%chk=000251646.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251646

0 1
S 2.163365 -0.746247 0.045763
O -2.543173 -0.537584 -0.333112
N -0.690538 0.278470 0.794520
N -1.921154 1.599423 -0.848640
C 0.670712 -1.793848 0.215137
C 1.465356 0.905366 -0.332214
C -0.314411 -1.113257 1.173897
C 0.447401 1.233048 0.766364
C 0.090553 -2.097513 -1.149456
C 2.636662 1.865796 -0.349951
C -1.754878 0.379681 -0.148874
H 1.042704 -2.738652 0.688810
H 0.967832 0.871117 -1.330890
H -1.255123 -1.718915 1.237222
H 0.109548 -1.072219 2.203717
H 0.931453 1.208141 1.773516
H 0.065040 2.271039 0.648899
H -0.831488 -2.694384 -1.067797
H -0.191446 -1.194197 -1.706793
H 0.793777 -2.658024 -1.778559
H 2.314290 2.888124 -0.587085
H 3.167434 1.904954 0.611860
H 3.380838 1.583569 -1.110256
H -2.822830 1.719543 -1.298806
H -1.532121 2.455468 -0.485176


%chk=000251646-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251646

0 1
S 2.327483 -0.835873 0.152743
O -2.845728 -0.442101 0.012555
N -0.669363 0.246416 0.538719
N -2.213788 1.713072 -0.550865
C 0.691848 -1.840942 0.205371
C 1.604491 0.857202 -0.354564
C -0.350518 -1.093865 1.068797
C 0.432867 1.221812 0.585866
C 0.190137 -2.181817 -1.207036
C 2.743225 1.885984 -0.286037
C -1.946623 0.459541 0.002601
H 0.994317 -2.759849 0.741286
H 1.234389 0.754984 -1.390572
H -1.296087 -1.663422 1.090492
H 0.034041 -0.991994 2.102762
H 0.826405 1.267860 1.623002
H 0.071232 2.237730 0.341949
H -0.723662 -2.802920 -1.148279
H -0.069277 -1.268521 -1.770826
H 0.959406 -2.731846 -1.774770
H 2.387226 2.879840 -0.619093
H 3.128563 1.982848 0.745460
H 3.584046 1.590533 -0.937440
H -3.157362 1.839841 -0.906846
H -1.547464 2.474386 -0.633177


