%chk=000287553.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287553

0 1
S 0.724959 -2.441161 0.418891
O 1.324611 0.919777 0.011592
O 2.908749 0.280900 1.477254
O -2.955586 1.022324 0.609507
O -3.577696 -0.893079 -0.424484
C 2.693576 -0.926236 -0.682613
C 1.425037 -1.689204 -1.081098
C 3.229000 -0.139613 -1.889654
C 3.771295 -1.869719 -0.140376
C 2.360269 0.100496 0.417842
C -1.055303 -2.117838 0.252959
C -1.340949 -0.662010 0.569204
C 0.987041 2.037490 0.910490
C -2.734230 -0.268802 0.172882
C -0.153793 2.749654 0.218254
C -4.243612 1.643998 0.304420
C -4.251957 2.126400 -1.131101
H 0.694516 -1.011280 -1.563779
H 1.656393 -2.485048 -1.813705
H 3.468453 -0.807023 -2.725089
H 2.498303 0.598061 -2.247313
H 4.147765 0.406117 -1.640955
H 4.033404 -2.643979 -0.868622
H 4.690117 -1.324917 0.115803
H 3.454759 -2.375178 0.784050
H -1.567173 -2.799800 0.964230
H -1.422198 -2.399737 -0.754254
H -0.612681 0.019351 0.050308
H -1.176522 -0.443188 1.649472
H 1.894453 2.657663 1.012421
H 0.717664 1.609425 1.891217
H 0.023824 2.826161 -0.863327
H -1.116334 2.227093 0.350578
H -0.279598 3.766782 0.608576
H -4.259970 2.465888 1.043022
H -5.044996 0.912148 0.511409
H -3.373044 2.742715 -1.357016
H -4.246003 1.279451 -1.834014
H -5.145242 2.724417 -1.347679


%chk=000287553-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287553

0 1
S 0.690973 -2.606174 0.428764
O 1.444694 1.012813 -0.022443
O 3.180624 0.425195 1.406970
O -3.086696 1.001859 0.594386
O -3.774453 -1.070528 -0.237739
C 2.776917 -0.930165 -0.646228
C 1.465231 -1.660700 -1.033322
C 3.349812 -0.252701 -1.932819
C 3.817743 -1.912854 -0.060978
C 2.508855 0.191630 0.378071
C -1.130937 -2.184105 0.137031
C -1.467313 -0.764894 0.618159
C 1.179787 2.203262 0.849180
C -2.885576 -0.346273 0.266786
C 0.075765 3.017859 0.182106
C -4.444702 1.566178 0.309094
C -4.524819 2.081844 -1.130236
H 0.714739 -0.936281 -1.388648
H 1.676486 -2.393819 -1.830997
H 3.597690 -1.026650 -2.682100
H 2.621782 0.450006 -2.373602
H 4.275776 0.302701 -1.698244
H 4.040903 -2.704672 -0.799150
H 4.752971 -1.385338 0.190498
H 3.444499 -2.386279 0.863362
H -1.699589 -2.949048 0.689553
H -1.351215 -2.314873 -0.935031
H -0.760896 -0.029919 0.190383
H -1.340437 -0.691373 1.715270
H 2.123708 2.768600 0.949665
H 0.891579 1.837964 1.851515
H 0.370923 3.318076 -0.838343
H -0.869724 2.451059 0.129774
H -0.109693 3.935123 0.771205
H -4.549466 2.376801 1.047907
H -5.196562 0.779411 0.495827
H -3.729905 2.821620 -1.329585
H -4.430206 1.251083 -1.849386
H -5.501964 2.572061 -1.297355


