%chk=000239585.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239585

0 1
S 2.193132 -0.955506 -0.129596
O 1.813781 -2.336987 -0.337043
O 3.182914 -0.326880 -0.983040
O -4.020110 0.214737 -0.066538
O -3.155330 -1.846213 -0.138569
N 2.850077 -0.859553 1.459726
C 0.760298 0.001566 -0.047528
C 0.806226 1.403800 0.057429
C -0.472335 -0.659494 -0.096807
C -1.666919 0.069451 -0.040286
C -0.402810 2.130779 0.110642
C -1.625321 1.475644 0.062086
C 2.097150 2.135952 0.120135
C -2.946396 -0.655995 -0.088536
H -0.513381 -1.759746 -0.184713
H -0.373435 3.217485 0.190209
H -2.565671 2.037436 0.102465
H 2.613472 1.964294 1.079972
H 2.805950 1.809330 -0.672858
H 1.990283 3.223178 0.007472
H 2.676760 -1.634601 2.097118
H 3.822347 -0.571657 1.552818
H -4.890781 -0.266820 -0.100959


%chk=000239585-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239585

0 1
S 2.249831 -1.032678 -0.118497
O 1.744300 -2.571923 -0.274151
O 3.345122 -0.404068 -1.143405
O -4.117172 0.204857 -0.087193
O -3.127043 -1.896768 -0.165972
N 2.991187 -0.764975 1.557432
C 0.694973 0.055314 -0.019180
C 0.808153 1.465746 0.071000
C -0.513071 -0.646475 -0.080711
C -1.719674 0.095641 -0.047019
C -0.425453 2.172347 0.098833
C -1.666855 1.508912 0.041518
C 2.128294 2.198305 0.144300
C -3.004830 -0.651177 -0.106524
H -0.532961 -1.739276 -0.161632
H -0.396581 3.265007 0.168044
H -2.602468 2.074168 0.063404
H 2.712892 1.847519 1.014748
H 2.743906 1.995470 -0.749873
H 1.968219 3.284481 0.234928
H 2.626751 -1.485977 2.203834
H 4.018171 -0.820867 1.441180
H -4.945790 -0.343386 -0.131467


