%chk=000240599.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240599

0 1
S -1.252723 1.644817 0.375373
S -1.117784 -1.388758 0.174937
O -0.167183 2.358061 -0.262041
O -1.905568 2.277559 1.504874
O -0.729475 -1.250479 -1.218510
O -2.534799 -1.569298 0.452309
C -0.655681 0.072954 1.038726
C 0.854297 0.158112 1.270541
C 1.717640 0.173741 0.001578
C 3.193523 -0.081485 0.334246
C -2.428304 1.200999 -0.812624
C -0.237050 -2.710166 0.892000
C 4.060253 -0.044617 -0.922355
H -1.129765 0.023090 2.063431
H 1.081499 1.079192 1.857633
H 1.171868 -0.671018 1.936861
H 1.614153 1.165183 -0.504845
H 1.368812 -0.552939 -0.758823
H 3.311161 -1.059437 0.838851
H 3.554055 0.680791 1.053986
H -2.964068 2.068125 -1.230700
H -2.005954 0.686030 -1.700353
H -3.233842 0.533825 -0.446106
H -0.340602 -2.785524 1.982243
H -0.580970 -3.687756 0.510987
H 0.842637 -2.690663 0.676102
H 5.114619 -0.222694 -0.685138
H 3.751145 -0.802084 -1.651964
H 3.996804 0.929539 -1.424118


%chk=000240599-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240599

0 1
S -1.289591 1.745567 0.462834
S -1.242568 -1.506657 0.167345
O -0.035563 2.591596 -0.153406
O -2.124818 2.340746 1.732732
O -0.766019 -1.392381 -1.394843
O -2.840973 -1.554832 0.528703
C -0.533481 0.006911 1.192089
C 0.976736 0.088751 1.307102
C 1.809897 -0.025431 0.005268
C 3.312725 0.188728 0.293126
C -2.507278 1.341155 -0.955522
C -0.422154 -3.069541 0.928190
C 4.175194 0.076780 -0.981558
H -1.103916 -0.056914 2.135097
H 1.199646 1.070555 1.777159
H 1.311731 -0.678320 2.038627
H 1.460810 0.733721 -0.716212
H 1.660902 -1.012066 -0.475102
H 3.660924 -0.552124 1.043608
H 3.455873 1.189005 0.749037
H -2.880767 2.326485 -1.267811
H -1.922992 0.824370 -1.730021
H -3.281592 0.694732 -0.518249
H -0.672746 -3.076632 1.997944
H -0.893584 -3.903128 0.388363
H 0.655810 -3.002033 0.729912
H 5.245795 0.234747 -0.757731
H 4.070245 -0.920086 -1.449828
H 3.870451 0.831394 -1.729751


