%chk=000237005.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237005

0 1
O 3.550841 0.181291 1.381838
O 4.523888 0.043886 -0.654920
O 1.219462 0.584724 0.561185
O -1.844204 1.596665 -1.121064
O -0.383154 3.946971 -1.145385
C -1.658639 -3.620729 -1.225198
C -2.508509 -2.985858 -0.115729
C -0.284456 -2.961527 -1.406180
C -3.124022 -1.643350 -0.529848
C 0.640161 -3.202055 -0.205202
C -3.960725 -1.039060 0.606505
C 1.998542 -2.514819 -0.391452
C -4.509208 0.340645 0.220426
C 2.840645 -2.596778 0.888039
C -5.338686 0.956905 1.354879
C 4.233390 -1.975738 0.712373
C -5.877067 2.335236 0.976539
C 4.148890 -0.525911 0.338435
C 3.277674 1.580086 1.161279
C 1.931039 1.759632 0.512341
C 1.462843 2.906696 -0.031347
C 0.140479 2.977381 -0.632123
C -0.056064 0.570836 0.000020
C -0.592743 1.670103 -0.573254
H -2.209587 -3.578844 -2.185787
H -1.525647 -4.698905 -1.008037
H -1.896158 -2.854847 0.798007
H -3.316911 -3.688940 0.167016
H -0.411606 -1.874989 -1.580215
H 0.189830 -3.354592 -2.326920
H -2.331206 -0.930208 -0.834045
H -3.754451 -1.778287 -1.429762
H 0.150137 -2.835761 0.719399
H 0.783656 -4.289391 -0.054461
H -3.347400 -0.954145 1.523843
H -4.795124 -1.719385 0.862967
H 1.847701 -1.451092 -0.670777
H 2.541151 -2.972850 -1.240582
H -3.667450 1.015871 -0.043265
H -5.124421 0.260919 -0.695564
H 2.312306 -2.080262 1.717708
H 2.955106 -3.652629 1.203380
H -4.722048 1.036538 2.271363
H -6.180468 0.285448 1.613658
H 4.816182 -2.087748 1.652502
H 4.805502 -2.513122 -0.076449
H -6.519786 2.287874 0.090266
H -5.065377 3.037538 0.754735
H -6.470562 2.766191 1.790223
H 3.291314 1.997871 2.190809
H 4.083136 2.035972 0.542628
H 2.054754 3.822529 -0.059468
H -0.474727 -0.425061 0.119286
H -2.084025 2.500872 -1.511518


%chk=000237005-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237005

0 1
O 3.707191 0.383502 1.361008
O 4.202589 0.018136 -0.892277
O 1.398136 2.649410 1.838787
O -1.983469 3.063672 0.415697
O -0.691177 2.011568 -1.687744
C -1.652876 -3.983116 -1.468954
C -2.632806 -3.374267 -0.433242
C -0.285637 -3.262969 -1.588601
C -2.996265 -1.895036 -0.696919
C 0.542510 -3.252436 -0.282834
C -4.067773 -1.349837 0.274714
C 1.919687 -2.573595 -0.457523
C -4.354541 0.155265 0.074914
C 2.736711 -2.532782 0.852797
C -5.420033 0.718978 1.042436
C 4.146567 -1.885184 0.695727
C -5.657760 2.233444 0.853333
C 4.048747 -0.438260 0.262806
C 3.512892 1.833244 1.047980
C 2.071360 2.125199 0.734069
C 1.433293 1.901670 -0.469392
C 0.019571 2.191742 -0.630601
C 0.039534 2.969762 1.735448
C -0.645799 2.762756 0.564172
H -2.142270 -3.978625 -2.464757
H -1.475566 -5.048483 -1.212156
H -2.210254 -3.468551 0.588216
H -3.564645 -3.977065 -0.433118
H -0.440229 -2.219397 -1.928924
H 0.308242 -3.759249 -2.383736
H -2.088687 -1.262293 -0.618033
H -3.356510 -1.784789 -1.741285
H -0.020593 -2.724893 0.513569
H 0.683654 -4.295300 0.072182
H -3.735647 -1.521835 1.320627
H -5.007788 -1.927327 0.149251
H 1.766654 -1.543909 -0.840148
H 2.499719 -3.106991 -1.238674
H -3.410252 0.722985 0.210209
H -4.678429 0.332698 -0.972249
H 2.174486 -1.984596 1.633290
H 2.883011 -3.564546 1.228450
H -5.101246 0.522740 2.086796
H -6.372727 0.168739 0.899123
H 4.682980 -1.938687 1.659427
H 4.726000 -2.426228 -0.071825
H -6.004467 2.453663 -0.174573
H -4.723532 2.800833 1.024663
H -6.422231 2.615976 1.554892
H 3.819947 2.359141 1.963595
H 4.156877 2.099546 0.193065
H 2.003842 1.489726 -1.305600
H -0.365636 3.382390 2.657992
H -2.211154 2.805258 -0.532969


