%chk=000268940.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268940

0 1
S 1.946433 2.803804 -0.092814
O -1.120881 -2.178329 -0.898326
O -3.381480 0.648705 -0.883170
N -3.823026 -1.141619 0.426983
C -0.678748 0.974214 -0.102867
C -1.565818 -0.142568 0.525897
C 0.702138 0.376281 -0.051848
C -0.766606 -1.480056 0.297614
C 0.662659 -1.024052 0.105591
C -0.725914 2.332863 0.602633
C 1.907132 1.054510 -0.107119
C 0.191388 3.320403 -0.105173
C 1.839293 -1.771630 0.091257
C -2.966047 -0.132327 -0.049834
C 3.103836 0.320329 -0.101502
C 3.063124 -1.071376 -0.020439
C 1.811354 -3.258078 0.198715
H -0.984920 1.106233 -1.177895
H -1.630123 0.031902 1.627544
H -0.900176 -2.173856 1.152782
H -0.443079 2.232932 1.669720
H -1.766908 2.720537 0.595517
H -0.122299 3.473228 -1.156726
H 0.169163 4.312156 0.388321
H 4.064092 0.834136 -0.160662
H 3.995275 -1.633989 -0.036106
H -2.081638 -2.361355 -0.943918
H 2.699992 -3.728498 -0.242267
H 1.755309 -3.581941 1.246934
H 0.935686 -3.676118 -0.326929
H -4.794437 -1.121393 0.144893
H -3.629473 -1.670650 1.257996


%chk=000268940-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268940

0 1
S 2.021964 2.903204 -0.139157
O -1.186595 -2.024009 -1.133799
O -3.539565 0.806051 -0.561515
N -3.755978 -1.220494 0.542031
C -0.688931 0.992302 -0.104897
C -1.540039 -0.133498 0.541910
C 0.703621 0.389310 -0.056201
C -0.786377 -1.471941 0.178079
C 0.659357 -1.015713 0.080770
C -0.751680 2.382439 0.555735
C 1.931247 1.072964 -0.096621
C 0.170490 3.372076 -0.181061
C 1.833301 -1.803083 0.114735
C -3.013694 -0.115417 0.124757
C 3.124810 0.309915 -0.047780
C 3.066450 -1.100968 0.040871
C 1.779440 -3.315276 0.225164
H -1.013786 1.102478 -1.159624
H -1.487602 -0.027297 1.647050
H -0.935988 -2.247811 0.961981
H -0.461966 2.318039 1.622956
H -1.786672 2.770115 0.502686
H -0.119108 3.460602 -1.241334
H 0.146837 4.370938 0.285089
H 4.098658 0.811794 -0.075987
H 4.004750 -1.668152 0.064965
H -2.158639 -2.232947 -1.103485
H 2.786831 -3.758345 0.146465
H 1.347826 -3.637798 1.193299
H 1.147089 -3.744977 -0.572582
H -4.754724 -1.239048 0.330708
H -3.376024 -1.911055 1.189596


