%chk=000243692.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243692

0 1
O 2.503252 -0.965409 0.052968
O -2.517508 -0.961961 0.111637
O 4.298087 -0.386467 -1.185092
O -4.300004 -0.367305 -1.136824
C 3.244427 1.243083 0.354422
C -3.225247 1.260719 0.389515
C -0.017675 -2.403041 -0.614743
C 1.260037 -2.971401 0.013535
C -1.276661 -2.969538 0.051833
C 3.041751 2.359202 -0.687171
C 4.461710 1.526934 1.254748
C -4.433286 1.564054 1.295980
C -3.018973 2.366205 -0.662642
C 2.511344 -2.304265 -0.545484
C -2.543809 -2.305872 -0.474725
C 3.463406 -0.074195 -0.368670
C -3.462672 -0.060120 -0.321165
C 1.775285 2.160602 -1.512270
C 4.551409 0.551975 2.423866
C -4.523667 0.600306 2.474295
C -1.759719 2.149268 -1.494139
H 2.324747 1.157922 0.990423
H -2.302049 1.171437 1.019794
H -0.015430 -1.295638 -0.508531
H -0.034189 -2.606466 -1.701761
H 1.322154 -4.064836 -0.149214
H 1.233545 -2.822331 1.114291
H -1.342548 -4.063727 -0.104299
H -1.219079 -2.815530 1.150697
H 3.001805 3.337048 -0.167390
H 3.924327 2.406408 -1.359819
H 5.392876 1.483315 0.651728
H 4.397227 2.564967 1.637553
H -5.369163 1.524175 0.700083
H -4.356194 2.604743 1.669148
H -2.966930 3.348004 -0.151486
H -3.905370 2.415618 -1.330152
H 3.444400 -2.800405 -0.229340
H 2.507147 -2.190335 -1.642692
H -3.467056 -2.797264 -0.124436
H -2.573587 -2.203433 -1.572817
H 0.870455 2.120475 -0.885608
H 1.640841 2.979983 -2.228493
H 1.809495 1.229199 -2.091893
H 5.424329 0.767324 3.051281
H 4.645532 -0.486633 2.082133
H 3.664226 0.601596 3.066166
H -3.632722 0.649464 3.111420
H -5.391713 0.827367 3.104307
H -4.626557 -0.440699 2.142471
H -1.625363 2.958911 -2.221412
H -1.804041 1.211132 -2.062108
H -0.850605 2.111235 -0.873621


%chk=000243692-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243692

0 1
O 2.582697 -0.919507 0.078002
O -2.614353 -0.923464 0.159566
O 4.590319 -0.572567 -1.048422
O -4.513377 -0.416336 -1.088809
C 3.599777 1.267682 0.277624
C -3.587201 1.270199 0.467981
C -0.014007 -2.284730 -0.485121
C 1.261740 -2.963441 0.059145
C -1.304816 -2.967325 0.017178
C 3.578080 2.313744 -0.873062
C 4.810837 1.498886 1.227773
C -4.871802 1.463989 1.325405
C -3.432373 2.409626 -0.578925
C 2.555398 -2.321985 -0.443349
C -2.582191 -2.281504 -0.468561
C 3.674848 -0.137931 -0.308917
C -3.650302 -0.076803 -0.244088
C 2.340838 2.204733 -1.789364
C 4.824547 0.564486 2.456003
C -5.033891 0.419884 2.450143
C -2.116074 2.341729 -1.382287
H 2.660797 1.341812 0.858341
H -2.702593 1.259755 1.132552
H -0.019630 -1.222717 -0.181062
H 0.003776 -2.302555 -1.595245
H 1.278351 -4.032146 -0.239931
H 1.254130 -2.941336 1.166518
H -1.333772 -4.021588 -0.328055
H -1.310169 -2.993249 1.124526
H 3.615469 3.321670 -0.414780
H 4.501865 2.194697 -1.471665
H 5.743291 1.370632 0.644608
H 4.780435 2.554294 1.563201
H -5.750069 1.432478 0.651767
H -4.834870 2.480895 1.763359
H -3.490314 3.375475 -0.039415
H -4.297276 2.371190 -1.269159
H 3.456758 -2.844841 -0.074786
H 2.605038 -2.284258 -1.547699
H -3.495269 -2.823469 -0.161263
H -2.604898 -2.160089 -1.567559
H 1.402113 2.310782 -1.212968
H 2.354532 2.992853 -2.563902
H 2.309166 1.228610 -2.307754
H 5.681518 0.794054 3.114931
H 4.909652 -0.495794 2.154686
H 3.898395 0.672049 3.050725
H -4.161609 0.424855 3.130112
H -5.936688 0.628339 3.052520
H -5.135554 -0.601715 2.039837
H -2.038439 3.192542 -2.083279
H -2.055249 1.412329 -1.978108
H -1.235584 2.370882 -0.712669


