%chk=000257397.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257397

0 1
S -0.814240 1.477721 -0.113664
O -1.186707 1.695528 -1.488960
O -0.414856 2.593041 0.715070
O 0.641528 -1.913514 -1.197006
O -3.482761 -1.294290 0.467039
N -1.369390 -1.451826 -0.316250
C 0.478127 0.237221 -0.059606
C 0.946953 0.054778 1.400989
C 1.639242 0.777649 -0.928268
C 2.214866 -0.805780 1.499094
C 2.912701 -0.069567 -0.807539
C 3.351063 -0.217603 0.653450
C -0.005366 -1.093049 -0.590736
C -2.159753 0.679608 0.714536
C -2.426517 -0.726640 0.302942
H 0.147336 -0.399661 2.016366
H 1.158663 1.057322 1.840895
H 1.874702 1.820461 -0.622247
H 1.323620 0.820877 -1.993016
H 2.000370 -1.840773 1.163136
H 2.528388 -0.884593 2.557511
H 3.721253 0.389857 -1.406774
H 2.734870 -1.074274 -1.251029
H 3.660489 0.764215 1.060820
H 4.243594 -0.869182 0.715281
H -3.106117 1.266320 0.568495
H -2.052833 0.734043 1.824065
H -1.635724 -2.401091 -0.648993


%chk=000257397-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257397

0 1
S -0.870244 1.583407 -0.135614
O -1.359965 1.821415 -1.672751
O -0.365611 2.831873 0.793080
O 0.532353 -1.924178 -1.389029
O -3.612485 -1.313607 0.455263
N -1.434882 -1.448406 -0.301088
C 0.557229 0.139289 -0.095828
C 0.958984 0.007755 1.389497
C 1.689503 0.698315 -0.976483
C 2.270103 -0.812879 1.531655
C 3.016409 -0.086409 -0.790033
C 3.411936 -0.188299 0.699533
C -0.096477 -1.117669 -0.654851
C -2.272226 0.657816 0.825327
C -2.493846 -0.753673 0.321030
H 0.156338 -0.465102 1.986736
H 1.121826 1.030292 1.785691
H 1.854295 1.754818 -0.681594
H 1.382267 0.688514 -2.036407
H 2.101271 -1.856831 1.201749
H 2.542113 -0.849869 2.603144
H 3.807635 0.430828 -1.364225
H 2.902212 -1.097831 -1.218311
H 3.646499 0.820554 1.096754
H 4.328605 -0.798156 0.804579
H -3.183452 1.258049 0.686595
H -1.946340 0.685734 1.877027
H -1.720550 -2.368950 -0.665846


