%chk=000207817.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207817

0 1
O 0.679310 -2.048564 0.590450
O -5.876704 0.081781 -1.056389
O -5.820060 0.683605 1.021424
N 1.248937 0.019375 -0.237425
N -5.298375 0.266673 0.001198
C 2.674652 -0.190070 -0.133662
C 0.802179 1.381135 -0.671198
C 3.517516 0.927840 0.100493
C 0.329270 -0.949766 0.203858
C 1.650817 2.476794 -0.089968
C 2.926676 2.259065 0.254594
C 3.229026 -1.473926 -0.268194
C -1.132388 -0.582225 0.132238
C 4.903782 0.733641 0.181174
C 4.611930 -1.640349 -0.183031
C 5.450495 -0.542490 0.037769
C -1.840154 -0.787927 -1.059036
C -1.775869 -0.111806 1.284182
C -3.207946 -0.513686 -1.105130
C -3.143357 0.165772 1.246011
C -3.845711 -0.033154 0.048202
H -0.265010 1.544507 -0.400600
H 0.864350 1.422032 -1.788420
H 1.166892 3.445106 0.008244
H 3.564532 3.043056 0.662318
H 2.584013 -2.344002 -0.422281
H 5.557560 1.587291 0.358600
H 5.038736 -2.638115 -0.289173
H 6.527756 -0.683963 0.101417
H -1.328897 -1.172189 -1.944277
H -1.214333 0.025917 2.211399
H -3.784769 -0.670758 -2.024049
H -3.670155 0.531399 2.135265


%chk=000207817-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207817

0 1
O 0.672843 -1.559977 1.351956
O -5.860053 0.037924 -1.336344
O -6.125243 -0.051687 0.927936
N 1.261891 0.175022 -0.124196
N -5.393357 -0.054150 -0.135461
C 2.670471 -0.147531 -0.107083
C 0.888093 1.476790 -0.752869
C 3.611058 0.929143 -0.053489
C 0.332871 -0.617184 0.571411
C 1.825165 2.592173 -0.322781
C 3.119695 2.311974 -0.012113
C 3.127622 -1.485473 -0.129092
C -1.141449 -0.362486 0.348917
C 4.997309 0.631260 -0.022687
C 4.512637 -1.757520 -0.107521
C 5.453027 -0.701848 -0.051956
C -1.708967 -0.266392 -0.949817
C -1.993467 -0.386624 1.484038
C -3.103605 -0.175258 -1.117055
C -3.387408 -0.273216 1.336328
C -3.922087 -0.166797 0.032818
H -0.146457 1.719073 -0.467419
H 0.910033 1.375364 -1.860672
H 1.431479 3.614119 -0.313517
H 3.821653 3.107744 0.262449
H 2.410719 -2.308166 -0.144486
H 5.714507 1.459414 0.023723
H 4.854544 -2.797734 -0.129062
H 6.525982 -0.918811 -0.028643
H -1.061346 -0.288937 -1.832658
H -1.547701 -0.510910 2.475382
H -3.563921 -0.112015 -2.106341
H -4.061837 -0.275288 2.196304


