%chk=000295784.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295784

0 1
S 1.629784 -1.005273 -0.040663
S -3.612560 0.245861 0.305642
O 2.213337 3.232036 -0.406958
O 3.005531 1.130374 -0.332492
N -0.974186 -0.288621 0.127749
N -1.708194 2.036303 0.010445
C 0.848723 -2.667546 0.181308
C 1.884346 -3.627688 -0.375174
C 0.554820 -2.880170 1.652238
C 0.312851 0.127738 -0.011963
C 0.640304 1.499696 -0.146975
C -0.422994 2.431512 -0.128381
C -1.932014 0.684862 0.131775
C 2.043579 1.866643 -0.297453
C -3.587028 -1.548717 0.418449
H -0.093807 -2.708899 -0.415908
H 1.533738 -4.666326 -0.294149
H 2.096123 -3.445359 -1.438116
H 2.842370 -3.579397 0.161429
H 0.164016 -3.889701 1.836690
H -0.200014 -2.170588 2.020919
H 1.446082 -2.763168 2.283076
H -0.229706 3.511479 -0.227674
H -2.978595 -1.903171 1.262172
H -3.183205 -2.013964 -0.491398
H -4.620625 -1.891373 0.560790
H 3.170823 3.482455 -0.510077


%chk=000295784-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295784

0 1
S 1.772774 -1.053788 -0.051370
S -3.553942 0.130719 0.278654
O 2.096092 3.525231 -0.400242
O 3.144856 1.451604 -0.369111
N -0.840561 -0.258612 0.107269
N -1.686993 2.025457 0.006960
C 0.774528 -2.681023 0.226498
C 1.624878 -3.811063 -0.377549
C 0.478216 -2.869567 1.722527
C 0.446485 0.178018 -0.028359
C 0.720405 1.583087 -0.157621
C -0.406866 2.452743 -0.127878
C -1.835022 0.665427 0.115946
C 2.082627 2.120445 -0.313401
C -3.342490 -1.735055 0.370430
H -0.162847 -2.535119 -0.334841
H 1.097030 -4.774680 -0.249171
H 1.803354 -3.656059 -1.455657
H 2.604665 -3.896657 0.127318
H -0.091682 -3.806932 1.876435
H -0.120820 -2.032262 2.118119
H 1.413013 -2.938757 2.307220
H -0.253684 3.531333 -0.217747
H -2.697370 -1.996660 1.220498
H -2.903493 -2.107274 -0.565886
H -4.357827 -2.136820 0.511358
H 3.038173 3.825262 -0.505099


