%chk=000268704.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268704

0 1
S -3.804275 -1.448992 0.002049
O 3.405245 -0.387622 -0.000469
O 2.232643 1.579506 -0.001786
N 1.186905 -0.561693 0.000503
N -0.087800 -0.066621 -0.000003
C 4.664668 0.381055 -0.001625
C -2.432444 -0.356756 0.000126
C -2.868585 0.938347 -0.001810
C 5.728331 -0.693435 -0.001536
C -4.308465 1.054951 -0.001752
C -1.091844 -0.907998 0.000752
C -4.954621 -0.142343 0.000231
C 2.247768 0.376237 -0.000553
H 4.668993 1.012201 -0.907268
H 4.669948 1.013297 0.903245
H -2.214401 1.804352 -0.003248
H 6.733888 -0.254341 -0.002309
H 5.644484 -1.343793 0.880545
H 5.643582 -1.344836 -0.882760
H -4.794690 2.022434 -0.003174
H -1.015595 -2.006891 0.001730
H -6.013595 -0.334254 0.000712
H 1.409060 -1.565506 0.001301


%chk=000268704-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268704

0 1
S -3.833755 -1.534099 0.001658
O 3.419453 -0.430317 -0.001540
O 2.285232 1.643004 -0.003602
N 1.171542 -0.457463 -0.001590
N -0.105664 0.063021 -0.001493
C 4.719172 0.300213 -0.001804
C -2.474414 -0.330060 -0.000064
C -2.972055 0.974881 -0.001066
C 5.818811 -0.756402 0.000075
C -4.405827 1.045187 -0.000491
C -1.104040 -0.802841 -0.000221
C -5.026493 -0.197882 0.000957
C 2.277502 0.396228 -0.002855
H 4.755840 0.946743 -0.897335
H 4.754958 0.948997 0.892129
H -2.306140 1.840401 -0.002165
H 6.807788 -0.263032 -0.000070
H 5.750993 -1.396402 0.896328
H 5.751875 -1.398692 -0.894607
H -4.964480 1.984100 -0.001119
H -0.942685 -1.899243 0.000739
H -6.087819 -0.438195 0.001663
H 1.359407 -1.470846 -0.000625


