%chk=000197714.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197714

0 1
O -2.644076 2.154999 0.397331
O 2.257486 -3.640808 -0.033802
N 0.759533 0.856320 0.052352
N -1.927132 -0.014074 0.382437
N 1.665165 2.927046 -0.082457
N 1.536321 -1.395806 0.006155
C -0.308695 1.799884 0.154168
C -0.875467 -0.961195 0.265500
C 0.479362 -0.533030 0.107719
C 1.956822 1.601556 -0.091605
C -1.694953 1.394716 0.310055
C -3.341683 -0.479365 0.472174
C 0.280308 3.069872 0.067874
C 3.297616 0.970237 -0.227829
C -3.899822 -0.852458 -0.910733
C -1.103356 -2.358215 0.318248
C -0.386187 4.380964 0.119265
C -0.050738 -3.251458 0.218169
C 1.254886 -2.723608 0.062042
C 4.414319 1.997807 -0.370089
C -5.311301 -1.415961 -0.792026
C 3.617368 -3.139525 -0.194445
H -3.947665 0.352513 0.913985
H -3.408628 -1.331294 1.181639
H 3.484827 0.313270 0.653982
H 3.291092 0.280336 -1.104254
H -3.903693 0.046990 -1.561687
H -3.237394 -1.580939 -1.416923
H -2.121111 -2.738945 0.441565
H -0.016666 4.987416 0.962233
H -0.197018 4.965468 -0.795771
H -1.481229 4.273357 0.233511
H -0.197769 -4.329003 0.256065
H 4.260046 2.639790 -1.248873
H 5.390815 1.513950 -0.468466
H 4.452221 2.672492 0.496895
H -5.998748 -0.693698 -0.333685
H -5.718975 -1.663792 -1.780019
H -5.341534 -2.329843 -0.188626
H 3.896204 -2.532303 0.672045
H 3.696239 -2.564771 -1.122151
H 4.187210 -4.074990 -0.240968


%chk=000197714-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197714

0 1
O -2.681024 2.171877 0.316752
O 2.337091 -3.660022 -0.044918
N 0.748641 0.817218 0.044001
N -1.927754 -0.051282 0.311262
N 1.675374 2.874598 -0.073432
N 1.531468 -1.432295 0.000237
C -0.316120 1.764973 0.119348
C -0.875190 -0.991500 0.209668
C 0.486654 -0.571612 0.083772
C 1.946467 1.548621 -0.073691
C -1.706123 1.357483 0.251059
C -3.336522 -0.497387 0.450924
C 0.287653 3.029635 0.044251
C 3.324519 0.956194 -0.183938
C -3.991940 -0.872410 -0.898683
C -1.097648 -2.398586 0.233545
C -0.353565 4.382711 0.079379
C -0.022948 -3.295851 0.149727
C 1.284041 -2.758869 0.035157
C 4.414548 2.038642 -0.311858
C -5.447853 -1.345105 -0.703326
C 3.693163 -3.090471 -0.166219
H -3.884293 0.352297 0.892149
H -3.380765 -1.340254 1.165633
H 3.515345 0.312110 0.696105
H 3.355832 0.265937 -1.048648
H -3.968847 0.017629 -1.554527
H -3.403437 -1.660872 -1.406810
H -2.112140 -2.793665 0.315641
H 0.033427 4.970288 0.932104
H -0.109335 4.948870 -0.838135
H -1.446239 4.289337 0.169551
H -0.168728 -4.377583 0.167245
H 4.250218 2.663001 -1.206075
H 5.409717 1.564086 -0.387173
H 4.407887 2.714007 0.560053
H -6.059051 -0.559439 -0.222023
H -5.917479 -1.589127 -1.672660
H -5.499168 -2.249842 -0.067907
H 3.930316 -2.457638 0.706485
H 3.781823 -2.485041 -1.084970
H 4.355985 -3.966763 -0.208055


