%chk=000207725.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207725

0 1
S -2.146106 -0.072828 1.404402
P -1.175257 0.040967 -0.459961
O -1.269279 -1.466368 -1.082955
O -1.738130 1.055074 -1.368761
O 1.689091 -0.644154 -1.408870
N 0.425711 0.374605 0.202815
C 2.873037 0.766612 0.149281
C 1.648508 0.098842 -0.448634
C 3.269879 0.126689 1.472526
C -3.739606 0.723996 1.016785
C -0.482085 -2.525611 -0.493206
H 2.709737 1.856855 0.268073
H 3.706724 0.673047 -0.584266
H 0.471962 0.968973 1.054420
H 4.188530 0.581947 1.866395
H 3.467817 -0.947905 1.357113
H 2.495623 0.239018 2.240542
H -3.652751 1.524683 0.263915
H -4.125718 1.166103 1.943594
H -4.459593 -0.017585 0.647592
H -0.573212 -2.568740 0.596036
H 0.564135 -2.429917 -0.828228
H -0.935017 -3.421704 -0.946208


%chk=000207725-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207725

0 1
S -2.078743 -0.316424 1.627205
P -1.119042 0.039919 -0.456716
O -1.198423 -1.414956 -1.367810
O -1.759044 1.259959 -1.246688
O 1.742657 -0.399351 -1.765345
N 0.547118 0.195785 0.150992
C 3.019071 0.499056 0.124870
C 1.735380 0.052587 -0.589818
C 2.979465 0.618487 1.662553
C -3.658818 0.680417 1.310689
C -0.563077 -2.648493 -0.857464
H 3.296781 1.472637 -0.325758
H 3.801562 -0.213500 -0.191553
H 0.609507 0.564687 1.106076
H 3.984141 0.870152 2.045009
H 2.671189 -0.329522 2.139341
H 2.302643 1.424352 2.006044
H -3.484659 1.351207 0.451939
H -3.852045 1.269193 2.219332
H -4.487396 -0.009526 1.101273
H -0.892208 -2.865752 0.176542
H 0.534684 -2.561541 -0.920281
H -0.916742 -3.436774 -1.538033


