%chk=000220817.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220817

0 1
O -0.655160 1.466254 0.544049
O 0.496143 2.456904 -1.131586
C -3.520575 0.577156 -0.033625
C -4.680800 -0.213591 0.584659
C -2.967291 1.618305 0.946621
C -5.235715 -1.252007 -0.399391
C -1.791896 2.395166 0.349872
C -6.395423 -2.047124 0.216833
C -1.463637 3.678304 1.095056
C -6.951985 -3.081616 -0.758913
C 0.443021 1.609006 -0.265374
C 1.450314 0.596044 0.105757
C 2.606206 0.499445 -0.565849
C 3.658243 -0.480113 -0.254762
C 3.342297 -1.778561 0.177911
C 5.006339 -0.108050 -0.406036
C 4.362984 -2.690620 0.459705
C 6.021112 -1.021561 -0.114901
C 5.701708 -2.313782 0.317010
H -3.855950 1.071956 -0.965573
H -2.706850 -0.114616 -0.332164
H -4.341471 -0.717049 1.510700
H -5.486818 0.478630 0.895426
H -3.764706 2.323478 1.250014
H -2.633358 1.117335 1.879967
H -5.575564 -0.751335 -1.326350
H -4.430541 -1.944811 -0.711450
H -1.894634 2.571076 -0.743983
H -6.055745 -2.551731 1.142477
H -7.202517 -1.355500 0.528291
H -2.296805 4.388759 1.066953
H -1.218112 3.486235 2.146681
H -0.592185 4.176860 0.645162
H -7.332618 -2.611027 -1.672584
H -7.778581 -3.644211 -0.310903
H -6.186526 -3.806269 -1.059033
H 1.184654 -0.040774 0.952528
H 2.825101 1.180500 -1.401784
H 2.300427 -2.078644 0.285813
H 5.260403 0.896167 -0.743672
H 4.113103 -3.697352 0.791992
H 7.064016 -0.727794 -0.226506
H 6.495388 -3.025042 0.540063


%chk=000220817-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220817

0 1
O -0.720813 1.514311 0.771782
O 0.548079 2.545553 -0.910246
C -3.467421 0.605056 0.052533
C -4.778183 -0.105370 0.458528
C -3.121616 1.801378 0.965132
C -5.111589 -1.318004 -0.439259
C -1.823382 2.521612 0.572102
C -6.420498 -2.036645 -0.038989
C -1.509769 3.760637 1.421799
C -6.738551 -3.251856 -0.936925
C 0.415304 1.643772 -0.040318
C 1.385148 0.576363 0.280534
C 2.565870 0.476950 -0.403380
C 3.623306 -0.525015 -0.212543
C 3.550063 -1.558328 0.767691
C 4.777796 -0.465511 -1.045676
C 4.592874 -2.493966 0.904710
C 5.822536 -1.403187 -0.908924
C 5.734217 -2.422069 0.067520
H -3.549568 0.954667 -0.997999
H -2.630391 -0.119460 0.078562
H -4.700956 -0.442008 1.513818
H -5.619427 0.618800 0.424122
H -3.943435 2.545742 0.933616
H -3.037418 1.461641 2.016749
H -5.186389 -0.984324 -1.495534
H -4.270981 -2.042147 -0.402303
H -1.824895 2.788716 -0.502442
H -6.346679 -2.365427 1.017964
H -7.260845 -1.313688 -0.081045
H -2.308668 4.515156 1.300594
H -1.443276 3.492782 2.491369
H -0.556364 4.217411 1.107294
H -6.847290 -2.945254 -1.994512
H -7.677596 -3.748791 -0.630803
H -5.926931 -4.002314 -0.888442
H 1.094842 -0.113817 1.078546
H 2.739314 1.230187 -1.186531
H 2.675568 -1.628239 1.423761
H 4.847368 0.324652 -1.803418
H 4.521789 -3.282176 1.662426
H 6.701519 -1.340808 -1.559661
H 6.543336 -3.152578 0.176901


