%chk=000219124.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219124

0 1
O -1.618887 -0.142347 0.762598
O 1.653644 0.285889 0.800674
C -3.809220 -0.361940 -0.036263
C 3.870311 0.444492 0.062264
C -2.822631 0.486582 0.531403
C 2.863920 -0.357539 0.661899
C -0.562483 0.607783 1.433513
C 0.574243 -0.409728 1.493384
C -3.540650 -1.784683 -0.324423
C 3.613300 1.839182 -0.347818
C -5.058893 0.197651 -0.323461
C 5.128468 -0.134213 -0.136284
C -3.079897 1.833043 0.813059
C 3.109883 -1.676717 1.058996
C -2.393162 -2.160229 -1.043430
C 2.491422 2.154121 -1.133279
C -4.441139 -2.772307 0.108686
C 4.499584 2.859759 0.035322
C -5.328951 1.544791 -0.051622
C 5.387565 -1.454857 0.251550
C -4.343743 2.354009 0.514924
C 4.382642 -2.217783 0.846923
C -2.159057 -3.505345 -1.335539
C 2.268889 3.471181 -1.539867
C -4.198718 -4.116755 -0.184558
C 4.268768 4.176046 -0.372623
C -3.061273 -4.485878 -0.909247
C 3.157097 4.484152 -1.162858
H -0.284281 1.487778 0.818377
H -0.921258 0.919350 2.427605
H 0.315789 -1.336365 0.941385
H 0.898875 -0.640461 2.520706
H -5.833231 -0.427134 -0.772212
H 5.918417 0.453936 -0.606797
H -2.323007 2.477062 1.247689
H 2.337865 -2.285179 1.517575
H -1.684250 -1.395186 -1.361178
H 1.792939 1.364952 -1.412809
H -5.322907 -2.491154 0.681091
H 5.361025 2.626739 0.658080
H -6.307762 1.956695 -0.285205
H 6.373363 -1.882500 0.085340
H -4.553960 3.402196 0.727569
H 4.584267 -3.245272 1.149779
H -1.271458 -3.790817 -1.897448
H 1.401299 3.709329 -2.152765
H -4.898466 -4.878773 0.153870
H 4.957404 4.963838 -0.072601
H -2.877328 -5.532790 -1.139473
H 2.982235 5.508998 -1.482202


%chk=000219124-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219124

0 1
O -1.467488 -0.025039 1.346136
O 1.480868 0.235177 1.389484
C -3.515545 -0.106302 0.074305
C 3.567466 0.190604 0.179331
C -2.735428 0.530000 1.092888
C 2.748842 -0.351302 1.222132
C -0.663623 0.544489 2.434388
C 0.635847 -0.241797 2.490471
C -3.036627 -1.283652 -0.711198
C 3.128324 1.306350 -0.712157
C -4.809232 0.423933 -0.173434
C 4.860598 -0.372461 0.014984
C -3.241195 1.638187 1.815266
C 3.219116 -1.401129 2.048362
C -1.697934 -1.390603 -1.180876
C 1.805700 1.391167 -1.229484
C -3.949292 -2.321756 -1.051934
C 4.065024 2.303499 -1.105882
C -5.323323 1.527833 0.540821
C 5.338961 -1.419312 0.832540
C -4.533073 2.136523 1.538164
C 4.511923 -1.934286 1.852408
C -1.293029 -2.487835 -1.970396
C 1.439469 2.427411 -2.114526
C -3.543631 -3.422014 -1.837456
C 3.698009 3.343032 -1.987276
C -2.211957 -3.509729 -2.304583
C 2.381909 3.409093 -2.499932
H -0.448130 1.614370 2.244286
H -1.207005 0.442392 3.396891
H 0.423889 -1.323695 2.381640
H 1.145002 -0.061207 3.460176
H -5.410357 -0.028822 -0.969656
H 5.490973 0.006905 -0.796843
H -2.639495 2.117019 2.592636
H 2.590427 -1.809410 2.844690
H -0.976203 -0.611577 -0.922486
H 1.065966 0.643293 -0.932845
H -4.977322 -2.279976 -0.673543
H 5.080804 2.279545 -0.694325
H -6.322323 1.912580 0.311595
H 6.338967 -1.832602 0.665965
H -4.911514 2.998303 2.098740
H 4.862284 -2.750694 2.493413
H -0.257739 -2.543310 -2.325716
H 0.415842 2.466798 -2.504146
H -4.263622 -4.212764 -2.077389
H 4.435681 4.104047 -2.266430
H -1.893871 -4.362623 -2.914658
H 2.093671 4.214951 -3.184243


