%chk=000247512.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247512

0 1
O 0.036382 -0.558231 0.806532
O 2.486846 2.655850 -1.513399
O -0.244360 1.456450 -2.111619
O 4.932224 -0.624745 0.954292
O -5.704399 -1.937515 -0.008456
O 0.550932 -2.709533 1.390308
O 4.703945 2.926637 -2.025986
O 4.297880 -1.829692 2.794719
O -4.078667 -3.506133 0.248988
C -2.238905 2.538974 -0.439396
C -0.832755 2.231371 0.086329
C -3.144982 1.342521 -0.323737
C 0.045641 1.545765 -0.941058
C 1.315162 0.989524 -0.381776
C 1.306073 -0.130853 0.473282
C 2.575322 1.525971 -0.716572
C -4.091568 1.264868 0.709530
C -3.033543 0.291506 -1.252198
C 2.475198 -0.709620 0.973425
C 3.770781 0.991222 -0.243451
C 3.688827 -0.133979 0.593713
C -4.922214 0.147368 0.829930
C -3.850033 -0.834069 -1.151256
C -4.782059 -0.877199 -0.109188
C -0.286136 -1.864512 1.270978
C 3.567200 3.274386 -2.170650
C 5.159703 -1.507608 2.028548
C -1.743202 -1.858809 1.509943
C 2.975530 4.360978 -2.991719
C -5.250106 -3.241843 0.144369
C 6.600877 -1.861905 1.974847
C -6.433426 -4.140249 0.161888
H -2.175408 2.860486 -1.504874
H -2.659171 3.406038 0.107357
H -0.327735 3.163861 0.412322
H -0.890598 1.596831 0.999770
H -4.183903 2.078559 1.428010
H -2.290774 0.359699 -2.056008
H 2.436662 -1.586325 1.631508
H 4.744965 1.405939 -0.515247
H -5.665985 0.073659 1.619529
H -3.765244 -1.657754 -1.857157
H -2.214010 -0.875381 1.328254
H -1.981784 -2.171253 2.538332
H -2.264347 -2.577622 0.835256
H 3.265957 5.351515 -2.606130
H 3.328131 4.295565 -4.035086
H 1.870690 4.321607 -3.014559
H 7.144841 -1.313827 1.185003
H 6.729234 -2.939282 1.775121
H 7.095032 -1.644928 2.935979
H -7.385531 -3.589621 0.074193
H -6.468143 -4.726374 1.094770
H -6.388345 -4.861287 -0.671400


%chk=000247512-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247512

0 1
O 0.111345 -0.237685 1.513223
O 2.660882 2.665761 -1.472354
O -0.068975 2.145884 -1.728014
O 5.025204 -0.657404 1.049090
O -5.394144 -1.994348 -0.880579
O 0.402896 -2.523444 1.008593
O 2.891675 1.260480 -3.343230
O 4.483524 -1.815312 3.033055
O -4.306377 -3.175518 0.831377
C -2.280113 2.804694 -0.020847
C -0.881199 2.447247 0.550947
C -3.137949 1.569582 -0.262398
C 0.096932 1.912123 -0.496301
C 1.342109 1.200997 -0.024653
C 1.352678 0.150203 0.932572
C 2.606610 1.565513 -0.572509
C -4.003285 1.084582 0.752607
C -3.058310 0.850564 -1.483913
C 2.534604 -0.497219 1.347685
C 3.802369 0.949814 -0.185689
C 3.755219 -0.081066 0.776699
C -4.751595 -0.098828 0.575187
C -3.796700 -0.337555 -1.676574
C -4.624083 -0.803084 -0.637964
C -0.278864 -1.632652 1.537039
C 2.682119 2.391788 -2.882590
C 5.307494 -1.511618 2.151711
C -1.585865 -1.779197 2.267482
C 2.413249 3.670518 -3.631286
C -5.159478 -3.136039 -0.077542
C 6.746115 -1.959736 2.055316
C -6.070623 -4.258612 -0.515511
H -2.139110 3.364779 -0.962391
H -2.785248 3.476783 0.697380
H -0.399313 3.362775 0.960007
H -0.956199 1.736729 1.390415
H -4.093577 1.639122 1.694767
H -2.399817 1.217243 -2.277977
H 2.498410 -1.297286 2.084387
H 4.756075 1.254889 -0.621023
H -5.414706 -0.470302 1.362381
H -3.731914 -0.901062 -2.612347
H -1.899623 -0.829392 2.722273
H -1.476945 -2.554771 3.045623
H -2.375150 -2.129812 1.577448
H 2.939921 4.518121 -3.164110
H 2.709554 3.561049 -4.684580
H 1.328553 3.874944 -3.576432
H 7.417882 -1.084823 2.025952
H 6.902561 -2.523503 1.119138
H 6.992687 -2.594873 2.917786
H -7.112678 -3.904359 -0.581613
H -5.995222 -5.096906 0.191527
H -5.776902 -4.602776 -1.523140


