%chk=000258149.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258149

0 1
S -0.237370 -2.291028 -0.053764
N 2.404925 -1.558610 -0.012383
N 3.002894 0.796333 0.025645
N 1.415118 2.522548 0.123179
C -1.594600 1.514689 0.080821
C -0.801472 0.248588 0.008979
C -3.061769 1.279470 -0.323017
C -3.640371 0.025681 0.349233
C -2.857617 -1.241274 -0.050117
C -1.401242 -0.974422 -0.024407
C 0.647764 0.170533 0.008328
C 1.107542 -1.174123 -0.015816
C 1.670475 1.162719 0.033940
C 3.307021 -0.534136 0.014432
H -1.547555 1.904553 1.121802
H -1.152561 2.297406 -0.568474
H -3.668933 2.164701 -0.058088
H -3.129398 1.174003 -1.423871
H -4.705793 -0.092484 0.079146
H -3.610497 0.145489 1.450064
H -3.160910 -1.568094 -1.069341
H -3.127581 -2.076469 0.629368
H 4.377220 -0.798510 0.018623
H 0.507117 2.870984 -0.146723
H 2.190693 3.165056 0.020940


%chk=000258149-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258149

0 1
S -0.220588 -2.368587 -0.065539
N 2.446659 -1.562670 -0.045913
N 3.022699 0.804968 0.039435
N 1.452016 2.516717 0.137994
C -1.618201 1.537237 -0.029710
C -0.793553 0.256585 -0.018281
C -3.107904 1.268295 -0.366117
C -3.650131 0.037184 0.395204
C -2.891393 -1.246255 -0.030892
C -1.406580 -0.984148 -0.040457
C 0.659238 0.164984 -0.000560
C 1.145653 -1.176489 -0.036023
C 1.696468 1.162619 0.057017
C 3.327558 -0.522526 -0.015816
H -1.549493 2.037290 0.960306
H -1.211483 2.242907 -0.783148
H -3.708177 2.166251 -0.128639
H -3.208972 1.088841 -1.454820
H -4.731551 -0.089328 0.202821
H -3.525951 0.192562 1.484778
H -3.228129 -1.565412 -1.038920
H -3.133348 -2.079134 0.656816
H 4.390929 -0.778081 -0.031900
H 0.514093 2.898797 0.189610
H 2.263242 3.130994 0.181253


