%chk=000298221.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298221

0 1
O -3.028698 0.066394 0.884835
O 0.001733 -1.300553 0.413907
O 0.082349 0.719754 1.608425
O -1.330055 -3.188471 -0.956329
O -1.943139 1.317087 -0.780295
C -1.269697 -1.700224 0.961407
C -2.037145 -0.586822 1.695572
C -2.045832 -2.144688 -0.307938
C -2.222202 -0.946163 -1.246112
C -2.846243 0.243853 -0.523688
C -1.117527 0.454184 2.348088
C 0.824659 -0.439491 1.221013
C 1.880735 0.068165 0.271419
C 1.494263 0.906999 -0.783976
C 3.222427 -0.296337 0.439637
C -2.344479 2.599412 -0.257125
C 2.459782 1.384622 -1.673933
C 4.181537 0.185190 -0.455870
C 3.801199 1.023737 -1.510060
H -1.066998 -2.559401 1.638332
H -2.704002 -1.037653 2.477092
H -3.015207 -2.623638 -0.042357
H -1.218411 -0.641319 -1.637121
H -2.812906 -1.231057 -2.134819
H -3.883221 0.507446 -0.824101
H -1.602409 1.453591 2.354225
H -0.838498 0.159864 3.375412
H 1.170775 -0.994917 2.112087
H -0.401337 -2.901873 -1.146049
H 0.434536 1.177063 -0.887661
H 3.520682 -0.949326 1.257354
H -2.582129 2.517752 0.808912
H -3.192653 2.983975 -0.829097
H -1.448526 3.213267 -0.408646
H 2.166041 2.036799 -2.494348
H 5.226308 -0.093274 -0.332729
H 4.552688 1.395853 -2.204565


%chk=000298221-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298221

0 1
O -3.009203 0.191092 0.954877
O -0.098935 -1.183095 0.207812
O 0.066069 0.737823 1.662215
O -1.570704 -3.318340 -0.949986
O -1.921244 1.257149 -0.956756
C -1.310791 -1.692771 0.891893
C -2.042526 -0.618469 1.726129
C -2.209173 -2.203283 -0.244899
C -2.545403 -1.049002 -1.218140
C -2.902260 0.280603 -0.512950
C -1.042559 0.258707 2.502911
C 0.788498 -0.397447 1.076209
C 1.905398 0.139624 0.221439
C 1.581475 0.910949 -0.922934
C 3.256169 -0.110739 0.550301
C -2.162955 2.612907 -0.442459
C 2.616175 1.427891 -1.730930
C 4.290840 0.409215 -0.260891
C 3.971339 1.179175 -1.402584
H -1.016777 -2.532616 1.557317
H -2.678476 -1.142549 2.468796
H -3.124408 -2.638501 0.191459
H -1.658401 -0.851819 -1.843194
H -3.368619 -1.365782 -1.879601
H -3.918460 0.643281 -0.770311
H -1.546164 1.160193 2.885407
H -0.637996 -0.329510 3.358658
H 1.149919 -1.053076 1.905766
H -0.673395 -3.003135 -1.237310
H 0.525529 1.086956 -1.157887
H 3.502751 -0.708260 1.436854
H -2.002373 2.652919 0.648784
H -3.193977 2.949579 -0.679111
H -1.431571 3.259727 -0.950912
H 2.370248 2.023526 -2.617333
H 5.338149 0.214511 -0.004768
H 4.772214 1.582366 -2.032974


