%chk=000245770.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245770

0 1
O 0.084468 0.581642 2.896007
O -3.700538 -1.715366 0.625624
O -4.236321 -0.415650 -1.471766
O 1.810606 2.531908 -0.327024
O 3.751372 -2.247628 1.138740
C 0.284752 1.139219 1.583041
C 1.554514 0.565760 0.974882
C -0.918666 0.747351 0.752670
C 3.388616 0.816002 -0.779501
C 2.213880 1.415077 -0.075774
C 3.904891 -0.436652 -0.393834
C 2.049708 -0.622081 1.333377
C -1.722249 -0.341924 1.150395
C -1.214268 1.468012 -0.398698
C 3.284639 -1.205800 0.732224
C -2.821531 -0.691289 0.379902
C -3.127211 0.049363 -0.813428
C -2.323825 1.118242 -1.190967
C 3.980927 1.518102 -1.833094
C 5.006582 -0.972942 -1.064312
C 5.084895 0.974328 -2.505384
C 5.595775 -0.265762 -2.122573
C -3.485855 -2.506060 1.841559
C -4.638395 0.285823 -2.694046
C -4.630061 -3.499981 1.800754
C -5.872537 -0.480249 -3.128775
H 0.363805 2.251347 1.678699
H 1.561414 -1.242671 2.097007
H -1.465182 -0.872557 2.066928
H -0.588427 2.309765 -0.702730
H -2.533761 1.695191 -2.086243
H 3.576324 2.492171 -2.125335
H 5.402654 -1.945673 -0.755713
H 0.724091 0.970423 3.526532
H 5.541672 1.525914 -3.327928
H 6.454778 -0.690260 -2.643755
H -2.495810 -2.988065 1.774534
H -3.533979 -1.830826 2.712913
H -4.853975 1.337570 -2.440345
H -3.813630 0.219658 -3.423578
H -4.602837 -4.178049 2.660141
H -5.601593 -2.985482 1.797401
H -4.597155 -4.104275 0.882947
H -6.299227 -0.066646 -4.048351
H -5.639720 -1.540756 -3.302127
H -6.646911 -0.458725 -2.348399


%chk=000245770-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245770

0 1
O 0.046176 0.776217 2.941714
O -3.679359 -1.771861 0.652605
O -4.336278 -0.398847 -1.515673
O 1.818861 2.581405 -0.424084
O 3.534601 -2.406268 1.099884
C 0.247828 1.249780 1.565204
C 1.498644 0.620954 0.943044
C -0.984151 0.853607 0.749358
C 3.397389 0.781584 -0.773579
C 2.210451 1.407427 -0.116250
C 3.849895 -0.510759 -0.378226
C 1.964375 -0.612954 1.325877
C -1.742199 -0.285603 1.118224
C -1.342435 1.592387 -0.395892
C 3.142765 -1.257075 0.709697
C -2.859085 -0.680202 0.354739
C -3.221550 0.068786 -0.815051
C -2.456839 1.200997 -1.173635
C 4.077486 1.480964 -1.800400
C 4.976113 -1.086741 -1.011500
C 5.197885 0.899897 -2.429443
C 5.647889 -0.385155 -2.034604
C -3.331314 -2.579211 1.839243
C -4.745756 0.344685 -2.723788
C -4.369625 -3.693559 1.930636
C -5.966778 -0.377670 -3.286115
H 0.364175 2.350895 1.534101
H 1.457367 -1.175289 2.118084
H -1.464726 -0.819623 2.029728
H -0.751089 2.466232 -0.688899
H -2.721539 1.788715 -2.056866
H 3.711471 2.472368 -2.085667
H 5.303146 -2.079467 -0.685840
H 0.814378 1.064839 3.496521
H 5.721625 1.441877 -3.223944
H 6.518770 -0.833121 -2.524890
H -2.307029 -2.988491 1.718269
H -3.349558 -1.934669 2.742078
H -4.986698 1.392338 -2.448394
H -3.909328 0.353445 -3.453041
H -4.160734 -4.335204 2.805952
H -5.383486 -3.271862 2.037216
H -4.349511 -4.319704 1.022527
H -6.325124 0.133661 -4.198101
H -5.716078 -1.420887 -3.542593
H -6.784321 -0.391336 -2.545628


