%chk=000235319.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235319

0 1
O 4.953015 -1.803339 0.260432
O 3.715324 1.885536 1.120067
O 4.238494 -3.007056 -1.477609
O -1.607451 2.369727 1.406537
O -2.224606 2.783879 -0.846783
O -2.035464 -0.570576 -2.525981
O -2.664580 -1.051826 2.225930
O -3.677701 -0.202895 -0.124573
C 3.029543 -0.402806 0.717127
C 2.670128 -1.429126 -0.378493
C 3.048674 1.047731 0.167013
C 4.439106 -0.808984 1.197364
C 1.585325 -2.433634 0.034187
C 3.974179 -2.184982 -0.644095
C 1.656312 1.549631 -0.144354
C 0.202303 -1.837179 0.000806
C 0.730271 1.709825 0.922672
C 1.305315 1.829458 -1.462295
C -0.529334 -1.706361 1.194966
C -0.351821 -1.450713 -1.217101
C -0.526993 2.136733 0.572629
C 0.004365 2.264498 -1.818573
C -0.892527 2.400191 -0.786072
C -1.659330 -0.918250 -1.261105
C -1.828877 -1.193298 1.146032
C -2.418891 -0.791770 -0.081414
C -2.744569 2.654311 0.522383
C -3.256623 0.199678 -2.699367
C -2.140587 -1.382069 3.537522
C -4.757030 -1.098518 0.266596
H 2.305034 -0.461895 1.560770
H 2.353384 -0.916527 -1.322137
H 3.733827 1.126204 -0.714008
H 5.174440 0.016930 1.175923
H 4.443302 -1.299805 2.182235
H 1.815266 -2.856963 1.033454
H 1.613508 -3.308775 -0.660011
H 3.109711 2.188195 1.826935
H 0.993975 1.492640 1.951767
H 2.037635 1.712636 -2.261960
H -0.085521 -2.008348 2.135153
H 0.195979 -1.549981 -2.152032
H -0.262214 2.464069 -2.852614
H -3.417536 1.775423 0.546875
H -3.155522 3.626905 0.814198
H -3.217464 1.106375 -2.079021
H -4.122495 -0.415918 -2.443236
H -3.220463 0.434807 -3.768563
H -3.000595 -1.156487 4.181589
H -1.292302 -0.735191 3.779072
H -1.877218 -2.442216 3.585882
H -4.648531 -1.359108 1.326293
H -5.643244 -0.480494 0.095618
H -4.757227 -1.990193 -0.363531


%chk=000235319-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235319

0 1
O 4.956456 -1.691832 0.133149
O 3.602370 1.673582 1.680199
O 4.232794 -2.588460 -1.882971
O -1.661512 2.475144 1.456975
O -2.147008 2.972861 -0.838100
O -2.348843 -0.983776 -2.641924
O -2.592189 -0.969507 2.242204
O -3.810658 -0.413015 -0.152864
C 2.959994 -0.470720 0.813923
C 2.624066 -1.358701 -0.412515
C 3.070544 1.035458 0.454217
C 4.313139 -1.040904 1.315636
C 1.589179 -2.503611 -0.146770
C 3.976733 -1.954384 -0.845965
C 1.728755 1.632297 0.056319
C 0.153849 -1.995121 -0.124811
C 0.727258 1.788589 1.062186
C 1.454299 1.978383 -1.287926
C -0.525501 -1.765572 1.098682
C -0.496638 -1.705560 -1.341206
C -0.523469 2.238019 0.651321
C 0.172395 2.447257 -1.692777
C -0.803887 2.545489 -0.700557
C -1.814093 -1.184625 -1.364345
C -1.838245 -1.242569 1.088127
C -2.505652 -0.963983 -0.141927
C -2.775607 2.690095 0.491109
C -3.291485 0.126989 -2.895473
C -1.909558 -1.071176 3.533864
C -4.876200 -1.315458 0.342312
H 2.191571 -0.559890 1.601711
H 2.237312 -0.759714 -1.256894
H 3.797127 1.163570 -0.378720
H 4.996745 -0.261126 1.678719
H 4.182050 -1.819137 2.088204
H 1.839879 -3.009442 0.805426
H 1.708236 -3.249011 -0.955420
H 3.569583 2.656440 1.562554
H 0.942344 1.554980 2.108369
H 2.241602 1.874594 -2.043791
H -0.026074 -1.995736 2.044922
H -0.000509 -1.872516 -2.303099
H -0.041945 2.705004 -2.732844
H -3.370496 1.761745 0.414380
H -3.348046 3.575706 0.803394
H -2.950288 1.057201 -2.407758
H -4.304783 -0.119615 -2.540980
H -3.282392 0.243391 -3.990984
H -2.650793 -0.742029 4.276756
H -1.026682 -0.404871 3.567279
H -1.603516 -2.113434 3.749060
H -4.708715 -1.556888 1.405476
H -5.815214 -0.753335 0.220445
H -4.906583 -2.240975 -0.263195


