%chk=000181122.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181122

0 1
S 1.055620 1.321514 0.064434
O 1.267774 2.085130 -1.150938
O 1.255180 1.951217 1.356633
O -5.077206 -1.084005 1.139250
O -5.225081 -1.104025 -1.092050
C 3.521225 0.223185 0.020297
C 2.034635 -0.143763 -0.008903
C 4.410957 -1.026440 -0.041663
C 5.899274 -0.650076 -0.011848
C -0.579763 0.687162 0.023338
C 6.793774 -1.885644 -0.072922
C -1.218048 0.500789 -1.203761
C -1.239525 0.402839 1.219440
C -2.520660 -0.006226 -1.241493
C -2.543249 -0.104172 1.193832
C -3.175519 -0.312824 -0.039059
C -4.556983 -0.855245 -0.115552
H 3.763757 0.894794 -0.831865
H 3.752582 0.798956 0.942793
H 1.820763 -0.736981 -0.920430
H 1.809708 -0.832000 0.830254
H 4.190321 -1.605714 -0.958758
H 4.179082 -1.701208 0.804603
H 6.124122 -0.070931 0.905788
H 6.135316 0.024335 -0.858911
H 6.627583 -2.461548 -0.990431
H 6.615198 -2.557829 0.774039
H 7.853795 -1.606744 -0.050285
H -0.710988 0.767267 -2.138743
H -0.748505 0.592166 2.181542
H -3.033483 -0.159263 -2.195780
H -3.072777 -0.331788 2.123606
H -6.006676 -1.442928 1.101443


%chk=000181122-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181122

0 1
S 1.035806 1.314495 0.013957
O 1.242403 2.165585 -1.370975
O 1.293374 1.971872 1.493191
O -5.287965 -1.043307 1.218437
O -5.424534 -0.991700 -1.100079
C 3.631379 0.166678 -0.008458
C 2.169350 -0.263946 -0.110095
C 4.577499 -1.060534 -0.068812
C 6.065736 -0.652511 0.037949
C -0.744207 0.636046 0.003853
C 7.018387 -1.865770 -0.020635
C -1.387235 0.485130 -1.236261
C -1.354060 0.374210 1.241515
C -2.714059 0.007303 -1.231921
C -2.682724 -0.101621 1.232842
C -3.356436 -0.292759 -0.001748
C -4.759331 -0.796148 -0.055889
H 3.871401 0.863117 -0.834564
H 3.788929 0.712297 0.941601
H 1.896069 -0.703626 -1.083485
H 1.833412 -0.896692 0.728199
H 4.416824 -1.612374 -1.017722
H 4.331503 -1.763723 0.753427
H 6.224208 -0.098519 0.984844
H 6.309597 0.052978 -0.781492
H 6.899736 -2.418703 -0.971423
H 6.815338 -2.571584 0.806726
H 8.074810 -1.550629 0.056635
H -0.873674 0.761966 -2.162985
H -0.812963 0.567391 2.173871
H -3.269004 -0.133012 -2.164892
H -3.205132 -0.320541 2.167603
H -6.222237 -1.371371 1.124686


