%chk=000280851.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280851

0 1
S 1.230590 0.437400 0.783055
P -0.268447 -0.584228 -0.264007
O -1.456221 0.499473 -0.583631
O 0.207297 -1.240453 -1.503934
N -0.914017 -1.595450 1.018387
C 2.524697 0.606867 -0.533867
C -2.116877 1.166419 0.537101
C 3.844748 0.697887 0.191287
C -3.214831 1.960457 -0.147095
H 2.493353 -0.255790 -1.234367
H 2.303333 1.519430 -1.119522
H -2.523061 0.415288 1.240725
H -1.385099 1.823319 1.044795
H 3.891097 1.552185 0.881276
H 4.062546 -0.205982 0.778566
H 4.672985 0.819726 -0.523116
H -3.778154 2.568760 0.567944
H -2.796607 2.627927 -0.914493
H -3.918688 1.296897 -0.668158
H -0.243851 -1.970968 1.700048
H -1.517595 -2.370663 0.713807


%chk=000280851-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280851

0 1
S 1.268077 1.039325 1.074227
P -0.037602 -0.433572 -0.115988
O -1.525675 0.323657 -0.603323
O 0.700363 -1.048458 -1.388549
N -0.581949 -1.436662 1.178834
C 2.681376 1.168259 -0.212256
C -2.199009 1.264728 0.336718
C 3.741664 0.079341 -0.023866
C -3.514371 1.659132 -0.329635
H 2.212407 1.101816 -1.207745
H 3.078667 2.186393 -0.062449
H -2.362577 0.759065 1.308778
H -1.537753 2.138013 0.495414
H 4.161685 0.092307 0.997020
H 3.309760 -0.915805 -0.224015
H 4.570979 0.239345 -0.740094
H -4.057194 2.380899 0.308585
H -3.325624 2.128388 -1.309771
H -4.156182 0.775366 -0.485187
H 0.073354 -1.702867 1.913678
H -1.403197 -2.030172 1.054423


