%chk=000249562.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249562

0 1
O -0.564381 -1.252176 -0.218557
O -2.019753 1.641317 0.507781
O -2.772631 0.551280 -1.325278
C -2.695509 -1.797323 0.706688
C -1.643033 -0.668435 0.543284
C -2.184402 -2.816137 1.727658
C -3.006056 -2.458337 -0.635065
C -2.217155 0.508237 -0.259884
C 0.691543 -0.662058 -0.155423
C 2.303744 1.041618 0.402089
C 0.980911 0.572431 0.428321
C 3.314792 0.270828 -0.210857
C 1.679285 -1.446752 -0.775055
C 2.984461 -0.963629 -0.795328
C 2.621782 2.362104 1.026990
C 4.730515 0.750689 -0.250126
C -2.458649 2.908248 -0.048539
H -3.629587 -1.322423 1.104063
H -1.266160 -0.316097 1.532609
H -1.216743 -3.234172 1.415776
H -2.881108 -3.656151 1.829865
H -2.050828 -2.376258 2.720977
H -3.758131 -3.245715 -0.534326
H -3.376909 -1.726417 -1.368651
H -2.103372 -2.906756 -1.073869
H 0.200561 1.179517 0.884887
H 1.412795 -2.398960 -1.225171
H 3.763102 -1.558300 -1.273927
H 1.739495 2.848891 1.462309
H 3.361595 2.252303 1.833005
H 3.044718 3.058906 0.288901
H 5.127360 0.906952 0.762703
H 5.401143 0.041352 -0.751702
H 4.812565 1.705514 -0.788339
H -3.436560 2.796936 -0.529745
H -1.707693 3.244249 -0.770355
H -2.506107 3.560827 0.828689


%chk=000249562-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249562

0 1
O -0.446250 -1.372154 -0.122249
O -2.461760 1.538783 0.622902
O -1.981436 0.703831 -1.502390
C -2.707613 -1.680947 0.717116
C -1.537727 -0.667491 0.544605
C -2.294978 -2.782803 1.721102
C -3.164575 -2.285087 -0.630468
C -1.983702 0.562697 -0.264142
C 0.832776 -0.772207 -0.131228
C 2.456760 0.997446 0.399991
C 1.136332 0.482836 0.447498
C 3.489078 0.245118 -0.233057
C 1.846698 -1.524094 -0.763476
C 3.156500 -1.008791 -0.806612
C 2.755419 2.350818 1.022050
C 4.913289 0.768671 -0.299464
C -3.014433 2.762661 -0.009746
H -3.545343 -1.100365 1.156132
H -1.219537 -0.320450 1.548182
H -1.420708 -3.339934 1.341859
H -3.124904 -3.497418 1.868530
H -2.032472 -2.356899 2.707744
H -4.027328 -2.956501 -0.468643
H -3.462294 -1.506898 -1.354703
H -2.347046 -2.869373 -1.085989
H 0.360806 1.083148 0.935256
H 1.593753 -2.490095 -1.210319
H 3.942066 -1.594128 -1.299273
H 1.853448 2.791363 1.479943
H 3.531636 2.275528 1.807961
H 3.136225 3.067330 0.268603
H 5.338655 0.932898 0.709939
H 5.572252 0.059350 -0.828858
H 4.970166 1.739506 -0.829321
H -3.876135 2.505683 -0.648592
H -2.242056 3.253240 -0.625385
H -3.319965 3.400832 0.830900


