011328
H 3.118532 2.084072 -0.149280
H 1.324210 -1.674833 1.029758
H 0.638353 -4.683707 -1.109909
H 5.091837 0.862354 -1.027672
H 3.300826 -2.887536 0.159379
H 5.739919 -1.544862 -2.062112
H 6.425688 -1.567247 -0.432578
H 5.418966 -2.909574 -0.986377


%chk=000290069-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290069

0 1
S 0.883277 1.251709 1.222190
O -0.218538 1.263750 -0.333136
O -2.962261 -0.339564 1.341003
O 0.151359 0.355407 2.359526
O 1.339416 2.774514 1.533798
C -2.308215 2.327430 0.721897
C -3.207135 2.626166 -1.358808
C -1.678001 1.156639 -0.101644
C -3.731549 2.410238 0.089816
C -2.312963 1.369866 -1.547298
C -1.694580 3.680456 0.254190
C -2.288351 3.873028 -1.189775
C -2.053887 -0.243926 0.468695
C -1.396723 -1.488090 -0.073025
C 2.348973 0.330225 0.505317
C -0.649945 -1.527931 -1.282119
C -1.591882 -2.693416 0.656836
C -0.127011 -2.750925 -1.755316
C -1.052071 -3.909333 0.193812
C 3.399165 1.092391 -0.033017
C 2.356405 -1.070821 0.573421
C -0.321212 -3.942993 -1.019638
C 4.520339 0.396815 -0.531176
C 3.494339 -1.739714 0.069819
C 4.585292 -1.022921 -0.487678
C 5.809135 -1.749822 -1.013071
H -2.271831 2.146242 1.806299
H -3.970830 2.729266 -2.147834
H -4.305588 3.270909 0.476417
H -4.323053 1.490853 0.224203
H -2.906434 0.486073 -1.844618
H -1.510779 1.517021 -2.292663
H -0.594302 3.682059 0.269922
H -2.036413 4.479324 0.936619
H -2.875973 4.805875 -1.265695
H -1.501983 3.909649 -1.965279
H -0.466938 -0.609830 -1.845198
H -2.174771 -2.645513 1.582362
H 0.437707 -2.771876 -2.693889
H -1.204036 -4.829405 0.768845
H 3.345997 2.185447 -0.040625
H 1.517845 -1.620347 1.012181
H 0.089372 -4.890146 -1.388077
H 5.357233 0.963813 -0.954956
H 3.529035 -2.833795 0.112095
H 6.045674 -1.441727 -2.047999
H 6.699150 -1.523140 -0.396217
H 5.667441 -2.843431 -1.007309


