%chk=000229587.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229587

0 1
S -4.530959 -0.378358 -0.018709
S 4.530928 0.378468 -0.015377
O -3.001750 0.343152 -0.014068
O 3.001721 -0.343061 -0.015785
O -4.650017 -1.092202 1.225050
O -4.641069 -1.096335 -1.260817
O 4.648674 1.086347 1.231913
O 4.642335 1.102388 -1.253914
C -0.653271 0.397040 -0.008252
C 0.653236 -0.396974 -0.014341
C -1.860350 -0.541884 -0.011745
C 1.860312 0.541951 -0.010417
C -5.460151 1.103450 -0.027973
C 5.460142 -1.103275 -0.030756
C -6.938181 0.787767 0.122682
C 6.938026 -0.788297 0.122782
H -0.712221 1.071887 -0.886812
H -0.709588 1.062550 0.877492
H 0.711912 -1.072174 0.863925
H 0.709827 -1.062128 -0.900375
H -1.901541 -1.170704 -0.921417
H -1.906012 -1.171621 0.897045
H 1.904487 1.166492 0.902037
H 1.902983 1.175950 -0.916407
H -5.130243 1.793596 0.780906
H -5.285140 1.687054 -0.959409
H 5.129479 -1.797233 0.774544
H 5.286016 -1.682477 -0.965101
H -7.536315 1.710414 0.146367
H -7.324106 0.184905 -0.712963
H -7.156097 0.247717 1.057310
H 7.536153 -1.711040 0.142618
H 7.324721 -0.181449 -0.709615
H 7.155062 -0.252714 1.060181


%chk=000229587-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229587

0 1
S -4.688888 -0.471370 0.082274
S 4.688912 0.471024 0.087427
O -3.054809 0.412374 0.341339
O 3.054598 -0.414117 0.340342
O -5.203355 -1.138604 1.465118
O -4.576753 -1.392894 -1.249008
O 5.202753 1.129654 1.474605
O 4.577463 1.400730 -1.238213
C -0.653138 0.416578 0.311322
C 0.652951 -0.418222 0.309992
C -1.885871 -0.499123 0.308967
C 1.885670 0.497504 0.311591
C -5.657694 1.162644 -0.273846
C 5.657677 -1.160914 -0.278246
C -7.153527 0.868603 -0.307172
C 7.153626 -0.867107 -0.308152
H -0.689712 1.074196 -0.577518
H -0.689119 1.066787 1.205615
H 0.688602 -1.071842 1.201803
H 0.689868 -1.072439 -0.581345
H -1.920555 -1.120209 -0.607679
H -1.895420 -1.153307 1.202263
H 1.895056 1.147993 1.207591
H 1.920475 1.122396 -0.602450
H -5.338705 1.816115 0.552536
H -5.225623 1.494210 -1.229947
H 5.337674 -1.819603 0.543586
H 5.226458 -1.486188 -1.236891
H -7.695087 1.815233 -0.489042
H -7.415021 0.165634 -1.116328
H -7.503898 0.453552 0.653039
H 7.695101 -1.812735 -0.495416
H 7.416205 -0.159134 -1.112583
H 7.503089 -0.458218 0.655027


