%chk=000270589.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270589

0 1
O 4.896693 -0.057101 0.115580
O -3.219174 2.511476 -1.122921
O -2.949324 2.736060 1.087977
C -0.710040 0.690018 0.505963
C 0.779937 0.456425 0.359895
C -1.084189 1.946475 -0.309413
C -1.488497 -0.559292 0.135078
C 1.652227 0.872258 1.383830
C 1.301866 -0.154804 -0.786417
C -1.340391 -1.688949 0.960694
C -2.335896 -0.631402 -0.976701
C -2.462508 2.424952 0.028614
C 3.023344 0.683519 1.266623
C 2.678031 -0.356543 -0.930158
C 3.525032 0.065943 0.100988
C -2.031343 -2.866835 0.675495
C -3.028172 -1.814726 -1.258837
C -2.878880 -2.933407 -0.436779
C 5.532088 -0.687204 -1.022645
H -0.946571 0.913315 1.585930
H -0.358987 2.762855 -0.087030
H -0.982888 1.754441 -1.400621
H 1.251839 1.347781 2.280238
H 0.627581 -0.487025 -1.578099
H -0.677331 -1.646099 1.824085
H -2.476188 0.230863 -1.630103
H 3.713968 0.996447 2.046406
H 3.063608 -0.834280 -1.824000
H -1.911322 -3.736151 1.320109
H -3.687255 -1.858886 -2.124534
H -3.418538 -3.851730 -0.657198
H -4.145888 2.827684 -0.953540
H 6.591444 -0.650266 -0.736002
H 5.351414 -0.104179 -1.930037
H 5.190207 -1.721034 -1.125171


%chk=000270589-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270589

0 1
O 5.023526 0.068403 0.044846
O -3.234122 2.755869 -1.075451
O -3.046193 2.451791 1.218472
C -0.712417 0.648753 0.531261
C 0.801622 0.427863 0.384230
C -1.114883 1.942816 -0.237689
C -1.529580 -0.589801 0.137199
C 1.696936 1.008004 1.322727
C 1.351043 -0.295741 -0.699422
C -1.505937 -1.715943 1.001774
C -2.286996 -0.677145 -1.057504
C -2.529308 2.385710 0.082081
C 3.090020 0.873002 1.185646
C 2.748347 -0.442009 -0.856619
C 3.621888 0.147107 0.090482
C -2.214582 -2.893542 0.686166
C -2.998366 -1.857709 -1.379583
C -2.965287 -2.970488 -0.511696
C 5.621205 -0.676205 -1.065408
H -0.918216 0.853396 1.601137
H -0.436196 2.755354 0.084835
H -0.988616 1.832731 -1.326588
H 1.296058 1.567429 2.177692
H 0.681185 -0.771383 -1.425071
H -0.921496 -1.664732 1.928930
H -2.342581 0.173370 -1.745459
H 3.782740 1.312021 1.910126
H 3.136746 -1.013345 -1.705341
H -2.185101 -3.748325 1.371401
H -3.580713 -1.903035 -2.307107
H -3.518672 -3.883118 -0.759954
H -4.150591 3.050587 -0.817960
H 6.707087 -0.613071 -0.902304
H 5.363569 -0.220699 -2.041642
H 5.303777 -1.737314 -1.056911


