%chk=000234760.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234760

0 1
S 1.649615 -1.882970 0.043868
S -2.630408 -1.344684 1.205952
O 2.396942 -2.594033 1.061341
O 1.453391 -2.468988 -1.250918
O -4.993722 1.080758 -0.845105
O -5.519688 -0.187051 0.926054
N 0.054838 -1.888545 0.859030
N -1.042251 -0.350134 -0.633562
N 3.305822 3.745130 -0.223423
C 2.112048 -0.264911 -0.033010
C 2.879678 0.300280 1.004269
C 1.749581 0.532807 -1.136636
C -1.035427 -1.207957 0.416607
C 2.905026 2.424486 -0.158386
C 3.278046 1.623671 0.958348
C 2.136718 1.861183 -1.211187
C -3.279168 -0.208039 0.063711
C -2.301456 0.196825 -0.825110
C -4.664267 0.168735 0.146109
H -0.066139 -2.509502 1.675678
H 3.171763 -0.323188 1.859919
H 1.152269 0.094874 -1.949991
H 3.871808 2.046960 1.762990
H 1.849371 2.464580 -2.067484
H -2.448792 0.901916 -1.645841
H 3.813701 4.176708 0.527434
H 3.020187 4.342021 -0.978893
H -5.951688 1.342767 -0.800763


%chk=000234760-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234760

0 1
S 1.427966 -1.670278 0.109741
S -2.983563 -1.610972 1.221428
O 2.283774 -2.613871 1.120212
O 0.957357 -2.177883 -1.353591
O -5.543094 0.528501 -1.121715
O -6.026447 -0.996504 0.579978
N -0.170708 -1.365612 1.221032
N -1.421007 -0.062636 -0.351285
N 4.086192 3.727814 -0.278004
C 2.215980 -0.001447 -0.000219
C 3.254636 0.294552 0.903154
C 1.766692 0.899310 -0.984813
C -1.341314 -0.960183 0.644503
C 3.465082 2.491894 -0.183258
C 3.882718 1.545695 0.804647
C 2.400083 2.147649 -1.074514
C -3.725152 -0.495219 0.001492
C -2.732794 0.180916 -0.709209
C -5.173132 -0.382424 -0.109905
H -0.180313 -2.098899 1.944022
H 3.569727 -0.445107 1.645813
H 0.936657 0.631335 -1.644536
H 4.700395 1.797085 1.489299
H 2.069946 2.867888 -1.831259
H -2.953821 0.893057 -1.504701
H 4.842060 3.983938 0.351273
H 3.796184 4.406457 -0.976839
H -6.536306 0.558639 -1.161744


