%chk=000258559.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258559

0 1
O -3.235795 -1.555358 0.000237
N 2.548642 1.186173 0.000243
C 0.845504 -0.590039 -0.000016
C 1.214968 0.786190 0.000104
C -1.506310 0.051431 -0.000166
C -0.537967 -0.932291 -0.000128
C 0.195025 1.792883 0.000071
C -1.126497 1.428978 -0.000067
C 1.889524 -1.568265 -0.000022
C -2.941656 -0.377095 -0.000311
C 3.198952 -1.160023 0.000121
C 3.488321 0.244826 0.000253
C -4.000580 0.686066 0.000578
H -0.830508 -1.988910 -0.000231
H -1.902085 2.195760 -0.000153
H 0.506510 2.839386 0.000121
H 1.623506 -2.626250 -0.000135
H 4.021147 -1.871844 0.000113
H 4.532405 0.585855 0.000365
H -3.939538 1.327742 -0.888080
H -3.936947 1.329290 0.887907
H -5.005319 0.232994 0.002397


%chk=000258559-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258559

0 1
O -3.275167 -1.601930 0.000063
N 2.567428 1.206072 0.000034
C 0.852366 -0.602268 0.000045
C 1.238019 0.796565 0.000029
C -1.522128 0.053391 0.000032
C -0.532039 -0.942679 0.000042
C 0.215995 1.799050 0.000006
C -1.130573 1.437297 0.000018
C 1.899838 -1.583065 0.000067
C -2.967351 -0.373867 0.000012
C 3.229456 -1.161540 0.000072
C 3.512017 0.245029 0.000056
C -4.050960 0.698223 0.000553
H -0.851279 -1.991917 0.000035
H -1.896380 2.219477 -0.000006
H 0.534510 2.845801 -0.000020
H 1.642055 -2.648347 0.000079
H 4.056193 -1.878319 0.000089
H 4.552185 0.593358 0.000059
H -3.968249 1.347729 -0.890962
H -3.967126 1.348144 0.891647
H -5.037509 0.211296 0.001250


