%chk=000257376.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257376

0 1
S -0.984309 1.253055 0.638709
O -2.382445 -1.828997 -1.253311
N -3.147239 0.229343 -0.510938
N -3.442080 2.417353 0.401222
C -0.786148 -0.453911 -0.019426
C 0.280656 -0.430314 -1.111134
C -0.484381 -1.413635 1.126553
C -2.175065 -0.798647 -0.671916
C 1.654351 -0.081718 -0.604412
C -1.603341 -1.528675 2.155401
C -2.718007 1.303920 0.120894
C 2.078258 1.255307 -0.569083
C 2.527748 -1.096313 -0.181899
C 3.357228 1.572356 -0.103225
C 3.805649 -0.773501 0.281782
C 4.222564 0.560709 0.324597
H -0.013636 0.272071 -1.923431
H 0.297420 -1.429023 -1.611269
H 0.460301 -1.115299 1.630641
H -0.283235 -2.420385 0.693514
H -1.799469 -0.578803 2.666992
H -2.547305 -1.865104 1.706096
H -1.342851 -2.261145 2.929899
H 1.414018 2.050174 -0.906221
H 2.213648 -2.137802 -0.218421
H 3.680516 2.611833 -0.075619
H 4.479133 -1.564400 0.608461
H -3.042618 3.202484 0.887957
H -4.412389 2.480184 0.119340
H 5.217730 0.810182 0.686447


%chk=000257376-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257376

0 1
S -1.094588 1.410873 0.712127
O -2.294016 -1.872152 -1.222366
N -3.211996 0.200807 -0.549266
N -3.661949 2.354920 0.297041
C -0.817137 -0.366880 0.022489
C 0.282756 -0.346700 -1.088584
C -0.496065 -1.357906 1.170230
C -2.187994 -0.758015 -0.651394
C 1.697646 -0.063553 -0.606524
C -1.599470 -1.502332 2.236609
C -2.829616 1.297954 0.087878
C 2.174352 1.269011 -0.494290
C 2.576990 -1.125767 -0.269976
C 3.487495 1.533403 -0.045412
C 3.892007 -0.865960 0.177025
C 4.351313 0.466229 0.293931
H -0.014643 0.393006 -1.854815
H 0.231298 -1.345498 -1.563977
H 0.458397 -1.062260 1.641788
H -0.327879 -2.338660 0.681465
H -1.802903 -0.538539 2.736437
H -2.542306 -1.871796 1.795059
H -1.285532 -2.226567 3.009261
H 1.511315 2.099935 -0.763213
H 2.231948 -2.162189 -0.370500
H 3.839134 2.568472 0.031973
H 4.557573 -1.699674 0.427609
H -3.356366 3.187331 0.795726
H -4.616816 2.293848 -0.055308
H 5.371753 0.669957 0.637177


