%chk=000239445.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239445

0 1
O 1.890810 0.347516 0.528083
O 5.209226 1.340011 -0.090594
O 1.952192 -1.705477 -0.425371
C -1.008183 -1.242030 0.610087
C -1.683879 -0.030927 0.225003
C -2.951811 -0.131770 -0.407303
C 0.312608 -1.181479 1.330625
C -1.572622 -2.468554 0.337816
C -1.130342 1.270817 0.445859
C -3.516147 -1.421609 -0.665449
C -2.838366 -2.558347 -0.306999
C -3.648195 1.061681 -0.783393
C 1.442884 -0.949241 0.362412
C -1.816841 2.398981 0.073485
C -3.096067 2.294671 -0.545880
C 2.954840 0.820844 -0.345433
C 4.292826 0.236696 0.108843
C 6.587304 0.982861 0.116911
H 0.293365 -0.385172 2.111622
H 0.510624 -2.128403 1.882635
H -1.060820 -3.392907 0.604536
H -0.140734 1.354668 0.902995
H -4.487818 -1.479120 -1.153766
H -3.252713 -3.545830 -0.506874
H -4.621834 0.967683 -1.261973
H -1.395214 3.388910 0.241346
H -3.619095 3.207258 -0.827471
H 2.706251 0.565879 -1.389133
H 2.913233 1.917732 -0.189143
H 4.603341 -0.632906 -0.495471
H 4.278794 -0.035681 1.179072
H 6.750140 0.655002 1.147536
H 7.108278 1.929423 -0.076138
H 6.900267 0.216622 -0.598477


%chk=000239445-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239445

0 1
O 1.992571 0.499249 0.693468
O 5.475827 1.152984 -0.404771
O 1.870089 -1.442894 -0.598908
C -1.046673 -1.214102 0.567549
C -1.797875 -0.029017 0.217774
C -3.076948 -0.181616 -0.452036
C 0.296875 -1.111764 1.286793
C -1.558295 -2.475722 0.242493
C -1.333055 1.300153 0.502867
C -3.561673 -1.494965 -0.762196
C -2.813843 -2.622093 -0.424152
C -3.834911 0.986960 -0.794390
C 1.446641 -0.746830 0.347716
C -2.095704 2.418891 0.157059
C -3.358704 2.264606 -0.495806
C 3.111169 0.995809 -0.158908
C 4.444749 0.427416 0.338749
C 6.822928 0.681547 -0.088501
H 0.264100 -0.378995 2.109631
H 0.544878 -2.098000 1.717768
H -0.981605 -3.371511 0.499884
H -0.361439 1.441852 0.986496
H -4.527848 -1.597807 -1.270477
H -3.182794 -3.625073 -0.663838
H -4.800334 0.857756 -1.298490
H -1.724022 3.424440 0.383584
H -3.945737 3.150664 -0.761308
H 2.931824 0.711261 -1.208926
H 3.090445 2.089666 -0.042006
H 4.503372 -0.663079 0.137290
H 4.551647 0.600405 1.432317
H 7.062471 0.826029 0.986713
H 7.511469 1.284118 -0.701031
H 6.946708 -0.392539 -0.342409


