%chk=000234072.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234072

0 1
O 2.828749 1.337498 -0.074690
N 1.643433 -0.635096 0.056111
N -3.636794 1.337600 0.010329
N -3.058611 -2.863960 0.054250
C 5.343897 0.153129 -0.025936
C 4.089591 -0.727138 0.062086
C 6.625101 -0.686517 0.039737
C -2.087514 -0.587020 0.006008
C 0.303964 -0.125813 0.029437
C -2.351543 0.809624 0.009024
C -0.738102 -1.039513 0.021400
C 2.836456 0.126967 0.005556
C -3.235560 -1.471607 -0.006642
C 0.038451 1.283242 0.018465
C -1.251928 1.734405 0.010526
C 7.869949 0.192709 -0.050059
C -4.673348 0.490320 0.007564
C -4.512904 -0.929167 -0.011585
C -6.048362 1.076715 0.017576
H 5.318224 0.748157 -0.961753
H 5.330965 0.904589 0.790251
H 4.091810 -1.465901 -0.765265
H 4.109600 -1.314906 1.003059
H 6.634943 -1.430591 -0.780753
H 6.649160 -1.270605 0.980684
H -0.542502 -2.108299 0.041047
H 1.717885 -1.651235 0.122368
H 0.880301 1.988468 0.017431
H -1.483739 2.802819 0.006947
H 8.784913 -0.408422 -0.002169
H 7.912165 0.919754 0.769749
H 7.898725 0.759587 -0.988222
H -5.396634 -1.556798 -0.015744
H -6.022771 2.179510 0.021035
H -6.620899 0.766997 -0.867005
H -6.606603 0.762275 0.910249
H -2.172800 -3.239016 -0.247394
H -3.845966 -3.442260 -0.197474


%chk=000234072-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000234072

0 1
O 2.904035 1.519577 0.006287
N 1.644199 -0.466072 0.002214
N -3.732587 1.348460 -0.003378
N -2.993119 -2.863587 0.003812
C 5.407887 0.149802 -0.001936
C 4.089749 -0.647277 0.007499
C 6.649696 -0.769160 0.003287
C -2.103507 -0.554308 0.000743
C 0.300359 0.007797 0.001482
C -2.433279 0.854718 -0.001310
C -0.732926 -0.947047 0.002154
C 2.843808 0.256126 0.005134
C -3.212781 -1.491654 0.001359
C -0.022102 1.406273 -0.000488
C -1.359222 1.800190 -0.001894
C 7.973562 0.025328 -0.005503
C -4.740618 0.445402 -0.003128
C -4.518725 -0.966940 -0.000639
C -6.155835 0.989204 -0.003733
H 5.429183 0.808874 -0.890285
H 5.432464 0.823632 0.875113
H 4.052084 -1.318825 -0.876119
H 4.057247 -1.305489 0.901327
H 6.617024 -1.441208 -0.879326
H 6.620080 -1.426702 0.896873
H -0.457148 -2.011304 0.003756
H 1.746218 -1.484390 0.001278
H 0.789613 2.135140 -0.000658
H -1.632511 2.859751 -0.003522
H 8.850335 -0.647931 -0.001617
H 8.046408 0.682201 0.881477
H 8.043263 0.667802 -0.903224
H -5.383043 -1.641770 -0.000285
H -6.123727 2.089401 -0.016972
H -6.721200 0.637919 -0.887659
H -6.712893 0.660216 0.894078
H -2.059045 -3.258718 0.005495
H -3.781245 -3.504930 0.004505


