%chk=000272491.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272491

0 1
O 2.837264 2.042335 -1.234205
O -3.667193 -2.227167 0.035431
O -1.599711 3.126225 -1.158639
O -0.590955 3.413607 -3.136076
O -2.048905 -1.771611 1.550697
N -0.182836 0.544652 -1.604625
C 0.417260 1.899717 -1.442141
C 1.765447 2.025013 -2.187688
C -1.113049 0.201199 -0.483845
C -1.774294 -1.146850 -0.805759
C -0.590866 2.867712 -2.061364
C 3.468711 0.774760 -0.954159
C 2.654418 -0.067654 -0.009661
C -2.450635 -1.711448 0.411254
C 2.377582 -1.408084 -0.312097
C 2.179265 0.490625 1.186228
C 1.607337 -2.176378 0.566468
C 1.411526 -0.281099 2.061460
C -4.512007 -2.837303 1.063039
C 1.115012 -1.612354 1.747494
C -5.185131 -1.757058 1.883047
H 0.584501 2.193664 -0.365929
H 1.867831 3.020855 -2.671956
H 1.904832 1.245128 -2.954239
H 0.565707 -0.159455 -1.662452
H -1.888935 1.001090 -0.409012
H -0.603439 0.149954 0.507312
H -2.492294 -1.033202 -1.649860
H -1.023752 -1.886255 -1.164606
H 4.415148 1.112600 -0.479054
H 3.706146 0.258580 -1.900515
H 2.763421 -1.857204 -1.225232
H 2.408756 1.530544 1.421632
H -2.294138 3.737356 -1.523655
H 1.391321 -3.217337 0.331329
H 1.037754 0.153444 2.988141
H -3.887602 -3.510622 1.676214
H -5.216877 -3.413138 0.435651
H 0.483615 -2.201504 2.415156
H -5.939889 -2.176684 2.558379
H -5.682728 -1.016421 1.243522
H -4.454415 -1.213431 2.500913


%chk=000272491-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272491

0 1
O 1.841880 1.244889 0.169559
O -4.518554 -1.049455 2.059384
O -1.795225 2.371027 -2.764454
O 0.069256 1.374687 -3.718779
O -4.916656 0.849484 0.760351
N -0.783027 0.565345 -0.562711
C -0.050277 1.660162 -1.245259
C 1.453780 1.344330 -1.244491
C -2.092239 0.928514 0.024129
C -2.747988 -0.335349 0.609200
C -0.534249 1.765569 -2.696304
C 3.286389 0.984382 0.361321
C 3.729180 -0.384338 -0.130686
C -4.154928 -0.078788 1.118473
C 4.651196 -0.510200 -1.198570
C 3.215393 -1.560410 0.475212
C 5.058814 -1.786165 -1.652927
C 3.615441 -2.835531 0.021502
C -5.914454 -0.971385 2.593490
C 4.541095 -2.951474 -1.043667
C -6.894462 -1.688441 1.660486
H -0.213833 2.646308 -0.750237
H 2.020845 2.154822 -1.747193
H 1.645021 0.393064 -1.777349
H -0.153284 0.150082 0.139785
H -2.739840 1.346855 -0.763050
H -2.004954 1.711342 0.816106
H -2.800342 -1.105443 -0.185785
H -2.145703 -0.772623 1.426654
H 3.414757 1.079933 1.453579
H 3.875070 1.783624 -0.137300
H 5.050911 0.392571 -1.677635
H 2.496081 -1.469872 1.298233
H -2.106605 2.380704 -3.710912
H 5.771795 -1.869883 -2.480676
H 3.211287 -3.736877 0.495871
H -6.183768 0.092431 2.717292
H -5.842423 -1.463939 3.576389
H 4.853367 -3.941160 -1.395361
H -7.903277 -1.697505 2.113663
H -6.583138 -2.733634 1.490510
H -6.959130 -1.170856 0.688753


