%chk=000224407.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224407

0 1
O -2.858230 -1.939872 1.476861
O -3.405147 0.035200 2.379959
N -4.223713 0.495323 -0.426722
C 2.153628 0.176399 0.193430
C 2.490165 -0.653967 -1.062088
C 3.300045 1.164613 0.496825
C 0.826698 0.943816 0.019879
C 3.822827 -1.396142 -0.892780
C 4.634653 0.425875 0.667080
C 4.965056 -0.423118 -0.568481
C -0.389131 0.009134 0.042948
C -1.696674 0.791076 -0.128978
C -2.928385 -0.133425 -0.056747
C -3.115475 -0.590106 1.390396
C -4.380621 0.679488 -1.893399
H 2.054347 -0.520204 1.061461
H 2.539871 0.006427 -1.947942
H 1.680008 -1.378418 -1.264607
H 3.072359 1.740072 1.412663
H 3.384965 1.905716 -0.319827
H 0.845902 1.521261 -0.923486
H 0.728710 1.695603 0.827763
H 4.058277 -1.960409 -1.814046
H 3.732988 -2.149406 -0.086724
H 4.593139 -0.220586 1.564699
H 5.445770 1.154354 0.851885
H 5.903382 -0.983448 -0.402110
H 5.150835 0.237479 -1.436801
H -0.407654 -0.559457 0.994647
H -0.295135 -0.752814 -0.756437
H -1.692798 1.317634 -1.103598
H -1.769729 1.586749 0.640412
H -2.767462 -1.039880 -0.704894
H -4.334515 1.395976 0.056308
H -3.633853 1.335873 -2.364525
H -5.383393 1.102086 -2.080913
H -4.347298 -0.300776 -2.398757
H -2.981216 -2.299226 2.394948


%chk=000224407-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224407

0 1
O -2.773988 -2.211157 1.175558
O -3.538021 -0.306238 2.258193
N -4.284262 0.514545 -0.403372
C 2.188555 0.211281 0.198299
C 2.541939 -0.868651 -0.859094
C 3.323518 1.266578 0.279699
C 0.825522 0.895190 -0.078952
C 3.925027 -1.512471 -0.597104
C 4.706256 0.626957 0.546853
C 5.041950 -0.445397 -0.516618
C -0.401981 -0.041261 0.009395
C -1.734331 0.726165 -0.144332
C -3.008183 -0.183884 -0.150799
C -3.149299 -0.864611 1.207512
C -4.479261 1.080141 -1.745279
H 2.124777 -0.293553 1.189119
H 2.543399 -0.392788 -1.863692
H 1.763935 -1.656080 -0.879563
H 3.087592 2.007183 1.070223
H 3.360213 1.826314 -0.679701
H 0.856117 1.367337 -1.084515
H 0.690741 1.723268 0.648907
H 4.155674 -2.250402 -1.390346
H 3.889689 -2.073497 0.360235
H 4.702435 0.153711 1.550959
H 5.490676 1.408764 0.564885
H 6.014554 -0.923415 -0.288072
H 5.149044 0.045128 -1.506745
H -0.381620 -0.573059 0.982439
H -0.341613 -0.823771 -0.773014
H -1.720438 1.288268 -1.099361
H -1.840143 1.471210 0.670347
H -2.880567 -0.969497 -0.918311
H -4.537654 1.142077 0.369214
H -3.765548 1.888403 -2.033669
H -5.501423 1.491984 -1.817910
H -4.394407 0.275936 -2.500454
H -2.875679 -2.601808 2.087367


