%chk=000239474.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239474

0 1
S 2.246138 -1.017327 0.272060
N -1.554496 1.394236 0.022112
N -0.560813 -2.187186 0.190684
N 0.852663 1.257381 0.154356
C -0.474530 -0.782084 0.081117
C -1.646943 0.041618 0.020818
C 0.760518 -0.093675 0.155825
C -3.015463 -0.547356 -0.046818
C -0.311470 1.958856 0.085872
C 3.558526 0.166919 -0.077818
H -3.213325 -1.198229 0.818793
H -3.792572 0.238392 -0.037922
H -3.166047 -1.130701 -0.964875
H 0.272351 -2.698050 -0.083986
H -1.385291 -2.593959 -0.233964
H -0.251442 3.056870 0.083247
H 4.519454 -0.336647 0.083992
H 3.499504 1.042471 0.586869
H 3.512041 0.534671 -1.110162


%chk=000239474-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239474

0 1
S 2.300808 -1.125570 0.005856
N -1.542086 1.417257 -0.001988
N -0.582604 -2.173800 0.001710
N 0.873196 1.236326 0.000820
C -0.489853 -0.788562 0.000932
C -1.649158 0.051024 -0.000986
C 0.773252 -0.111184 0.002400
C -3.036549 -0.547809 -0.001938
C -0.291767 1.949312 -0.001391
C 3.600915 0.229181 0.001565
H -3.213024 -1.177264 0.893377
H -3.776348 0.266412 -0.003258
H -3.211049 -1.178484 -0.896803
H 0.253802 -2.752895 -0.001461
H -1.488237 -2.633031 0.001324
H -0.206100 3.038988 -0.002646
H 4.569782 -0.293693 0.006620
H 3.479640 0.854645 0.896297
H 3.484184 0.845347 -0.900230


