%chk=000277702.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277702

0 1
S 1.524182 1.022711 -0.408371
O -4.413258 -0.218769 -0.484133
O -3.920058 1.745887 0.469847
O 4.889526 -0.829075 -0.095678
O 4.268024 0.970026 -1.138983
N 4.061379 0.001280 -0.424450
C -2.234922 -1.267487 -0.564569
C -2.137177 0.095607 0.046177
C -3.724983 -1.439104 -0.909951
C -1.059415 0.745148 0.497788
C -3.519087 0.688238 0.070383
C 0.283888 0.200156 0.484867
C 0.781684 -0.920674 1.107917
C 2.707369 -0.149372 0.055958
C 2.176312 -1.124837 0.867387
H -1.592094 -1.354665 -1.463993
H -1.883379 -2.052369 0.133812
H -3.926737 -1.519548 -1.990297
H -4.221285 -2.253838 -0.358850
H -1.158381 1.762444 0.913680
H 0.197930 -1.583675 1.734566
H 2.742582 -1.955582 1.280693


%chk=000277702-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277702

0 1
S 1.726086 1.392459 0.171062
O -4.519956 -0.137906 -0.265061
O -3.675571 2.021490 -0.012949
O 5.057383 -0.803265 0.330897
O 4.694724 1.467803 0.305562
N 4.285634 0.236645 0.291295
C -2.436696 -1.429260 -0.174525
C -2.171912 0.053717 -0.073594
C -3.973348 -1.516224 -0.417931
C -0.997860 0.754787 0.039791
C -3.470418 0.797694 -0.107712
C 0.340564 0.215390 0.104140
C 0.810246 -1.114057 0.133068
C 2.863537 0.007812 0.226086
C 2.226864 -1.231580 0.202222
H -1.870662 -1.898180 -1.000239
H -2.149982 -1.950626 0.758941
H -4.221068 -1.849306 -1.439292
H -4.495000 -2.150071 0.315676
H -1.109701 1.848233 0.086850
H 0.149812 -1.981191 0.115573
H 2.779423 -2.171858 0.233940