%chk=000231196.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231196

0 1
S 0.781479 1.075608 -0.394968
O 0.760152 1.556973 -1.789101
N -0.119214 -0.425713 -0.254471
C -1.536647 -0.333340 -0.154580
C -4.332518 -0.262119 0.160089
C -2.343265 -1.338003 -0.731704
C -2.138955 0.707329 0.579829
C 2.396988 0.338226 -0.159002
C -3.725920 -1.299300 -0.566688
C -3.525546 0.735572 0.728069
C -5.815920 -0.230049 0.338788
C 3.372366 0.501191 -1.141463
C 2.678473 -0.317994 1.038510
C 4.661390 0.004794 -0.918300
C 3.968243 -0.814401 1.258980
C 4.957187 -0.650760 0.281903
H -1.891575 -2.143057 -1.305941
H -1.538507 1.488183 1.039881
H 0.210811 -1.238828 -0.785817
H -4.340232 -2.081003 -1.011716
H -3.983993 1.544940 1.295096
H -6.200580 0.793912 0.434340
H -6.345970 -0.690958 -0.505126
H -6.110780 -0.775824 1.246886
H 3.127230 1.010640 -2.080399
H 1.905697 -0.455714 1.796771
H 5.430944 0.127889 -1.678407
H 4.201340 -1.329130 2.189193
H 5.961019 -1.037062 0.456446


%chk=000231196-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231196

0 1
S 0.791522 1.159267 -0.521620
O 0.739131 1.241179 -2.175877
N -0.133848 -0.435936 0.210092
C -1.559044 -0.368844 0.137792
C -4.421032 -0.252332 0.115964
C -2.309390 -1.162260 -0.772856
C -2.253781 0.496201 1.026896
C 2.496296 0.386082 -0.191518
C -3.718586 -1.114437 -0.765381
C -3.659852 0.557238 1.002825
C -5.938607 -0.212945 0.128839
C 3.367645 0.301545 -1.291288
C 2.856963 -0.029422 1.104886
C 4.661373 -0.229833 -1.082021
C 4.154941 -0.558619 1.298686
C 5.053841 -0.655368 0.209294
H -1.784627 -1.810532 -1.485609
H -1.679519 1.102512 1.735925
H 0.250097 -1.223775 -0.347757
H -4.281540 -1.740927 -1.467835
H -4.179972 1.234361 1.691433
H -6.316667 0.788737 0.399396
H -6.359231 -0.481756 -0.856052
H -6.349707 -0.928671 0.867770
H 3.017603 0.634884 -2.276027
H 2.142298 0.033116 1.931315
H 5.359419 -0.308343 -1.922453
H 4.459454 -0.895919 2.295330
H 6.058515 -1.063199 0.366951


