%chk=000249656.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249656

0 1
S 3.694674 1.089292 -0.540501
O -0.522881 0.078723 -1.678822
O 2.712088 -0.212108 0.018252
O -3.659283 -0.372373 -0.030469
O 0.981998 -1.016386 1.988812
O 3.457884 1.131353 -1.960280
O 3.414254 2.234674 0.265592
O -3.890569 1.876592 -0.178320
C -1.344235 -0.373231 -0.656336
C 1.372298 -0.198364 -0.231660
C -2.760998 -0.369729 -1.161732
C -0.888817 -0.746687 0.552368
C 0.535142 -0.696137 0.913427
C 0.838633 0.133524 -1.430583
C 5.208167 0.359492 -0.143380
C -4.150095 0.858758 0.409103
C -4.981001 0.615936 1.614419
H -3.010952 -1.315568 -1.686497
H -2.962082 0.503384 -1.822266
H -1.570331 -1.103871 1.329049
H 1.336620 0.498603 -2.333963
H 5.839930 0.979611 0.515398
H 5.091170 -0.599180 0.401934
H 5.828130 0.114606 -1.021807
H -4.514692 1.070523 2.505763
H -5.120085 -0.457345 1.827607
H -5.978567 1.072008 1.503991


%chk=000249656-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249656

0 1
S 4.071369 1.059229 -0.230850
O -0.395141 0.136467 -1.588644
O 2.879683 -0.630835 -0.140064
O -3.489024 0.201834 0.347450
O 1.166802 -0.710379 2.189528
O 3.582926 1.799623 -1.598601
O 4.260175 1.926511 1.126499
O -5.357715 0.582139 -0.990975
C -1.235439 0.039199 -0.457882
C 1.539658 -0.392392 -0.200101
C -2.659082 0.305429 -0.866984
C -0.743883 -0.254466 0.782228
C 0.694478 -0.475491 1.037114
C 0.962733 -0.072860 -1.424617
C 5.622714 0.009490 -0.542705
C -4.876280 0.374374 0.141308
C -5.613975 0.286238 1.454884
H -2.999215 -0.426015 -1.624648
H -2.762161 1.312990 -1.312993
H -1.435592 -0.305639 1.625478
H 1.524538 0.049987 -2.352187
H 6.450244 0.716377 -0.693447
H 5.744140 -0.604795 0.358973
H 5.400613 -0.593984 -1.431429
H -5.425285 1.198060 2.049568
H -5.257404 -0.573261 2.045586
H -6.693477 0.198270 1.266611


