%chk=000289416.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289416

0 1
S 1.428767 0.211475 0.805342
O 4.027036 0.228765 0.876376
O 0.646862 -1.625648 -1.074872
O -1.196696 -2.722465 -0.445653
C -0.245278 0.639474 0.419942
C -1.092593 -0.309582 -0.162167
C 2.279982 0.683028 -0.741787
C -0.730106 1.895132 0.785906
C -2.445331 0.000408 -0.376057
C 3.701270 0.187483 -0.519157
C -2.076691 2.205029 0.561803
C -2.931203 1.260572 -0.018048
C -0.618213 -1.663877 -0.532453
H 1.802252 0.196487 -1.615331
H 2.219718 1.772276 -0.896495
H -0.069392 2.629476 1.249413
H -3.111266 -0.747343 -0.813353
H 4.442214 0.772449 -1.093374
H 3.816019 -0.890373 -0.756599
H -2.461708 3.185303 0.844369
H -3.980194 1.504467 -0.185505
H 4.023802 1.151421 1.210823
H 0.987449 -2.538859 -1.288622


%chk=000289416-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289416

0 1
S 1.440795 0.352580 1.065350
O 4.560214 0.517397 0.703314
O 0.668252 -1.753574 -1.033051
O -1.454539 -2.635278 -0.802692
C -0.290984 0.653676 0.482966
C -1.103705 -0.298985 -0.206126
C 2.393941 0.732610 -0.543722
C -0.873734 1.880570 0.887587
C -2.471506 0.007046 -0.458114
C 3.785357 0.099809 -0.472773
C -2.225672 2.181413 0.611479
C -3.030435 1.237223 -0.064967
C -0.681222 -1.654474 -0.673504
H 1.818851 0.288576 -1.370704
H 2.440994 1.830745 -0.659098
H -0.250510 2.594929 1.434279
H -3.081094 -0.751444 -0.959814
H 4.334345 0.332072 -1.412448
H 3.701799 -0.994252 -0.373407
H -2.645827 3.141028 0.931716
H -4.082943 1.453043 -0.275875
H 4.615364 1.506678 0.724639
H 0.848958 -2.696292 -1.300535