%chk=000277941.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277941

0 1
O 2.774973 1.274381 0.306198
O 2.841071 -1.472301 1.279225
O -3.916700 -1.311564 -0.320586
O 1.190503 2.838323 0.262179
O 3.232092 -1.231209 -0.921601
O -3.836682 0.912856 -0.147939
N -1.364420 2.040240 0.070968
C 0.544134 0.516463 0.068433
C -0.875775 0.773043 0.005288
C 0.992510 -0.809779 -0.013245
C -1.770629 -0.349274 -0.129736
C 0.117607 -1.885896 -0.145299
C -1.258345 -1.647409 -0.200867
C 1.457941 1.649390 0.213764
C 2.462238 -1.146912 0.001018
C -3.214997 -0.134508 -0.193008
H 0.494934 -2.907287 -0.201632
H -1.953838 -2.492147 -0.302597
H -0.745915 2.853701 0.160731
H -2.371266 2.227673 0.027369
H 3.390141 2.057970 0.373808
H 3.812865 -1.689739 1.342906
H -4.901842 -1.153015 -0.363277


%chk=000277941-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000277941

0 1
O 2.798350 1.324048 0.360617
O 2.928374 -1.512302 1.294904
O -3.966816 -1.327761 -0.330654
O 1.121571 2.901617 0.266545
O 3.197002 -1.314207 -1.005693
O -3.836585 0.975959 -0.174775
N -1.381904 2.053389 0.046009
C 0.546770 0.529270 0.082385
C -0.886124 0.784978 0.000175
C 1.024298 -0.810074 0.018117
C -1.781181 -0.351184 -0.128769
C 0.129774 -1.896450 -0.110662
C -1.253397 -1.660130 -0.179030
C 1.455816 1.677896 0.236033
C 2.488369 -1.180940 0.012466
C -3.234290 -0.140309 -0.207934
H 0.516979 -2.917388 -0.159556
H -1.951810 -2.495407 -0.275106
H -0.714724 2.830964 0.131166
H -2.401735 2.171043 -0.011625
H 3.347903 2.149109 0.433373
H 3.886858 -1.781793 1.252406
H -4.932899 -1.097328 -0.378291


