%chk=000276807.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276807

0 1
O 0.630843 -0.407952 -2.081533
O 3.458333 -1.133157 -0.074504
O 3.633943 0.998628 -0.829878
O 0.541986 1.750696 2.097892
O -5.212109 0.198353 0.048518
O -3.815633 1.386306 -1.099394
N 0.937002 1.475044 -0.124363
N -4.096285 0.440969 -0.379395
C 0.700236 -0.936687 -0.746189
C 1.486718 0.131145 0.066358
C -0.686332 -1.145211 -0.179246
C 2.964167 0.120846 -0.354672
C -1.725309 -0.284555 -0.550083
C -0.926971 -2.180197 0.736622
C -2.999171 -0.477516 0.000830
C -2.204774 -2.362617 1.276623
C 0.492528 2.227183 0.977234
C -3.251436 -1.513044 0.913988
C 4.878775 -1.388480 -0.329789
C -0.032754 3.587259 0.637529
C 5.715269 -0.767217 0.767296
H 1.282232 -1.891488 -0.776764
H 1.436601 -0.142580 1.169120
H 0.933145 1.824862 -1.081533
H -1.542357 0.532759 -1.260328
H -0.114971 -2.845646 1.038104
H 0.187504 -1.044091 -2.681383
H -2.383776 -3.168363 1.990453
H -4.256244 -1.640857 1.331520
H 5.128032 -0.996431 -1.331948
H 4.893999 -2.493436 -0.321019
H -0.338215 4.114463 1.557591
H 0.718827 4.217517 0.140909
H -0.917597 3.545568 -0.014758
H 6.767084 -1.067812 0.690290
H 5.684036 0.332378 0.719920
H 5.357179 -1.056040 1.764181


%chk=000276807-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276807

0 1
O 0.827940 -0.634109 -1.997355
O 3.581623 -1.127465 -0.093120
O 3.563151 1.086229 -0.837775
O 0.153712 1.467018 2.211091
O -5.257685 0.380686 -0.248643
O -3.667989 1.449847 -1.484163
N 0.932180 1.403332 0.023287
N -4.040883 0.536119 -0.649372
C 0.739258 -1.027984 -0.581518
C 1.530109 0.087312 0.175159
C -0.697540 -1.142041 -0.096396
C 2.986828 0.109022 -0.316078
C -1.693230 -0.288168 -0.619319
C -1.044283 -2.079949 0.908191
C -3.005806 -0.384024 -0.115237
C -2.368432 -2.164046 1.394385
C 0.287533 2.032937 1.083289
C -3.368928 -1.312044 0.884656
C 5.012252 -1.269609 -0.521957
C -0.258245 3.419937 0.771007
C 5.956216 -0.782672 0.579514
H 1.275758 -1.982909 -0.410002
H 1.511647 -0.152969 1.255322
H 1.104038 1.898578 -0.853630
H -1.456639 0.439023 -1.399591
H -0.272826 -2.743297 1.318028
H 0.359748 -1.303120 -2.556968
H -2.620183 -2.891548 2.172267
H -4.401870 -1.348303 1.240128
H 5.150796 -0.698601 -1.456463
H 5.116508 -2.349201 -0.714054
H -0.490820 3.933253 1.715480
H 0.461409 4.027254 0.193283
H -1.189778 3.338667 0.179799
H 7.003871 -0.971001 0.279939
H 5.837311 0.300591 0.747991
H 5.767755 -1.316145 1.527022


