%chk=000265924.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265924

0 1
S -1.922287 -1.605412 -0.416284
O -3.304047 -1.404502 -0.801552
O -1.522024 -2.928941 -0.002929
O 3.827323 0.374497 0.456617
N 1.059597 -0.073218 -0.080163
C -0.358687 0.203657 -0.489587
C -1.306591 -0.317658 0.659769
C -0.800908 -0.851977 -1.557849
C -0.574226 1.649476 -0.976524
C -2.394223 0.584439 1.222529
C -1.968866 2.192587 -0.663408
C -2.250447 2.060300 0.835560
C 2.045237 0.101164 -1.197545
C 1.494894 0.741737 1.102502
C 3.420306 -0.379265 -0.703392
C 2.884750 0.253458 1.541440
H -0.700907 -0.721163 1.502969
H -1.252720 -0.418971 -2.457814
H 0.012965 -1.499602 -1.916757
H -0.379491 1.709637 -2.064479
H 0.178824 2.320430 -0.510358
H -2.410059 0.496387 2.327976
H -3.400576 0.234034 0.889741
H -2.739722 1.647846 -1.245651
H -2.041517 3.250407 -0.979188
H -1.439299 2.534404 1.420127
H -3.176389 2.605788 1.101483
H 2.120858 1.152808 -1.548197
H 1.721438 -0.514555 -2.063935
H 0.764529 0.598477 1.928081
H 1.527831 1.832015 0.881971
H 3.412088 -1.454660 -0.450663
H 4.224984 -0.158411 -1.425935
H 3.329681 0.900794 2.317015
H 2.861082 -0.797106 1.882333


%chk=000265924-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265924

0 1
S -1.991944 -1.700673 -0.371969
O -3.543455 -1.356678 -0.785434
O -1.552921 -3.220303 0.029506
O 3.947389 0.316940 0.459709
N 1.109676 -0.028112 -0.079133
C -0.320223 0.234545 -0.459105
C -1.243970 -0.199962 0.756140
C -0.738328 -0.808375 -1.556954
C -0.580894 1.694581 -0.951123
C -2.393224 0.665575 1.276691
C -2.039192 2.161206 -0.753225
C -2.388506 2.123178 0.748261
C 2.091530 0.186876 -1.181933
C 1.588773 0.697461 1.131795
C 3.464915 -0.360600 -0.754351
C 2.965559 0.144088 1.541811
H -0.670889 -0.734126 1.528405
H -1.303005 -0.416053 -2.414333
H 0.038858 -1.532338 -1.834480
H -0.283598 1.777281 -2.013883
H 0.075159 2.384468 -0.384548
H -2.401807 0.653267 2.381549
H -3.345452 0.199121 0.940436
H -2.744749 1.517471 -1.316428
H -2.150529 3.188110 -1.148788
H -1.654825 2.739290 1.305858
H -3.385619 2.564521 0.928712
H 2.201816 1.268653 -1.433568
H 1.759854 -0.341703 -2.094058
H 0.880129 0.555352 1.967250
H 1.689501 1.795313 0.952026
H 3.388701 -1.453644 -0.571656
H 4.228210 -0.162350 -1.524798
H 3.375127 0.699165 2.401746
H 2.871334 -0.932647 1.797778


