%chk=000291658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291658

0 1
S -2.592615 -1.049841 -0.953914
O 2.164143 2.330726 0.154479
O -3.743699 -0.119301 -0.124010
O -2.563225 -2.356196 -0.281017
N 2.501174 -0.449567 0.332051
N -0.319918 3.492044 -0.173544
C 0.092884 -0.764371 -0.159913
C 1.235347 0.062740 0.054181
C -1.140759 -0.134081 -0.462439
C 1.100326 1.487033 -0.012648
C -0.143146 2.084051 -0.264215
C -1.264680 1.236665 -0.494098
C 0.293439 -2.181021 -0.036372
C 1.538751 -2.675782 0.245175
C 2.636786 -1.766484 0.418219
H -2.238441 1.708985 -0.675267
H -0.565542 -2.859944 -0.147387
H 1.715851 -3.744842 0.348446
H 3.639730 -2.155124 0.636710
H -0.942326 3.879080 -0.871916
H 0.555151 4.010238 -0.144155
H 3.002840 1.812801 0.359821
H -3.802972 -0.254211 0.836213


%chk=000291658-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291658

0 1
S -2.724643 -1.092276 -0.997828
O 2.211998 2.261911 0.223986
O -3.948692 0.020090 -0.071167
O -2.633437 -2.556034 -0.255391
N 2.486662 -0.388286 0.369920
N -0.222007 3.481543 -0.374676
C 0.080807 -0.807335 -0.179673
C 1.211702 0.064856 0.058277
C -1.157842 -0.150175 -0.483682
C 1.089959 1.479981 -0.016125
C -0.141248 2.099729 -0.321135
C -1.264189 1.244574 -0.560643
C 0.331298 -2.215576 -0.071668
C 1.621806 -2.661670 0.238083
C 2.674437 -1.717396 0.453998
H -2.236794 1.696650 -0.788028
H -0.491042 -2.922585 -0.208508
H 1.834678 -3.730911 0.325202
H 3.686824 -2.055672 0.701603
H -1.094521 3.953637 -0.589301
H 0.612918 4.031686 -0.188038
H 2.953739 1.605302 0.416718
H -3.723311 -0.048447 0.902479


