%chk=000281005.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281005

0 1
O 3.766706 -1.668858 -0.215173
N -0.957001 0.301876 0.182002
C 4.260819 0.698660 -0.081817
C 3.791037 1.564456 1.094565
C 5.697555 0.217847 0.158525
C 4.176829 1.472637 -1.405423
C 3.332104 -0.536901 -0.192269
C 1.866351 -0.266724 -0.274592
C 0.968485 -1.164955 0.146462
C -0.492449 -0.947804 0.089812
C -3.248538 -0.574760 -0.006180
C -2.331519 0.505397 0.138536
C -1.358186 -2.090130 -0.055073
C -2.713951 -1.897490 -0.105139
C -4.648785 -0.294712 -0.045465
C -2.825286 1.848258 0.243391
C -5.097548 0.998452 0.055769
C -4.176063 2.079022 0.201746
H 2.772879 1.945463 0.951880
H 4.445285 2.434124 1.225706
H 3.802949 1.005584 2.037477
H 6.401114 1.053814 0.202860
H 5.780643 -0.343723 1.097018
H 6.027550 -0.462685 -0.637583
H 3.172725 1.868552 -1.592382
H 4.863286 2.327780 -1.400369
H 4.453669 0.842821 -2.259185
H 1.568203 0.701362 -0.686084
H 1.282500 -2.133529 0.555903
H -0.919844 -3.083341 -0.129059
H -3.399907 -2.737668 -0.218711
H -5.345759 -1.124427 -0.156613
H -2.101834 2.657058 0.355388
H -6.162964 1.223436 0.026951
H -4.570157 3.092408 0.279826


%chk=000281005-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281005

0 1
O 3.745416 -1.701533 -0.015964
N -0.995823 0.295247 -0.008015
C 4.309318 0.697312 -0.019937
C 4.055028 1.565372 1.248866
C 5.766538 0.182818 -0.017108
C 4.054616 1.550436 -1.299456
C 3.327290 -0.502323 -0.015646
C 1.865362 -0.199342 -0.012378
C 0.929851 -1.195890 -0.011206
C -0.525297 -0.980526 -0.007981
C -3.315516 -0.605684 -0.002103
C -2.363885 0.492795 -0.005083
C -1.403490 -2.124231 -0.005908
C -2.783305 -1.936317 -0.002780
C -4.717741 -0.318548 0.001155
C -2.856918 1.839659 -0.004558
C -5.167946 1.004025 0.001545
C -4.230618 2.088494 -0.001346
H 3.026247 1.966431 1.284120
H 4.752150 2.424143 1.253927
H 4.226687 0.979904 2.170546
H 6.469443 1.036396 -0.024126
H 5.967201 -0.434471 0.875647
H 5.965768 -0.448316 -0.900324
H 3.024184 1.946621 -1.341013
H 4.748441 2.411790 -1.312655
H 4.230598 0.954855 -2.213763
H 1.524356 0.841552 -0.010919
H 1.287016 -2.235325 -0.012933
H -0.969773 -3.129488 -0.006715
H -3.467059 -2.792994 -0.000848
H -5.432898 -1.150049 0.003385
H -2.121140 2.649568 -0.006811
H -6.241923 1.219593 0.004097
H -4.601279 3.119328 -0.001012


