%chk=000290019.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290019

0 1
S 2.095541 1.039744 -0.199464
O -0.497508 0.035408 1.017472
O 0.547955 -1.868376 0.225297
O -1.815834 1.401806 -0.203992
O 2.523047 0.420564 -1.434301
O 2.912892 2.094363 0.370662
C 1.956701 -0.202838 1.054903
C 0.483357 1.702402 -0.447122
C 0.595873 -0.848520 1.221044
C -0.609954 0.670721 -0.290220
C -0.572665 -2.795958 0.328939
C -3.024151 0.591630 -0.049710
C -0.538050 -3.555835 -0.982084
C -4.146637 1.603857 -0.162147
H 2.292057 0.214342 2.030649
H 2.697853 -1.014601 0.842471
H 0.395661 2.194945 -1.441887
H 0.281075 2.551256 0.253516
H 0.398868 -1.241186 2.241954
H -0.642001 -0.123024 -1.064285
H -0.389871 -3.444388 1.203303
H -1.503522 -2.219701 0.469531
H -3.049758 -0.169116 -0.847458
H -2.975414 0.109680 0.942898
H -1.292559 -4.349128 -1.009588
H -0.704743 -2.889591 -1.839148
H 0.448199 -4.016873 -1.143622
H -5.124412 1.139638 0.006106
H -4.021961 2.411348 0.574425
H -4.158839 2.083233 -1.150142


%chk=000290019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290019

0 1
S 2.184055 1.070223 -0.357953
O -0.443917 0.105666 1.183473
O 0.517533 -1.861100 0.108707
O -1.853290 1.546751 -0.045162
O 2.193677 0.351269 -1.823510
O 3.373065 2.098165 0.087894
C 2.037786 -0.264363 1.061579
C 0.476630 1.959565 -0.183020
C 0.645903 -0.893580 1.168687
C -0.597396 0.879310 -0.091002
C -0.645995 -2.770821 0.260852
C -3.026683 0.643224 -0.192244
C -0.567048 -3.788586 -0.873570
C -4.268587 1.528302 -0.230973
H 2.295650 0.324111 1.954237
H 2.811583 -1.004867 0.810924
H 0.393120 2.574435 -1.091604
H 0.547473 2.563200 0.733008
H 0.537936 -1.371529 2.166077
H -0.525795 0.160365 -0.938014
H -0.589349 -3.261163 1.256304
H -1.582557 -2.180346 0.218260
H -2.911073 0.059050 -1.130648
H -3.045986 -0.052783 0.667517
H -1.419061 -4.490193 -0.817723
H -0.593142 -3.281010 -1.852859
H 0.369619 -4.367994 -0.813180
H -5.175880 0.906093 -0.336436
H -4.353443 2.114589 0.699683
H -4.223629 2.229820 -1.081303


