%chk=000295762.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295762

0 1
S 3.921443 1.321643 0.402744
O -2.534484 1.339535 -0.115092
O -2.521426 -0.699885 0.843380
N 0.236783 -2.030864 -0.160603
N 1.876510 -0.408487 0.181346
N 1.379820 1.973184 0.210425
C 0.503220 -0.711830 0.069038
C -0.446716 0.358015 0.162469
C -1.104264 -2.543622 -0.503111
C 1.327291 -3.037351 -0.126434
C 0.069698 1.685408 0.173134
C -1.883253 0.204983 0.342413
C 2.231204 0.881863 0.254641
C -3.986053 1.402922 0.043449
C -4.656140 0.610706 -1.060663
C 4.782649 -0.258482 0.449727
H -1.042939 -3.554765 -0.934795
H -1.604328 -1.894035 -1.243958
H -1.756017 -2.586241 0.399590
H 2.061379 -2.801582 0.669568
H 1.875018 -3.047175 -1.085681
H 0.924224 -4.041786 0.074440
H -0.627629 2.541150 0.164445
H -4.250242 1.034994 1.051154
H -4.155663 2.492210 -0.037579
H -5.738503 0.782965 -1.077414
H -4.257609 0.882227 -2.046789
H -4.493630 -0.468445 -0.927587
H 4.595689 -0.854734 -0.453308
H 4.479364 -0.864742 1.313404
H 5.858204 -0.052081 0.521749


%chk=000295762-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295762

0 1
S 4.019003 1.353997 0.405411
O -2.574724 1.341007 -0.197852
O -2.372705 -0.708793 0.906106
N 0.279170 -2.018912 -0.212145
N 1.909884 -0.383885 0.157278
N 1.468706 1.997242 -0.093302
C 0.572878 -0.690227 -0.012575
C -0.396933 0.388849 -0.032943
C -0.983327 -2.485343 -0.809428
C 1.295349 -3.061231 0.032016
C 0.145665 1.703316 -0.142269
C -1.836548 0.235947 0.263519
C 2.280872 0.909217 0.134430
C -4.023231 1.366430 0.163378
C -4.857014 0.613490 -0.877475
C 4.776511 -0.345806 0.665082
H -0.772959 -3.400313 -1.390630
H -1.386164 -1.722029 -1.497150
H -1.750842 -2.692213 -0.043624
H 2.119967 -2.636220 0.619420
H 1.706658 -3.445406 -0.922016
H 0.829773 -3.898873 0.582374
H -0.539477 2.550546 -0.234959
H -4.145382 0.926315 1.168747
H -4.265716 2.441309 0.185694
H -5.932779 0.725630 -0.646341
H -4.677791 1.015147 -1.889789
H -4.613832 -0.462218 -0.868913
H 4.581273 -0.976635 -0.213737
H 4.350727 -0.812776 1.564550
H 5.856590 -0.171863 0.791246


