%chk=000222687.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222687

0 1
O 4.653653 -1.971713 -0.090985
O 2.505829 -2.568324 -0.091679
N 0.657859 -0.581434 -0.038799
N -0.611799 -0.070555 -0.021510
C 1.743970 0.310102 -0.025800
C 3.067049 -0.215781 -0.044077
C 1.557074 1.719545 0.005217
C 4.162008 0.682638 -0.030410
C -2.997224 -0.375413 -0.014734
C 2.649924 2.564717 0.017588
C 3.964615 2.050386 -0.000160
C -4.064980 -1.292706 -0.015878
C -3.269267 1.003074 0.003448
C -1.619860 -0.904437 -0.033187
C 3.315313 -1.651454 -0.076387
C -5.382564 -0.832090 0.001070
C -4.590983 1.455576 0.020291
C -5.648788 0.541536 0.019154
H 0.541492 2.121099 0.019051
H 5.174644 0.265178 -0.044359
H 2.501157 3.646399 0.041410
H 0.840796 -1.609975 -0.062129
H 4.810684 2.733056 0.010133
H -3.868630 -2.363428 -0.029805
H -2.445768 1.719092 0.004436
H -1.539388 -2.003078 -0.056039
H -6.205716 -1.545076 0.000204
H -4.795868 2.525142 0.034350
H -6.677456 0.896954 0.032294
H 4.795524 -2.958931 -0.113109


%chk=000222687-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222687

0 1
O 4.621306 -2.082105 -0.093356
O 2.355880 -2.540715 -0.087443
N 0.662473 -0.477586 -0.034503
N -0.607995 0.054960 -0.017502
C 1.777570 0.355916 -0.024530
C 3.103814 -0.213952 -0.044492
C 1.634972 1.774766 0.005603
C 4.235289 0.652708 -0.033723
C -3.008850 -0.346836 -0.011586
C 2.769619 2.597973 0.015506
C 4.080829 2.045362 -0.004044
C -4.049799 -1.317846 -0.019442
C -3.358781 1.035225 0.009959
C -1.614800 -0.800379 -0.026655
C 3.284771 -1.668251 -0.075312
C -5.403925 -0.922261 -0.006241
C -4.710812 1.425659 0.022934
C -5.740764 0.450851 0.014895
H 0.625520 2.190565 0.020564
H 5.229840 0.198710 -0.049124
H 2.639028 3.685932 0.038762
H 0.852409 -1.501733 -0.055719
H 4.957700 2.699738 0.004033
H -3.792196 -2.384470 -0.036042
H -2.556360 1.779664 0.015754
H -1.446640 -1.895228 -0.046161
H -6.194153 -1.681071 -0.012497
H -4.969736 2.490393 0.039249
H -6.791697 0.760311 0.024964
H 4.638792 -3.076200 -0.114250


