%chk=000237930.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237930

0 1
S -1.201310 -0.820263 0.334065
N 0.745851 0.978776 0.034520
N 3.129108 0.391469 -0.161976
N 2.420418 2.652605 -0.132123
C -3.590434 0.393357 0.592339
C -4.267395 -0.231829 -0.636363
C -2.132328 0.748709 0.349686
C -5.750217 -0.494573 -0.384751
C 0.477128 -0.344593 0.150652
C 1.459733 -1.340353 0.124413
C 2.797438 -0.924653 -0.040261
C 2.089756 1.309059 -0.100631
C 3.913992 -1.910401 -0.095199
H -3.695635 -0.282556 1.466640
H -4.135945 1.317691 0.881719
H -4.147782 0.434736 -1.513095
H -3.762489 -1.179847 -0.911027
H -1.979481 1.286401 -0.605700
H -1.731275 1.409260 1.143748
H -6.225076 -0.945635 -1.263773
H -6.294302 0.428936 -0.157208
H -5.902341 -1.181432 0.455879
H 1.210701 -2.391294 0.223165
H 4.893962 -1.421661 -0.229588
H 3.968833 -2.499919 0.832116
H 3.782868 -2.614749 -0.929838
H 1.689912 3.334386 -0.264008
H 3.358709 2.917974 -0.391398


%chk=000237930-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237930

0 1
S -1.099748 -0.829255 -1.810119
N 0.409179 0.857568 -0.234084
N 2.603838 0.289991 0.701333
N 1.613130 2.377685 1.083135
C -3.045625 0.722780 -0.362667
C -4.120314 -0.385971 -0.325657
C -2.174416 0.726024 -1.628771
C -4.970303 -0.339221 0.962189
C 0.354059 -0.372064 -0.803953
C 1.393514 -1.324940 -0.659446
C 2.518655 -0.944535 0.113501
C 1.539711 1.135205 0.497247
C 3.684302 -1.884941 0.326420
H -2.388744 0.646466 0.524656
H -3.545308 1.713757 -0.299336
H -4.780511 -0.287264 -1.212089
H -3.623479 -1.372415 -0.410737
H -2.779944 0.740871 -2.552133
H -1.468181 1.571810 -1.626557
H -5.734766 -1.137611 0.969906
H -5.493402 0.631097 1.060475
H -4.335632 -0.470227 1.858866
H 1.332956 -2.311545 -1.124592
H 4.435910 -1.403815 0.970623
H 3.353482 -2.826400 0.802252
H 4.157931 -2.152299 -0.636259
H 0.849332 3.035700 0.957991
H 2.436771 2.613149 1.629809


