%chk=000296066.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296066

0 1
S -1.648330 1.705175 -0.022275
O -1.877980 2.545275 -1.193854
O -1.530932 2.319130 1.297631
O 5.776417 -0.465112 1.240928
O 5.757896 -0.051076 -0.990241
N 3.229878 -1.538968 -1.035306
N -5.957214 -2.351797 0.207105
C -0.208128 0.785962 -0.303530
C -2.910839 0.530461 0.046410
C 0.564542 0.343874 0.774362
C 0.209932 0.514856 -1.611991
C 2.130347 -0.691658 -0.755852
C 1.727085 -0.393540 0.563994
C 1.366590 -0.218707 -1.851412
C -3.271214 -0.045165 1.271373
C -3.607884 0.177495 -1.116127
C -4.292240 -0.984869 1.345372
C -4.633647 -0.759065 -1.076465
C -4.978088 -1.355373 0.161999
C 4.269626 -1.752597 -0.016638
C 5.331007 -0.659719 -0.041289
C 6.810536 0.539927 1.434641
H 0.261547 0.590016 1.799468
H -0.371505 0.896999 -2.459660
H 2.315165 -0.731327 1.413879
H 1.679240 -0.422424 -2.872235
H -2.750354 0.258076 2.187722
H -3.350685 0.655231 -2.069414
H 3.616237 -1.463586 -1.983138
H -4.558594 -1.429669 2.298857
H -5.162352 -1.030355 -1.984708
H 3.823055 -1.841653 1.006054
H 4.767147 -2.735724 -0.215472
H -6.349112 -2.612338 1.096862
H -6.584023 -2.457060 -0.573424
H 6.428920 1.518712 1.125734
H 7.699849 0.268643 0.857770
H 6.988404 0.491549 2.514369


%chk=000296066-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296066

0 1
S -1.620944 1.717516 -0.197421
O -1.974293 2.541069 -1.573123
O -1.399353 2.440923 1.259953
O 5.593706 -0.658860 1.457324
O 5.833099 0.309210 -0.653157
N 3.486603 -1.376241 -1.374316
N -6.160171 -2.246067 0.581189
C -0.050494 0.741635 -0.549829
C -2.998519 0.459250 0.037029
C 0.782797 0.395748 0.524801
C 0.280344 0.454229 -1.886686
C 2.329831 -0.647313 -1.078401
C 1.978686 -0.301095 0.262025
C 1.468762 -0.247525 -2.146670
C -3.271457 -0.007624 1.334417
C -3.763698 0.081995 -1.080098
C -4.329159 -0.916689 1.515451
C -4.821118 -0.826965 -0.897153
C -5.114788 -1.345114 0.401555
C 4.471760 -1.753617 -0.374367
C 5.361092 -0.579655 0.085150
C 6.479577 0.391927 2.025070
H 0.515436 0.699647 1.542543
H -0.368665 0.798152 -2.698826
H 2.639711 -0.552843 1.096691
H 1.744262 -0.485846 -3.181056
H -2.683130 0.358871 2.182354
H -3.548784 0.516927 -2.061969
H 3.777311 -1.410200 -2.350664
H -4.560109 -1.291541 2.519460
H -5.431924 -1.132444 -1.754797
H 3.992238 -2.207934 0.508878
H 5.143084 -2.518424 -0.806724
H -6.387881 -2.603878 1.504231
H -6.734545 -2.542026 -0.202647
H 6.039100 1.387811 1.853197
H 7.474076 0.345871 1.550791
H 6.537855 0.160718 3.097292


