%chk=000224108.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224108

0 1
O 0.850136 -2.697943 -0.200373
N -3.365699 0.869905 -0.237125
C 0.833368 0.855299 -0.008264
C 0.111972 -0.374012 -0.099309
C 2.275155 0.555140 0.017002
C 2.446848 -0.864467 -0.057211
C 1.101907 -1.522947 -0.132317
C -1.967590 0.823482 -0.096524
C -1.259002 -0.417207 -0.143216
C 0.144716 2.056519 0.039425
C -1.257435 2.039892 0.002166
C -4.184959 -0.344968 0.028661
C 3.376568 1.389691 0.095054
C 3.705171 -1.432577 -0.053166
C -5.678299 -0.006377 -0.103381
C 4.659601 0.802750 0.098878
C 4.825075 -0.577678 0.026577
C -6.536246 -1.247390 0.120073
H -1.781932 -1.367927 -0.222822
H 0.675539 3.004802 0.108071
H -1.795974 2.983527 0.037951
H -3.971136 -0.768654 1.035872
H -3.905691 -1.124979 -0.718124
H -3.813164 1.744897 0.032132
H 3.265799 2.468673 0.151483
H 3.831717 -2.514119 -0.110277
H -5.881079 0.416035 -1.109476
H -5.963160 0.781420 0.621647
H 5.534999 1.450367 0.159744
H 5.824374 -1.008667 0.030751
H -6.313898 -2.033790 -0.611767
H -6.385614 -1.675537 1.118268
H -7.603168 -1.010562 0.025496


%chk=000224108-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000224108

0 1
O 0.856857 -2.728434 0.002677
N -3.384304 0.833605 -0.008742
C 0.862432 0.879819 -0.003074
C 0.139318 -0.348698 -0.002121
C 2.314219 0.575004 -0.000673
C 2.479971 -0.846353 0.001891
C 1.122281 -1.493445 0.001106
C -1.993611 0.823269 -0.007171
C -1.257535 -0.406915 -0.004065
C 0.144101 2.091261 -0.006032
C -1.267713 2.058210 -0.008030
C -4.219821 -0.372791 -0.009518
C 3.448259 1.408022 -0.000525
C 3.748640 -1.444027 0.004554
C -5.716843 -0.005052 -0.011788
C 4.735952 0.805815 0.002162
C 4.891644 -0.601846 0.004685
C -6.617509 -1.258098 -0.011755
H -1.760328 -1.378413 -0.003097
H 0.658910 3.058632 -0.006820
H -1.829216 3.001341 -0.010312
H -3.996275 -0.995543 0.883450
H -3.993740 -0.996281 -0.901373
H -3.859392 1.736058 -0.012113
H 3.353425 2.499531 -0.002416
H 3.843433 -2.535173 0.006443
H -5.939233 0.613977 -0.904297
H -5.941469 0.615576 0.879044
H 5.626985 1.444435 0.002307
H 5.896299 -1.037775 0.006743
H -6.428601 -1.883274 -0.903917
H -6.432235 -1.880548 0.883061
H -7.686002 -0.979293 -0.014385


