%chk=000230754.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230754

0 1
S -1.508958 2.348770 -0.000023
O 0.229457 -2.262251 -0.000694
N -0.447850 -0.063642 -0.000561
N 1.149994 1.770111 -0.000866
C -1.869140 -0.260110 -0.000209
C -0.070731 1.314003 -0.000565
C -2.583866 0.962045 0.000224
C 1.941010 -0.569562 -0.000808
C 0.568069 -1.099229 -0.001041
C 2.203299 0.824727 -0.000836
C -2.545624 -1.482531 -0.000399
C -3.970632 0.981757 0.000640
C 3.024270 -1.476170 -0.000536
C 3.536372 1.296876 -0.000576
C -3.944554 -1.454985 -0.000188
C -4.649766 -0.244470 0.000366
C 4.327254 -1.003389 -0.000334
C 4.579803 0.384503 -0.000318
H -1.990120 -2.425864 -0.000803
H -4.522680 1.920868 0.001025
H 2.812231 -2.549731 -0.000512
H 3.716946 2.373167 -0.000488
H -4.493281 -2.398493 -0.000442
H -5.739138 -0.253902 0.000581
H 5.163712 -1.700943 -0.000209
H 5.612422 0.739346 -0.000031


%chk=000230754-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230754

0 1
S -1.512199 2.431827 0.000353
O 0.229002 -2.293683 -0.000623
N -0.446624 -0.032499 0.000351
N 1.167339 1.792466 0.000303
C -1.859239 -0.252523 0.000103
C -0.057470 1.331846 0.000377
C -2.593862 0.965452 0.000053
C 1.940059 -0.563941 -0.000074
C 0.558275 -1.072559 0.000566
C 2.206336 0.846711 -0.000006
C -2.540820 -1.491056 -0.000043
C -3.998293 0.976850 -0.000168
C 3.018989 -1.488581 -0.000665
C 3.553165 1.302468 -0.000451
C -3.952855 -1.478313 -0.000280
C -4.678518 -0.263074 -0.000342
C 4.343121 -1.024665 -0.001089
C 4.607266 0.375566 -0.000972
H -1.970706 -2.420748 0.000037
H -4.553413 1.919685 -0.000197
H 2.783545 -2.557752 -0.000695
H 3.731835 2.381567 -0.000409
H -4.490987 -2.431752 -0.000398
H -5.773198 -0.277620 -0.000510
H 5.174642 -1.736789 -0.001500
H 5.643109 0.732019 -0.001324


