%chk=000245403.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245403

0 1
O -1.359347 -2.004802 -0.038795
O 4.325669 -0.337792 0.815114
O 2.550771 1.053698 0.639718
N -2.153436 0.117428 0.077504
C -3.313369 -0.240946 -0.783845
C -2.039827 1.533274 0.506169
C -0.015960 -0.449978 1.223240
C -1.203246 -0.864512 0.379893
C 1.054363 -1.545238 1.224223
C -4.582381 -0.455851 0.059288
C -0.976880 2.293042 -0.309050
C 2.366076 -1.072289 1.858946
C -5.778218 -0.781020 -0.829796
C -0.957502 3.772283 0.056515
C 3.016717 0.011228 1.042940
C 5.158979 0.563366 0.018021
C 4.835686 0.393517 -1.451400
H -3.067858 -1.179087 -1.341217
H -3.469471 0.555719 -1.541128
H -1.799076 1.576827 1.591523
H -3.030750 2.027639 0.393409
H 0.425049 0.505567 0.830005
H -0.345437 -0.223047 2.255623
H 1.231926 -1.898292 0.185284
H 0.677696 -2.438239 1.765758
H -4.409493 -1.281297 0.780003
H -4.796072 0.439677 0.672650
H 0.029652 1.845192 -0.128211
H -1.166828 2.167128 -1.392420
H 2.189595 -0.685742 2.885799
H 3.061217 -1.933847 1.977603
H -5.996610 0.028809 -1.534677
H -5.608311 -1.692571 -1.416333
H -6.681024 -0.946421 -0.230215
H -1.913242 4.261676 -0.161605
H -0.738355 3.926547 1.119614
H -0.181906 4.303378 -0.510030
H 4.997884 1.596531 0.373114
H 6.169205 0.205064 0.287660
H 4.862945 -0.662465 -1.750813
H 3.827521 0.768967 -1.682934
H 5.544348 0.939379 -2.084948


%chk=000245403-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245403

0 1
O -1.783032 -2.089982 -0.174567
O 4.334865 -0.243349 1.195848
O 2.793886 0.455614 -0.409477
N -2.306127 0.165847 -0.000819
C -3.676015 -0.106423 -0.496935
C -1.976267 1.565904 0.344399
C -0.005825 -0.598432 0.633836
C -1.422903 -0.902688 0.119879
C 0.976537 -1.736747 0.289158
C -4.681991 -0.398884 0.641090
C -1.464694 2.399462 -0.856822
C 2.352238 -1.570747 0.962195
C -6.108049 -0.629728 0.097689
C -1.210063 3.871395 -0.468108
C 3.134262 -0.354743 0.485446
C 5.238601 0.887150 0.816395
C 6.150270 0.485606 -0.346492
H -3.623275 -0.981061 -1.168349
H -4.012729 0.768355 -1.087638
H -1.228711 1.585877 1.156967
H -2.891418 2.039408 0.752589
H 0.376127 0.349135 0.216976
H -0.056616 -0.471994 1.737028
H 1.100830 -1.782466 -0.808167
H 0.529911 -2.699354 0.593227
H -4.334226 -1.293909 1.189379
H -4.685265 0.444079 1.361281
H -0.533648 1.944519 -1.245891
H -2.207697 2.347249 -1.676653
H 2.256564 -1.504428 2.063854
H 2.984852 -2.460138 0.773587
H -6.484135 0.262501 -0.438771
H -6.128186 -1.480981 -0.608082
H -6.815945 -0.854224 0.915742
H -2.135829 4.358478 -0.106966
H -0.453558 3.946544 0.335723
H -0.839043 4.451493 -1.331668
H 4.616709 1.761355 0.554495
H 5.807083 1.085171 1.739222
H 6.723763 -0.424891 -0.101061
H 5.560975 0.302547 -1.260595
H 6.868473 1.299980 -0.556748


