%chk=000236058.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236058

0 1
S -0.687576 0.017988 -1.360163
O -3.819871 0.321948 0.909090
O 0.653745 2.327430 0.314644
O 2.815570 2.237330 0.284671
O -2.403795 -1.393522 0.661923
N 0.870401 -1.816483 -0.011874
N 2.501192 -0.569090 0.966959
N 1.721841 1.722778 0.303474
C 0.591563 -0.492532 -0.318880
C 1.609422 0.262854 0.299681
C 2.044051 -1.828702 0.770526
C 0.062197 -2.975785 -0.396366
C -1.829387 0.816484 -0.221225
C -2.640626 -0.223651 0.464740
H 2.505203 -2.728388 1.155679
H -1.011916 -2.800965 -0.135875
H 0.118610 -3.161823 -1.484993
H 0.391904 -3.885262 0.133162
H -2.460609 1.536922 -0.794163
H -1.287775 1.473478 0.515170
H -4.393342 -0.333511 1.393820


%chk=000236058-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236058

0 1
S -0.715940 -0.071598 -1.514130
O -3.759783 0.518103 1.127902
O 0.634221 2.372901 0.094400
O 2.814737 2.187780 0.759844
O -2.390084 -1.331438 0.825742
N 0.894208 -1.841643 -0.057134
N 2.431516 -0.593894 1.062310
N 1.688835 1.673991 0.418564
C 0.579583 -0.505547 -0.337184
C 1.556624 0.233089 0.370725
C 2.006651 -1.839311 0.783600
C 0.141332 -3.025257 -0.508680
C -1.939555 0.797854 -0.379158
C -2.673792 -0.145096 0.553265
H 2.456036 -2.753503 1.163703
H -0.919996 -2.895239 -0.243058
H 0.237187 -3.159867 -1.598446
H 0.548950 -3.911722 0.002376
H -2.650730 1.325830 -1.034628
H -1.368223 1.556191 0.186648
H -4.220976 -0.084127 1.773339


