%chk=000245369.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245369

0 1
O -1.208670 2.723078 0.586843
O 3.287949 0.157404 -0.280974
O 2.466741 -1.935382 -0.073896
N -1.171636 0.393521 0.656608
C -2.615623 0.170305 0.888611
C -0.199319 -0.620176 0.466243
C 0.891118 1.461103 0.184828
C -3.356591 -0.122137 -0.425255
C 1.018164 -0.038918 0.195133
C -0.579519 1.702267 0.481650
C -4.845284 -0.386093 -0.165485
C -0.521054 -2.054142 0.579355
C 2.261342 -0.734301 -0.051065
C -5.595259 -0.679522 -1.462122
C 4.609685 -0.429191 -0.547406
C 5.504484 0.774574 -0.750693
H -2.747907 -0.660484 1.615449
H -3.027769 1.094360 1.364833
H 1.543600 1.939873 0.944044
H 1.190022 1.899020 -0.789635
H -2.901259 -0.986940 -0.944390
H -3.240368 0.734422 -1.120394
H -5.301635 0.490513 0.337256
H -4.965509 -1.235648 0.535205
H -1.327467 -2.363886 -0.102342
H -0.824902 -2.332718 1.600522
H 0.368809 -2.677983 0.334727
H -5.197240 -1.564296 -1.971914
H -6.659132 -0.862872 -1.270935
H -5.531134 0.159508 -2.165458
H 4.886057 -1.044243 0.326217
H 4.518224 -1.069420 -1.441573
H 6.536704 0.470686 -0.960394
H 5.156365 1.395657 -1.587405
H 5.514316 1.420760 0.137812


%chk=000245369-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245369

0 1
O -1.340946 2.664105 0.451258
O 3.342239 0.206625 -0.283055
O 2.563110 -1.978732 0.027890
N -1.172646 0.305680 0.600923
C -2.605392 0.068130 0.846249
C -0.158218 -0.674249 0.472004
C 0.843939 1.440485 0.127972
C -3.419294 -0.130396 -0.454475
C 1.052655 -0.060501 0.191903
C -0.652646 1.612457 0.399475
C -4.919609 -0.359949 -0.163950
C -0.463904 -2.131607 0.654951
C 2.327360 -0.736369 -0.012590
C -5.747919 -0.554089 -1.451902
C 4.699979 -0.361643 -0.520230
C 5.637638 0.819161 -0.753442
H -2.716476 -0.808637 1.509969
H -2.986624 0.956836 1.381871
H 1.435726 1.991514 0.881065
H 1.110935 1.875291 -0.851894
H -3.015149 -0.991186 -1.024075
H -3.295466 0.766041 -1.091763
H -5.317281 0.504535 0.405128
H -5.038581 -1.248123 0.490485
H -1.264528 -2.464416 -0.031468
H -0.807495 -2.337927 1.686845
H 0.446479 -2.718710 0.463550
H -5.390532 -1.428688 -2.027361
H -6.816887 -0.714999 -1.222127
H -5.673038 0.332896 -2.108139
H 4.988451 -0.963559 0.360853
H 4.648934 -1.039485 -1.392016
H 6.664252 0.452601 -0.936810
H 5.318592 1.410205 -1.629181
H 5.658645 1.485402 0.126090


