%chk=000229575.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229575

0 1
S 5.338413 -0.681060 -0.646784
O 5.384419 -1.559839 0.498342
O 5.445287 -1.237028 -1.979304
O 5.771553 1.527792 1.317213
O -9.787754 -0.355053 0.138652
O 7.955361 1.058590 1.501531
O -8.792463 1.527663 0.819428
C 0.133194 -0.488941 -0.301824
C -1.128000 0.378856 -0.196657
C 1.399978 0.373418 -0.385298
C -2.394238 -0.484039 -0.110047
C 2.657926 -0.500914 -0.491426
C -3.655703 0.383529 -0.006475
C 3.927189 0.352760 -0.571771
C -4.921912 -0.479127 0.083293
C -6.178182 0.393255 0.186955
C 6.736168 0.446670 -0.518835
C -7.444584 -0.465448 0.272856
C 6.957246 0.993702 0.833773
C -8.664375 0.383938 0.455046
H 0.195932 -1.168739 0.570564
H 0.064246 -1.146539 -1.190473
H -1.193656 1.056344 -1.069987
H -1.060190 1.036848 0.691344
H 1.335639 1.052880 -1.257073
H 1.468017 1.028401 0.504920
H -2.461808 -1.143502 -0.997011
H -2.329202 -1.160869 0.763987
H 2.579592 -1.154799 -1.386454
H 2.711876 -1.181759 0.386664
H -3.720818 1.059388 -0.881366
H -3.586555 1.044579 0.879528
H 3.964310 1.040590 0.306310
H 3.858780 1.031780 -1.445600
H -4.990055 -1.139913 -0.802880
H -4.854603 -1.154027 0.958878
H -6.244596 1.075122 -0.684822
H -6.115208 1.056881 1.074850
H 6.652729 1.268934 -1.262172
H 7.662064 -0.087289 -0.855074
H -7.377849 -1.184364 1.120431
H -7.556889 -1.102633 -0.632564
H 5.857419 1.874850 2.246283
H -10.630899 0.156911 0.254249


%chk=000229575-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229575

0 1
S 5.480177 -0.705039 -0.718774
O 5.452355 -1.703932 0.570359
O 5.596690 -1.292328 -2.239339
O 6.214388 1.670480 1.409166
O -9.994309 -0.547141 0.377519
O 8.244771 0.542037 1.618141
O -8.985448 1.543149 0.405983
C 0.109933 -0.422041 -0.262552
C -1.183360 0.419796 -0.185384
C 1.385938 0.440061 -0.401191
C -2.461006 -0.442828 -0.076604
C 2.667088 -0.430671 -0.479887
C -3.757499 0.394205 -0.000030
C 3.908401 0.445023 -0.638420
C -5.035510 -0.469965 0.086715
C -6.326362 0.373797 0.167703
C 7.040014 0.534845 -0.520656
C -7.590059 -0.503671 0.242326
C 7.274622 0.885458 0.915607
C -8.871429 0.299572 0.347462
H 0.191672 -1.056082 0.644145
H 0.044117 -1.116963 -1.124958
H -1.255034 1.066548 -1.084798
H -1.127345 1.103860 0.687042
H 1.304873 1.069349 -1.311166
H 1.457529 1.134572 0.460851
H -2.516275 -1.124971 -0.950664
H -2.390172 -1.092540 0.820698
H 2.587024 -1.127588 -1.336324
H 2.760856 -1.043097 0.436683
H -3.821476 1.053453 -0.890748
H -3.709594 1.066925 0.881489
H 4.111211 1.102717 0.221899
H 3.955038 0.990252 -1.595852
H -5.083040 -1.139374 -0.797870
H -4.968870 -1.132508 0.975288
H -6.394531 1.042119 -0.712204
H -6.287882 1.037852 1.052355
H 6.752710 1.393752 -1.144582
H 7.863425 -0.049384 -0.952711
H -7.549081 -1.187094 1.113761
H -7.673743 -1.161514 -0.644991
H 6.364891 1.858692 2.374690
H -10.817902 0.008015 0.451025


