%chk=000250512.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250512

0 1
S 1.650338 -0.854907 0.226042
O 1.461834 -1.349088 1.579238
O 1.485709 -1.729046 -0.912534
O -0.139657 2.684242 1.034241
O 0.110787 2.389864 -1.609503
C 0.525006 0.553331 0.014953
C -0.896082 0.025608 0.044799
C 0.709778 1.537820 1.186860
C 0.895793 1.239455 -1.319440
C 3.268235 -0.131626 0.165715
C -1.317841 -0.775672 1.122534
C -1.823139 0.353036 -0.955660
C 4.286594 -1.220997 -0.133290
C -2.627318 -1.254566 1.179429
C -3.134256 -0.130057 -0.895169
C -3.541508 -0.936266 0.169534
H 1.716871 1.996516 1.211652
H 0.491308 1.057504 2.162977
H 0.700194 0.571776 -2.188264
H 1.961684 1.552835 -1.324068
H 3.352604 0.671591 -0.596249
H 3.529872 0.356108 1.127682
H -0.623807 -1.053417 1.926265
H -1.537639 0.999123 -1.792628
H 5.293718 -0.800516 -0.256060
H 4.347527 -1.963664 0.676096
H 4.048492 -1.766242 -1.061578
H -1.088610 2.400702 1.021055
H 0.064262 2.994316 -0.811825
H -2.934423 -1.883985 2.014253
H -3.837801 0.126123 -1.686571
H -4.560326 -1.316099 0.213215


%chk=000250512-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250512

0 1
S 1.703247 -0.860974 0.091773
O 1.695596 -1.368730 1.658205
O 1.329423 -1.899774 -1.113064
O -0.159528 2.770364 1.368984
O -0.050921 2.739031 -1.459720
C 0.366834 0.784395 0.013975
C -1.001743 0.155060 0.019940
C 0.706263 1.565004 1.298709
C 0.782444 1.550041 -1.254884
C 3.537730 -0.252458 -0.260132
C -1.441734 -0.576867 1.162980
C -1.870356 0.257717 -1.101931
C 4.472559 -1.416406 0.056763
C -2.715967 -1.179404 1.180623
C -3.147455 -0.339805 -1.074196
C -3.576301 -1.059540 0.064573
H 1.730796 1.972026 1.269015
H 0.599290 0.940523 2.202251
H 0.657815 0.927322 -2.157013
H 1.851210 1.845840 -1.175890
H 3.519350 0.035857 -1.322673
H 3.676807 0.620173 0.398608
H -0.768441 -0.724467 2.014426
H -1.563240 0.833401 -1.978617
H 5.518594 -1.098244 -0.110621
H 4.367595 -1.732015 1.108683
H 4.265079 -2.281810 -0.595257
H -1.080299 2.482193 1.601232
H -0.159832 3.181007 -0.568202
H -3.030913 -1.754890 2.057753
H -3.808784 -0.243459 -1.942098
H -4.566919 -1.527308 0.079506


