%chk=000237355.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237355

0 1
S 1.729087 1.360640 -1.737573
O -0.983982 -1.905633 0.473414
O 1.946527 -0.668684 -0.048309
C -2.660095 -0.275092 0.310373
C -1.337385 -0.727086 -0.305824
C -3.208694 0.963059 -0.407498
C 0.358353 -2.364103 0.264272
C 1.360400 -1.472996 1.005657
C -4.528565 1.427379 0.203744
C 2.874673 0.334304 0.427676
C 3.292464 1.048204 -0.847171
H -2.514868 -0.070401 1.389262
H -3.390429 -1.107612 0.270272
H -1.437585 -1.035492 -1.359709
H -0.537708 0.030133 -0.216768
H -2.465929 1.784492 -0.363219
H -3.352432 0.742499 -1.483786
H 0.322625 -3.385184 0.686621
H 0.595652 -2.407181 -0.816265
H 2.157409 -2.052154 1.498954
H 0.853788 -0.820728 1.738944
H -4.915298 2.311924 -0.314347
H -4.412960 1.689789 1.261602
H -5.297127 0.648155 0.142956
H 2.359616 1.001607 1.143315
H 3.725836 -0.162450 0.927644
H 3.836848 1.981528 -0.629472
H 3.945936 0.408261 -1.470771
H 2.142043 2.388322 -2.507494


%chk=000237355-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237355

0 1
S 1.401096 2.235314 -0.890053
O -0.934107 -1.784544 0.947825
O 1.814884 -0.744720 -0.113729
C -2.662918 -0.186008 0.359418
C -1.324922 -0.789524 -0.074847
C -3.171408 0.878281 -0.640972
C 0.300657 -2.503160 0.644700
C 1.576966 -1.717295 0.962907
C -4.498221 1.527658 -0.191722
C 2.953788 0.135795 0.152551
C 2.992065 1.186295 -0.951236
H -2.537936 0.270571 1.360900
H -3.410888 -0.995867 0.467592
H -1.420231 -1.297400 -1.061463
H -0.544420 -0.010089 -0.166736
H -2.396845 1.661941 -0.766667
H -3.306722 0.412368 -1.638561
H 0.271618 -3.402680 1.286868
H 0.328085 -2.823637 -0.419851
H 2.442843 -2.415807 1.035911
H 1.458209 -1.193800 1.936261
H -4.845772 2.283962 -0.919640
H -4.380302 2.028711 0.787631
H -5.295724 0.768097 -0.084969
H 2.847083 0.619605 1.147748
H 3.901746 -0.450842 0.142585
H 3.855008 1.855491 -0.801632
H 3.056297 0.706115 -1.940237
H 1.988270 3.410667 -1.334083


