%chk=000272178.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272178

0 1
O -0.683681 0.013636 0.620086
O 1.424967 2.825105 0.524606
O -0.340503 1.445806 -1.106606
C -1.913424 -0.548926 -0.000449
C -1.856094 -2.011809 0.445497
C -3.091058 0.240944 0.567749
C -2.815212 -2.884781 -0.373037
C -3.482803 1.424616 -0.326194
C -2.770994 -4.341059 0.081571
C -4.571424 2.279307 0.315993
C -0.013596 1.001502 -0.031743
C 1.194178 1.451262 0.808949
C 2.401302 0.583811 0.530429
C 2.287274 -0.811955 0.606564
C 3.637543 1.172811 0.239269
C 3.407589 -1.613496 0.378060
C 4.755540 0.365243 0.009642
C 4.641963 -1.026573 0.076694
H -1.811441 -0.438898 -1.102791
H -0.816451 -2.384916 0.339686
H -2.080934 -2.094741 1.526838
H -2.830563 0.602597 1.584583
H -3.963813 -0.426535 0.710524
H -2.558595 -2.821822 -1.449735
H -3.849979 -2.497025 -0.285067
H -3.827131 1.056015 -1.312510
H -2.588234 2.048606 -0.540005
H -1.768423 -4.770474 -0.029042
H -3.057786 -4.446898 1.134307
H -3.457729 -4.959909 -0.507931
H -4.240070 2.707403 1.269249
H -4.849168 3.116088 -0.335965
H -5.480871 1.701132 0.512805
H 0.947005 1.455993 1.902467
H 1.323649 -1.267750 0.844322
H 3.725190 2.260319 0.204364
H 1.460860 2.976743 -0.456005
H 3.320057 -2.697296 0.434945
H 5.716464 0.823789 -0.219248
H 5.513395 -1.653862 -0.103168


%chk=000272178-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272178

0 1
O -0.797588 0.544093 0.100743
O 1.911736 2.342295 -1.508306
O -0.078708 0.602120 -2.122279
C -2.017781 -0.285894 -0.274213
C -1.601130 -1.768244 -0.261890
C -3.098947 0.105093 0.740193
C -2.698233 -2.712658 -0.810588
C -3.547045 1.580487 0.640089
C -2.210767 -4.175185 -0.895120
C -4.659785 1.928516 1.651298
C 0.079348 0.870426 -0.903085
C 1.317088 1.632759 -0.386763
C 2.306542 0.663046 0.289584
C 1.966240 0.010824 1.501698
C 3.576362 0.437676 -0.290077
C 2.886081 -0.865130 2.119245
C 4.494134 -0.442546 0.327878
C 4.152731 -1.097642 1.532787
H -2.300731 0.018642 -1.301330
H -0.693348 -1.883759 -0.884538
H -1.329613 -2.064439 0.770614
H -2.727727 -0.109586 1.762308
H -3.973726 -0.554144 0.573435
H -3.006683 -2.367840 -1.818454
H -3.599975 -2.664611 -0.169160
H -3.903904 1.784160 -0.390180
H -2.672015 2.237023 0.806023
H -1.334712 -4.261885 -1.564374
H -1.911182 -4.552676 0.100546
H -3.002510 -4.840216 -1.285144
H -4.319619 1.759633 2.690421
H -4.963089 2.987613 1.564703
H -5.559343 1.305329 1.487044
H 0.982157 2.388283 0.346565
H 0.983498 0.183081 1.955094
H 3.838369 0.974176 -1.206863
H 1.591554 1.894716 -2.341123
H 2.616414 -1.363463 3.057431
H 5.476906 -0.609155 -0.127723
H 4.865999 -1.776911 2.013211


