%chk=000082078.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000082078

0 1
S 0.179593 -1.480947 -0.863041
O -1.979731 0.476666 0.203810
O 0.863167 -2.208459 -1.916966
O -0.452834 -2.207479 0.213890
O -3.428704 -0.657937 -1.121781
C -1.075962 -0.516046 -1.702177
C 1.265075 -0.292336 -0.232779
C 0.912982 0.469235 0.885070
C 2.520383 -0.124317 -0.828417
C -2.303714 -0.291758 -0.896448
C 1.808661 1.411912 1.399612
C 3.417018 0.817136 -0.316696
C 3.059575 1.584828 0.797930
C -3.048948 0.778528 1.160857
C -3.931978 1.880377 0.616690
H -0.667210 0.457582 -2.048962
H -1.358807 -1.031275 -2.654648
H -0.067291 0.332033 1.358583
H 2.803875 -0.737095 -1.693605
H 1.533872 2.005709 2.269821
H 4.393676 0.948023 -0.780317
H 3.760200 2.317970 1.200116
H -3.604587 -0.155353 1.365031
H -2.458543 1.083827 2.043302
H -4.651870 2.224838 1.369238
H -3.346536 2.748942 0.290938
H -4.510963 1.532197 -0.253151


%chk=000082078-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000082078

0 1
S 0.199293 -1.544073 -0.796428
O -2.125454 0.631418 0.082787
O 0.971878 -2.401102 -1.955238
O -0.509348 -2.254406 0.490367
O -3.502702 -0.869166 -1.072810
C -1.188947 -0.500546 -1.783934
C 1.425791 -0.249069 -0.151944
C 1.175628 0.339855 1.097401
C 2.562218 0.010493 -0.934635
C -2.404118 -0.290954 -0.924101
C 2.125735 1.269224 1.580705
C 3.499723 0.943559 -0.432598
C 3.277859 1.571479 0.816116
C -3.230182 0.892675 1.063320
C -4.194632 1.952135 0.524794
H -0.668272 0.431612 -2.045998
H -1.392577 -1.147932 -2.647774
H 0.283911 0.067562 1.669735
H 2.716128 -0.520681 -1.880032
H 1.968265 1.749433 2.552013
H 4.401397 1.170014 -1.010950
H 4.010772 2.289574 1.199633
H -3.744411 -0.063034 1.264156
H -2.695874 1.234209 1.963991
H -4.949940 2.188653 1.296859
H -3.658806 2.882744 0.270195
H -4.722934 1.583124 -0.369730


