%chk=000245182.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245182

0 1
S 1.373482 1.356010 -0.337410
O 6.162751 -0.050504 0.049832
O 4.744614 -1.712671 0.546695
O -5.185721 0.457440 -0.059798
O -4.579644 -1.536384 0.520678
N -4.339832 -0.387626 0.184850
C 2.475008 -0.035906 0.064139
C -0.261729 0.750581 -0.156983
C 3.885887 0.505053 -0.097786
C -1.265932 1.694473 -0.429091
C -0.577399 -0.556226 0.224203
C -2.922305 0.008205 0.065992
C -2.602634 1.323372 -0.317610
C -1.917377 -0.932489 0.337193
C 4.896445 -0.564233 0.208905
H 2.299047 -0.398014 1.097922
H 2.293559 -0.895940 -0.612749
H 4.066959 0.891987 -1.130240
H 4.072909 1.383850 0.566442
H -1.011370 2.714632 -0.726685
H 0.195927 -1.293987 0.436963
H -3.407082 2.039103 -0.523855
H -2.191465 -1.951638 0.634552
H 6.877203 -0.717886 0.240938


%chk=000245182-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245182

0 1
S 1.401212 1.531745 -0.387693
O 6.245581 -0.197089 0.094122
O 4.610711 -1.782918 0.560869
O -5.275441 0.375649 -0.036725
O -4.537804 -1.699789 0.566498
N -4.330699 -0.473625 0.209050
C 2.501654 0.055248 0.035588
C -0.276870 0.853786 -0.185286
C 3.960755 0.513624 -0.099636
C -1.351312 1.749925 -0.445989
C -0.551844 -0.482184 0.206906
C -2.934871 -0.015634 0.073397
C -2.681222 1.320043 -0.318218
C -1.882865 -0.919554 0.336970
C 4.918951 -0.619845 0.222183
H 2.285609 -0.270835 1.065373
H 2.281819 -0.768371 -0.662115
H 4.179654 0.872307 -1.123106
H 4.183879 1.359426 0.577812
H -1.141782 2.781418 -0.748388
H 0.255806 -1.189122 0.412915
H -3.520841 1.991790 -0.513968
H -2.118560 -1.943934 0.637508
H 6.859783 -0.950858 0.309029


