%chk=000236611.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236611

0 1
S -0.510382 -2.574627 -1.058387
O -0.087728 1.560596 -0.000001
O -0.187967 -0.214111 -1.412338
O -3.008500 1.583356 1.773209
O -3.305306 2.052671 -0.399634
C 2.337615 1.451136 0.187936
C 2.853868 0.156761 -0.467281
C 3.474670 2.485718 0.304307
C 4.029273 -0.425557 0.327300
C 4.655845 1.906476 1.096171
C 5.163499 0.599004 0.472004
C 1.162225 2.042731 -0.600891
C -1.924228 0.121175 0.286815
C -0.660426 0.427062 -0.503666
C -2.738838 -0.995537 -0.399516
C -2.071759 -2.312030 -0.300094
C -2.795494 1.350686 0.436240
C -2.502435 -3.456130 0.301153
C -1.579691 -4.560086 0.156153
C -0.462706 -4.242475 -0.550195
H 1.970522 1.208381 1.218300
H 3.168635 0.355722 -1.509510
H 2.033271 -0.584908 -0.541220
H 3.108518 3.403783 0.800027
H 3.815632 2.788925 -0.703844
H 3.684226 -0.748977 1.328036
H 4.404971 -1.336900 -0.174519
H 4.350709 1.725924 2.145039
H 5.476116 2.647154 1.139137
H 5.977250 0.177171 1.090331
H 5.607827 0.806172 -0.520419
H 1.046126 3.133557 -0.466484
H 1.173343 1.788049 -1.674188
H -1.603665 -0.228545 1.314226
H -3.754014 -1.045739 0.056783
H -2.910495 -0.730266 -1.471399
H -3.433504 -3.566206 0.838326
H -1.792567 -5.530579 0.582634
H 0.372893 -4.871739 -0.799309
H -3.572630 2.387902 1.940869


%chk=000236611-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236611

0 1
S -0.315414 -2.623971 -1.278124
O -0.067854 1.467754 0.496775
O -0.528877 0.765413 -1.688650
O -4.258936 0.875601 0.977949
O -3.086625 2.498387 -0.199519
C 2.427609 1.487004 0.538954
C 2.614673 0.113424 -0.150955
C 3.661887 2.397957 0.293106
C 3.924863 -0.574490 0.299428
C 4.972736 1.708982 0.743837
C 5.152856 0.334852 0.056599
C 1.159573 2.210480 0.061842
C -2.087781 0.240073 0.157916
C -0.823714 0.831802 -0.476119
C -2.632105 -0.986531 -0.651336
C -1.863732 -2.258648 -0.405253
C -3.144833 1.342094 0.263359
C -2.176389 -3.290340 0.470681
C -1.220645 -4.372875 0.481127
C -0.164798 -4.178126 -0.393391
H 2.336714 1.321368 1.633959
H 2.633639 0.263584 -1.250400
H 1.750704 -0.543529 0.062406
H 3.536165 3.361977 0.825947
H 3.729217 2.634477 -0.790093
H 3.859518 -0.817199 1.380719
H 4.047464 -1.535842 -0.235897
H 4.948719 1.566015 1.844158
H 5.837062 2.365326 0.524346
H 6.074697 -0.156609 0.423773
H 5.281963 0.488248 -1.035003
H 1.056100 3.201493 0.536273
H 1.136920 2.308699 -1.039000
H -1.855438 -0.081436 1.188877
H -3.678303 -1.156054 -0.343791
H -2.627338 -0.715655 -1.722457
H -3.077572 -3.275588 1.090505
H -1.318690 -5.260937 1.110124
H 0.688571 -4.822825 -0.596420
H -4.937904 1.601344 1.035850


