%chk=000217658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217658

0 1
S -2.515817 0.370983 -0.615577
O 0.090336 -2.223670 0.569207
O -0.746979 2.287529 -0.050983
N -0.107291 0.066329 0.344517
C 1.288970 0.343694 0.796555
C -0.581552 -1.281488 0.230922
C -1.981849 -1.335075 -0.320177
C -0.963030 1.113663 -0.063897
C 2.179487 0.653811 -0.376302
C 3.326405 0.018959 -0.601293
H 1.269865 1.212275 1.498803
H 1.647771 -0.544358 1.373062
H -2.015427 -1.927855 -1.259644
H -2.668195 -1.846496 0.388508
H 1.819717 1.457365 -1.023650
H 3.979598 0.257928 -1.430321
H 3.705293 -0.785694 0.014772


%chk=000217658-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217658

0 1
S -2.617906 0.366842 -0.603280
O 0.196668 -2.245603 0.509058
O -0.771653 2.326551 0.034095
N -0.108982 0.080829 0.336085
C 1.263975 0.425507 0.804110
C -0.519892 -1.259804 0.209035
C -1.946414 -1.374248 -0.328148
C -1.010418 1.106754 -0.026481
C 2.209261 0.685079 -0.354164
C 3.291449 -0.084017 -0.624544
H 1.169880 1.324521 1.439086
H 1.610446 -0.426154 1.413016
H -1.941074 -1.926378 -1.280711
H -2.576335 -1.906694 0.400851
H 1.980115 1.563888 -0.972208
H 3.962400 0.148370 -1.459058
H 3.535783 -0.967543 -0.022240


