%chk=000247471.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247471

0 1
S 2.977992 0.350632 -0.937517
O -3.750320 1.278072 -0.622248
O 3.522128 -0.624968 1.466859
N -2.769195 -0.562587 0.366705
C -1.397626 -0.306931 0.057904
C 1.303501 0.077021 -0.485818
C -0.983608 0.834994 -0.653508
C -0.448173 -1.254602 0.500838
C 0.371649 1.026941 -0.916864
C 0.904079 -1.058184 0.223181
C -3.873846 0.250007 0.009057
C -5.193754 -0.288827 0.485812
C 3.982963 -0.088906 0.502491
C 5.396371 0.293250 0.256913
H -1.718861 1.572705 -0.995507
H -0.756035 -2.135358 1.058705
H 0.691172 1.919858 -1.459168
H 1.641823 -1.783518 0.577645
H -2.948099 -1.416380 0.899935
H -5.427233 -1.273725 0.060065
H -6.006133 0.391686 0.175620
H -5.248457 -0.367392 1.579767
H 5.796178 -0.138217 -0.675324
H 6.048360 -0.045132 1.079410
H 5.518723 1.386362 0.174946


%chk=000247471-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247471

0 1
S 3.075650 0.280396 -1.101860
O -3.849077 1.383793 -0.500420
O 3.462172 -0.398628 1.562643
N -2.786790 -0.537449 0.336293
C -1.425568 -0.298059 -0.006058
C 1.318242 0.038318 -0.618309
C -0.988953 0.876108 -0.676589
C -0.477075 -1.295190 0.350992
C 0.381367 1.036392 -0.969259
C 0.886102 -1.134322 0.042719
C -3.904204 0.267451 0.093943
C -5.223942 -0.306155 0.606838
C 4.003539 -0.015863 0.508831
C 5.483860 0.277224 0.344895
H -1.717404 1.641020 -0.949431
H -0.805186 -2.203834 0.871973
H 0.719469 1.948164 -1.472530
H 1.603646 -1.909041 0.323957
H -2.963829 -1.416217 0.827744
H -5.126931 -1.285451 1.107194
H -5.922605 -0.408025 -0.241359
H -5.673831 0.411139 1.314655
H 5.788645 0.306080 -0.713449
H 6.072508 -0.482314 0.886982
H 5.703793 1.261262 0.799506


