%chk=000201906.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201906

0 1
S 2.533678 0.757318 -0.779524
O -0.293028 1.298591 -1.114137
O -3.196225 -1.391366 0.616311
N -1.160800 -0.283498 0.493987
C -0.122765 -0.013743 -0.538545
C -0.440530 -0.987923 -1.708722
C -1.714611 -1.743031 -1.310378
C -1.447597 0.783637 1.481830
C -2.176861 -1.150483 0.010868
C -1.630907 2.132147 0.767661
C 1.261204 -0.140619 0.000215
C -0.455472 2.389931 -0.175683
C 1.759300 -0.890075 1.022199
C 3.189037 -0.743891 1.182719
C 3.750696 0.109744 0.283537
H 0.402157 -1.674634 -1.898065
H -0.584997 -0.401546 -2.638857
H -1.539248 -2.830027 -1.200342
H -2.515204 -1.639879 -2.067654
H -0.598206 0.825451 2.199886
H -2.361702 0.507215 2.057197
H -2.579890 2.126034 0.193306
H -1.725422 2.950395 1.504532
H -0.634581 3.239318 -0.859932
H 0.493391 2.533594 0.369943
H 1.169108 -1.534525 1.662217
H 3.728232 -1.277915 1.953762
H 4.784343 0.392479 0.183768


%chk=000201906-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201906

0 1
S 2.633079 0.671082 -0.906746
O -0.341777 1.482887 -1.214240
O -3.022763 -1.634032 0.742136
N -1.226186 -0.164996 0.337386
C -0.186986 0.113088 -0.666538
C -0.521285 -0.873104 -1.830679
C -1.472207 -1.928721 -1.214162
C -1.486637 0.809444 1.408079
C -2.033986 -1.265950 0.051693
C -1.615770 2.223192 0.791328
C 1.201851 -0.061914 -0.074090
C -0.419815 2.505858 -0.138841
C 1.597532 -0.818764 1.018078
C 3.026470 -0.837023 1.230031
C 3.727354 -0.095465 0.293987
H 0.392230 -1.307597 -2.262848
H -1.034320 -0.281284 -2.607392
H -0.940842 -2.853361 -0.922420
H -2.299798 -2.220121 -1.880278
H -0.658762 0.789973 2.144071
H -2.412824 0.491230 1.916780
H -2.554681 2.290555 0.212428
H -1.650580 2.982465 1.595623
H -0.529773 3.460571 -0.677208
H 0.531705 2.519317 0.433004
H 0.882159 -1.352449 1.649546
H 3.509829 -1.377509 2.047524
H 4.799883 0.075325 0.215849


