%chk=000294592.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294592

0 1
S -0.708259 1.063163 0.615733
O -0.426753 -1.331180 -1.262090
O -1.573547 -2.111867 0.506262
N -3.818377 -0.967005 -1.057830
N 2.979558 0.801400 1.118729
C -2.487734 0.887225 0.149758
C -2.517213 -0.282140 -0.875213
C -3.031084 2.169708 -0.448007
C -3.155301 0.532364 1.468567
C 0.130764 1.664957 -0.891815
C 1.561686 1.972674 -0.478944
C -1.509703 -1.334438 -0.413024
C 2.346420 0.746558 -0.087055
C 2.454078 -0.374341 -0.936837
C 3.219208 -1.464168 -0.519767
C 3.716080 -0.270264 1.510560
C 3.860587 -1.422897 0.722193
H -2.205020 0.096401 -1.891344
H -4.110916 2.104392 -0.636593
H -2.885215 3.022458 0.232715
H -2.556470 2.435759 -1.400283
H -2.805817 -0.438167 1.864079
H -4.245889 0.474425 1.376963
H -2.949697 1.279881 2.249809
H -0.371329 2.568926 -1.279193
H 0.085663 0.883624 -1.677860
H 1.575449 2.713407 0.358840
H 2.092220 2.481515 -1.315294
H -4.544877 -0.295498 -1.287882
H -4.102158 -1.452975 -0.207588
H 1.944495 -0.384115 -1.897882
H 0.293672 -1.950629 -0.959849
H 3.320615 -2.340951 -1.159163
H 4.199646 -0.184440 2.490872
H 4.457017 -2.260760 1.071533


%chk=000294592-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294592

0 1
S -0.682480 1.197578 0.776879
O -0.558194 -1.593268 -1.187523
O -2.028176 -2.288897 0.468575
N -3.902364 -0.771240 -1.164461
N 3.110543 0.873382 1.078997
C -2.515280 0.891053 0.232444
C -2.564931 -0.260485 -0.852039
C -3.120895 2.182235 -0.353329
C -3.225543 0.497190 1.545423
C 0.171741 1.677046 -0.850079
C 1.658385 1.989843 -0.565876
C -1.721161 -1.463847 -0.419573
C 2.486613 0.786540 -0.137673
C 2.621678 -0.358056 -0.968897
C 3.414957 -1.440459 -0.533236
C 3.869896 -0.184683 1.491031
C 4.052369 -1.358726 0.727545
H -2.123301 0.137485 -1.782245
H -4.187603 2.024294 -0.608890
H -3.064166 3.000087 0.385001
H -2.596470 2.507942 -1.270351
H -2.812897 -0.432764 1.970671
H -4.305645 0.346972 1.360053
H -3.119836 1.305137 2.290824
H -0.326978 2.572366 -1.258753
H 0.071562 0.835836 -1.555581
H 1.744722 2.756533 0.223372
H 2.088835 2.419019 -1.494084
H -4.520937 -0.163112 -1.698918
H -4.345916 -1.336471 -0.438969
H 2.113552 -0.391542 -1.938640
H -0.014252 -2.348969 -0.832460
H 3.542243 -2.326933 -1.164908
H 4.346197 -0.073126 2.472219
H 4.675530 -2.174956 1.106551


