%chk=000219307.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219307

0 1
S -2.019423 1.313197 -0.100484
O 0.549118 -2.923043 -0.678305
O 3.049485 2.348185 0.449451
N 0.633846 1.065674 0.045122
N -0.599621 -0.946271 -0.405241
C -0.551734 0.337792 -0.170810
C -3.341065 0.087226 -0.416043
C 1.845124 0.353580 0.003851
C 1.862902 -0.980116 -0.234696
C -4.633633 0.865867 -0.367417
C 0.602214 -1.736903 -0.461195
C 3.103937 1.160098 0.239086
H -3.172030 -0.403933 -1.396460
H -3.296067 -0.718587 0.345376
H 0.649825 2.074177 0.227523
H 2.778021 -1.567572 -0.274673
H -4.810627 1.337997 0.609605
H -4.685847 1.654072 -1.132140
H -5.489788 0.196843 -0.550202
H 4.042464 0.586016 0.202451


%chk=000219307-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219307

0 1
S -2.002686 1.450791 -0.077428
O 0.504518 -2.961912 -0.678281
O 3.090903 2.366623 0.448837
N 0.679683 1.063576 0.045962
N -0.611922 -0.903718 -0.395396
C -0.524453 0.389704 -0.160294
C -3.340787 0.138066 -0.416685
C 1.872435 0.344815 0.004774
C 1.854085 -1.014523 -0.236791
C -4.714320 0.817467 -0.376975
C 0.568802 -1.720329 -0.454051
C 3.113537 1.124757 0.231821
H -3.105044 -0.303216 -1.396760
H -3.219749 -0.638614 0.353287
H 0.733295 2.073065 0.228078
H 2.781315 -1.593415 -0.272461
H -4.922884 1.265263 0.610401
H -4.806093 1.605054 -1.145310
H -5.493340 0.059157 -0.575727
H 4.059806 0.541688 0.197797


