%chk=000230708.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230708

0 1
S 0.095866 -0.497761 1.022055
O 1.008841 0.088173 -0.324221
O 0.447758 0.363357 2.125951
O 0.416244 -1.897731 1.114592
C -1.455618 -0.180086 0.415179
C -1.838935 1.163367 0.178892
C -2.375085 -1.217117 0.138029
C -4.032399 0.423543 -0.564223
C -3.118831 1.455132 -0.302789
C -3.652796 -0.908023 -0.344435
C -0.889308 2.281755 0.430016
C -2.026582 -2.647890 0.351185
C -5.391444 0.740152 -1.090489
C 2.382772 0.099192 -0.315578
C 3.132193 0.370180 0.836457
C 2.984413 -0.112335 -1.568231
C 4.523702 0.417492 0.721074
C 4.374899 -0.052146 -1.653721
C 5.146256 0.208806 -0.514106
H -3.406722 2.489063 -0.479559
H -4.357617 -1.709876 -0.553436
H -1.323172 3.272623 0.244980
H 0.010061 2.206322 -0.210620
H -0.518950 2.291847 1.475778
H -1.125364 -2.950598 -0.217556
H -1.769209 -2.869566 1.402375
H -2.828958 -3.340092 0.066576
H -6.144579 -0.001953 -0.790134
H -5.756061 1.721438 -0.755125
H -5.383797 0.760977 -2.192335
H 2.649270 0.549715 1.800551
H 2.364243 -0.316511 -2.436414
H 5.126441 0.622010 1.606010
H 4.863151 -0.213345 -2.614247
H 6.229817 0.247986 -0.590081


%chk=000230708-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230708

0 1
S 0.173070 -0.497343 1.019816
O 1.183700 0.559012 -0.415142
O 0.410200 0.192938 2.474366
O 0.634321 -2.045896 0.847236
C -1.584783 -0.151404 0.376115
C -2.009126 1.204276 0.423085
C -2.377807 -1.228529 -0.100499
C -4.173403 0.440174 -0.517232
C -3.324639 1.463416 -0.032514
C -3.684290 -0.885879 -0.536761
C -1.153350 2.355161 0.917673
C -1.954836 -2.684921 -0.162926
C -5.565437 0.762558 -1.026658
C 2.551370 0.336443 -0.406920
C 3.409646 1.217096 0.312854
C 3.096242 -0.748071 -1.152954
C 4.804698 1.033283 0.249446
C 4.493636 -0.921805 -1.206657
C 5.349540 -0.033548 -0.509274
H -3.685146 2.498542 -0.006439
H -4.330929 -1.692618 -0.901838
H -1.691018 3.308743 0.791969
H -0.203307 2.406770 0.357324
H -0.890565 2.230634 1.982403
H -1.065700 -2.829023 -0.799517
H -1.679151 -3.080603 0.829922
H -2.781529 -3.293669 -0.564819
H -6.250440 -0.094499 -0.907593
H -6.000698 1.627693 -0.497122
H -5.539272 1.016344 -2.104141
H 2.963645 2.027277 0.898837
H 2.412382 -1.423366 -1.676338
H 5.469794 1.713360 0.792764
H 4.918430 -1.749736 -1.784634
H 6.435251 -0.174711 -0.551432


