%chk=000236598.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236598

0 1
S 1.170738 2.353942 1.178645
O 0.868536 -1.550696 -0.428442
O 1.017257 -0.053286 1.263262
O -2.135470 -0.873877 -2.016915
O -2.415983 -1.576602 0.094036
C -0.743071 0.164691 -0.434455
C -1.324228 1.326847 0.398463
C -0.413189 2.491719 0.434662
C 0.455290 -0.451769 0.270521
C 2.033186 -2.282521 0.102269
C -1.826707 -0.864251 -0.678281
C 2.204556 -3.425998 -0.891238
C -0.611372 3.759948 -0.021818
C 0.511355 4.637398 0.224341
C 3.394356 -4.297570 -0.508468
C 1.545676 4.027262 0.861289
H -0.384258 0.563464 -1.430878
H -1.538945 0.973497 1.436745
H -2.311559 1.625098 -0.022434
H 1.784264 -2.614514 1.123998
H 2.884944 -1.582805 0.128582
H 1.274537 -4.030317 -0.930977
H 2.332264 -3.017493 -1.915014
H -1.503563 4.111579 -0.519649
H 3.270556 -4.745868 0.484988
H 3.520686 -5.122043 -1.221590
H 4.332745 -3.729890 -0.500681
H 0.493276 5.673698 -0.083529
H 2.489891 4.447489 1.158410
H -2.844571 -1.536031 -2.245640


%chk=000236598-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236598

0 1
S 1.212320 2.357153 1.399590
O 0.867952 -1.493840 -0.460241
O 0.186865 -0.873841 1.681668
O -3.148772 -0.112151 -1.322817
O -2.378321 -2.020437 -0.247133
C -0.970914 0.037114 -0.305857
C -1.350955 1.324546 0.500813
C -0.313529 2.413515 0.417723
C 0.069950 -0.805896 0.438706
C 1.886886 -2.416966 0.134659
C -2.197026 -0.834603 -0.587779
C 2.629664 -3.076863 -1.026618
C -0.336837 3.557781 -0.368800
C 0.825254 4.403226 -0.224681
C 3.718595 -4.044658 -0.511334
C 1.751596 3.909312 0.678132
H -0.557768 0.333254 -1.287058
H -1.534159 1.024423 1.548610
H -2.293971 1.719666 0.086299
H 1.355991 -3.151127 0.768042
H 2.558241 -1.820003 0.779410
H 1.903667 -3.620642 -1.659016
H 3.085478 -2.291762 -1.658353
H -1.173638 3.791126 -1.033435
H 3.281194 -4.849373 0.108655
H 4.248587 -4.520508 -1.355005
H 4.470282 -3.514923 0.103150
H 0.962546 5.341128 -0.768153
H 2.706382 4.332542 0.985304
H -3.934363 -0.696093 -1.504278


