%chk=000274859.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274859

0 1
O -3.785294 -0.058377 -2.863617
O 6.577851 1.475721 0.954023
O 6.878663 -0.616641 1.668378
N 1.198653 -0.856503 -1.490544
N -2.149698 -1.068737 -0.731096
N -3.028955 -0.503055 1.905393
N -4.952698 0.592482 1.020511
N -5.312017 0.767387 -1.371854
N -6.982142 1.512087 0.132213
C 0.466742 -2.124488 -1.259385
C -0.161153 -2.235117 0.145525
C 2.391309 -0.585047 -0.824900
C -1.430776 -1.458257 0.340778
C 0.397396 0.250903 -2.065409
C 3.109248 -1.630024 -0.172453
C 2.955134 0.723404 -0.840721
C -1.882989 -1.161659 1.671218
C -3.302931 -0.384526 -0.521034
C -3.751883 -0.108321 0.799381
C 4.330452 -1.369824 0.425419
C 4.177207 0.964500 -0.236325
C 4.879014 -0.071727 0.410763
C -4.107006 0.084945 -1.715517
C -5.715415 0.963616 -0.129717
C 6.162963 0.156527 1.065657
H 1.172243 -2.975425 -1.412455
H -0.322982 -2.229188 -2.044061
H -0.374561 -3.308960 0.351861
H 0.587026 -1.924867 0.909932
H -0.511236 -0.143300 -2.562139
H 0.986522 0.781915 -2.833454
H 0.066824 0.972797 -1.301036
H 2.719133 -2.643308 -0.163000
H 2.437412 1.541695 -1.332473
H -1.301594 -1.467866 2.552416
H 4.885366 -2.173618 0.920581
H 4.611750 1.969555 -0.250911
H -5.292500 0.701558 1.978037
H -7.490674 1.834541 -0.693383
H -7.086605 2.124830 0.929669
H 7.452802 1.624973 1.397832


%chk=000274859-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274859

0 1
O -3.437387 0.385925 -2.803209
O 6.704919 1.555022 0.776730
O 6.871810 -0.564194 1.715684
N 1.085021 -0.802704 -1.342342
N -2.112481 -1.028506 -0.683521
N -3.200341 -0.729750 1.928386
N -5.007873 0.480236 1.002746
N -5.182502 0.980598 -1.354131
N -6.864662 1.646792 0.116701
C 0.449087 -2.127197 -1.207059
C -0.222145 -2.381172 0.170329
C 2.329146 -0.544724 -0.771059
C -1.487624 -1.573289 0.398382
C 0.425463 0.220158 -2.180167
C 3.032400 -1.536956 -0.002239
C 2.964776 0.733093 -0.936565
C -2.037622 -1.397343 1.704703
C -3.262715 -0.326172 -0.488905
C -3.806502 -0.206977 0.823860
C 4.282168 -1.258339 0.563006
C 4.214329 0.999992 -0.361935
C 4.896500 0.013702 0.401156
C -3.945134 0.359638 -1.649551
C -5.658462 1.025333 -0.112918
C 6.207478 0.253654 1.023529
H 1.197270 -2.923285 -1.386844
H -0.319485 -2.214400 -1.991039
H -0.472100 -3.461510 0.235348
H 0.493728 -2.179794 0.988670
H -0.570598 -0.137575 -2.478389
H 1.023142 0.447077 -3.085540
H 0.276949 1.162708 -1.618763
H 2.605581 -2.532815 0.144022
H 2.477301 1.514417 -1.524589
H -1.532900 -1.803819 2.587447
H 4.811319 -2.022104 1.143319
H 4.682036 1.979305 -0.499836
H -5.362315 0.560535 1.960193
H -7.323256 2.051977 -0.696897
H -7.311904 1.695877 1.028472
H 7.588186 1.631183 1.226916


