%chk=000223958.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223958

0 1
O -4.558629 0.212515 -0.799059
O -3.784386 0.794407 1.240665
O -7.617888 -0.871554 -0.249406
N -6.409780 -0.349131 1.597238
C 2.732284 -0.375910 -0.257494
C 3.990163 0.329456 0.267374
C 1.455710 0.338398 0.206274
C 5.267379 -0.384102 -0.196058
C 6.525444 0.320959 0.328806
C 0.198037 -0.367411 -0.318641
C 7.802525 -0.392349 -0.134705
C -1.074034 0.349653 0.148630
C 9.061928 0.311750 0.389843
C -2.330160 -0.350935 -0.382513
C 10.336191 -0.393928 -0.068745
C -3.572327 0.289536 0.159970
C -5.865835 0.811206 -0.524403
C -6.437937 1.086341 -1.898305
C -6.712894 -0.227663 0.248105
H 2.721539 -1.428642 0.085388
H 2.760020 -0.419448 -1.363478
H 3.964184 0.372872 1.373417
H 4.002608 1.382312 -0.074880
H 1.469054 1.391525 -0.135868
H 1.430307 0.382014 1.312684
H 5.294746 -0.427477 -1.301975
H 5.256265 -1.436881 0.146359
H 6.537379 1.373776 -0.013366
H 6.499025 0.364081 1.434758
H 0.225889 -0.410440 -1.425003
H 0.188755 -1.420446 0.024504
H 7.792582 -1.445271 0.206684
H 7.831063 -0.436110 -1.240390
H -1.108350 0.388846 1.257897
H -1.061281 1.406058 -0.186602
H 9.036105 0.354108 1.496347
H 9.074468 1.365015 0.047402
H -2.331884 -1.426645 -0.094361
H -2.345808 -0.349448 -1.495525
H 10.412441 -0.419740 -1.161697
H 10.374070 -1.430020 0.286383
H 11.229209 0.115422 0.310294
H -5.713203 1.738190 0.074891
H -6.640416 0.147352 -2.441129
H -7.393533 1.623686 -1.831717
H -5.745255 1.676652 -2.510842
H -6.898653 -1.028361 2.160535
H -5.619517 0.117886 2.029308


%chk=000223958-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223958

0 1
O -4.671061 0.210614 -0.878260
O -3.836653 0.633532 1.258411
O -7.841555 -0.844772 -0.300165
N -6.470728 -0.478144 1.550324
C 2.763335 -0.394571 -0.230141
C 4.041633 0.343412 0.227521
C 1.460463 0.340440 0.157636
C 5.343603 -0.403296 -0.140565
C 6.623815 0.347181 0.291321
C 0.185656 -0.379185 -0.337069
C 7.925296 -0.406019 -0.065325
C -1.113940 0.337751 0.089091
C 9.206324 0.351036 0.354106
C -2.374154 -0.366442 -0.466105
C 10.501192 -0.411351 -0.001630
C -3.663173 0.212591 0.083211
C -6.010173 0.807929 -0.500128
C -6.655426 1.257108 -1.802691
C -6.863050 -0.259255 0.246554
H 2.752414 -1.414821 0.207448
H 2.794259 -0.529611 -1.331755
H 4.004736 0.494696 1.326769
H 4.060464 1.357179 -0.224681
H 1.483672 1.370270 -0.256008
H 1.415673 0.449804 1.261235
H 5.371440 -0.571935 -1.237661
H 5.333315 -1.409884 0.327659
H 6.638613 1.349755 -0.185478
H 6.592667 0.525247 1.386851
H 0.220408 -0.463179 -1.443422
H 0.176262 -1.418363 0.054115
H 7.916400 -1.404846 0.419406
H 7.953747 -0.592735 -1.159527
H -1.180970 0.380140 1.192479
H -1.092687 1.387355 -0.265763
H 9.175712 0.540476 1.446712
H 9.216095 1.347355 -0.133406
H -2.349389 -1.437771 -0.176450
H -2.406402 -0.337571 -1.568647
H 10.571443 -0.585453 -1.092127
H 10.528566 -1.398739 0.496969
H 11.401770 0.149514 0.309670
H -5.799957 1.652156 0.184086
H -6.875351 0.387527 -2.441648
H -7.611990 1.764342 -1.588578
H -5.990702 1.955189 -2.338660
H -6.973729 -1.173379 2.101640
H -5.630286 -0.019169 1.920273


