%chk=000266003.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266003

0 1
O 1.934593 -0.092966 1.831696
O 1.428951 -2.183129 2.540616
N 0.565267 -1.325710 0.484694
N 1.673659 0.754967 0.705627
N -4.227759 3.084603 0.124878
C 0.634588 0.034650 -0.149680
C -0.659079 0.801309 -0.063729
C 1.290253 -1.339977 1.695856
C -0.222669 -2.405588 -0.030170
C 2.926074 1.033373 0.017313
C -1.256512 1.286473 -1.236833
C -1.271370 1.061619 1.172487
C -3.082548 2.249870 0.057748
C -2.452525 1.992826 -1.186629
C -2.467714 1.766457 1.238965
C -0.298192 -3.617803 0.684209
C -0.894733 -2.261632 -1.258379
C 2.863004 1.899700 -1.089938
C 4.160506 0.563727 0.491874
C -1.039800 -4.675046 0.159335
C -1.631653 -3.335989 -1.763031
C 4.048065 2.282377 -1.720758
C 5.334729 0.956903 -0.153542
C -1.707433 -4.542746 -1.063500
C 5.282204 1.810575 -1.260161
C -5.069250 3.182313 -1.098468
C -5.051016 3.010946 1.362096
H 0.979292 -0.079154 -1.214649
H -0.785155 1.112411 -2.204789
H -0.798350 0.709859 2.093019
H -2.891567 2.361521 -2.110637
H -2.915324 1.955842 2.212268
H 0.216000 -3.738232 1.642599
H -0.863671 -1.330472 -1.815887
H 1.906466 2.291030 -1.433256
H 4.197407 -0.091804 1.364101
H -1.097662 -5.613670 0.711639
H -2.152841 -3.225581 -2.713929
H 4.009124 2.956900 -2.575704
H 6.296253 0.595368 0.210974
H -2.282321 -5.373616 -1.464546
H 6.200924 2.112478 -1.759276
H -4.447436 3.502576 -1.953508
H -5.838002 3.959821 -0.955238
H -5.571597 2.238686 -1.363916
H -5.827221 3.793507 1.336120
H -4.416700 3.220848 2.242392
H -5.541759 2.035683 1.508446


%chk=000266003-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266003

0 1
O 1.749614 0.218274 1.918075
O 1.361897 -1.953019 2.698379
N 0.553908 -1.189055 0.565862
N 1.618305 0.891079 0.592197
N -4.546337 2.962272 0.182826
C 0.502683 0.144889 -0.108564
C -0.839313 0.845122 -0.013991
C 1.218205 -1.118145 1.786688
C -0.064862 -2.356699 0.014526
C 2.897020 0.976654 -0.074341
C -1.346434 1.534690 -1.140539
C -1.598963 0.872946 1.181103
C -3.334475 2.271870 0.116423
C -2.564021 2.235409 -1.090723
C -2.816465 1.567611 1.253144
C 0.062370 -3.622372 0.649217
C -0.799187 -2.253810 -1.197663
C 2.922873 1.502815 -1.395134
C 4.112141 0.659922 0.583238
C -0.531821 -4.759293 0.063771
C -1.385475 -3.402406 -1.769060
C 4.155044 1.669195 -2.059744
C 5.337473 0.839231 -0.095259
C -1.255616 -4.663584 -1.146639
C 5.370935 1.335797 -1.417993
C -5.052994 3.672193 -0.998186
C -5.307966 2.995995 1.438529
H 0.796110 0.033325 -1.168818
H -0.778993 1.530400 -2.081743
H -1.238150 0.348065 2.073023
H -2.915033 2.752828 -1.987433
H -3.369803 1.561883 2.195866
H 0.612329 -3.708463 1.588358
H -0.943069 -1.286074 -1.684504
H 1.993753 1.816863 -1.883553
H 4.090083 0.284383 1.608723
H -0.424279 -5.728643 0.563057
H -1.950685 -3.304575 -2.702552
H 4.163613 2.074671 -3.077735
H 6.271505 0.585505 0.418410
H -1.712807 -5.552745 -1.593230
H 6.325957 1.470949 -1.936247
H -4.360514 4.473690 -1.328417
H -6.020326 4.140034 -0.757586
H -5.212469 2.984890 -1.853899
H -6.221526 3.594136 1.296276
H -4.725231 3.456901 2.261784
H -5.613505 1.980496 1.762875


