%chk=000274877.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274877

0 1
O -0.561128 2.587644 -0.298654
O -3.853363 -2.723896 -0.194105
O -1.916845 -3.598944 0.167014
O -4.515416 1.852789 -1.143395
O -2.900813 3.280384 -0.965531
N 3.284214 0.065129 1.210717
N 1.125400 0.640439 0.390073
N -2.645566 -2.640356 -0.029899
N -3.360800 2.125835 -0.904198
C 5.429737 0.658994 -0.727067
C 4.994456 -0.782343 -0.428231
C 4.289214 1.650748 -0.464242
C 4.407182 -0.896747 0.988132
C 3.712308 1.475738 0.949038
C 2.000618 -0.325673 0.772862
C 1.577811 -1.704252 0.869363
C -0.177649 0.287609 0.138006
C -0.669392 -1.038619 0.216016
C 0.278757 -2.039182 0.598136
C -2.061469 -1.285287 -0.085016
C -1.082523 1.376941 -0.243055
C -2.432148 1.082714 -0.524420
C -2.905964 -0.257861 -0.437128
H 6.308849 0.922991 -0.107739
H 5.763802 0.739990 -1.779100
H 4.246263 -1.111275 -1.175837
H 5.853984 -1.470537 -0.533888
H 4.645218 2.689530 -0.595789
H 3.481836 1.512240 -1.211945
H 4.071108 -1.935901 1.194468
H 5.184943 -0.662023 1.751400
H 4.472353 1.726932 1.721655
H 2.851439 2.165788 1.107816
H 2.301142 -2.464453 1.171763
H -0.047843 -3.087832 0.672481
H -3.972464 -0.448757 -0.661052
H -1.268650 3.329502 -0.576649


%chk=000274877-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274877

0 1
O -0.669995 2.613630 -0.293223
O -4.147226 -2.703085 -0.124520
O -2.151071 -3.668040 0.359364
O -4.748650 1.893524 -0.893080
O -3.022825 3.381224 -0.808419
N 3.252878 0.025890 0.710941
N 1.024095 0.592231 0.268629
N -2.874193 -2.630254 0.083859
N -3.506951 2.146883 -0.714331
C 5.839358 0.732799 -0.466865
C 5.398466 -0.740055 -0.296621
C 4.608175 1.660818 -0.596891
C 4.404238 -0.885212 0.883024
C 3.632789 1.456242 0.585038
C 1.940108 -0.376708 0.553427
C 1.513119 -1.753116 0.691258
C -0.288733 0.262262 0.104784
C -0.807779 -1.086418 0.210293
C 0.176141 -2.090470 0.522486
C -2.225069 -1.295053 0.001436
C -1.189301 1.364884 -0.203359
C -2.574713 1.075578 -0.399073
C -3.084911 -0.241219 -0.296675
H 6.437730 1.038769 0.416618
H 6.497559 0.835201 -1.349523
H 4.910800 -1.096081 -1.225014
H 6.274288 -1.390899 -0.111083
H 4.922128 2.721340 -0.624634
H 4.074483 1.451372 -1.544051
H 4.068094 -1.928497 0.973650
H 4.920329 -0.621477 1.830178
H 4.123865 1.766068 1.531662
H 2.709285 2.039138 0.455107
H 2.222494 -2.546065 0.938089
H -0.142200 -3.126522 0.629197
H -4.149973 -0.426577 -0.451901
H -1.458232 3.245893 -0.517776


