%chk=000249335.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249335

0 1
O -4.055157 -1.405073 1.232964
O 5.607512 -0.093366 -0.597156
C -0.692073 0.856435 0.003261
C 0.137272 -0.409871 -0.303617
C -2.068979 0.859161 -0.707938
C -2.827286 -0.501500 -0.691265
C 1.534298 -0.395469 0.399854
C -0.685108 -1.648619 0.089630
C -1.938868 -1.748376 -0.777819
C 0.100132 2.106818 -0.424888
C -3.031090 1.833376 0.029159
C 2.252548 0.928171 0.136468
C -3.621588 -0.453318 0.635106
C 1.443582 2.184435 0.302883
C -3.783387 0.992644 1.069499
C 2.362190 -1.572265 -0.188035
C -3.869509 -0.548296 -1.822041
C 1.413867 -0.542959 1.927129
C 3.843916 -1.503294 0.170087
C 3.561481 0.999431 -0.155794
C 4.449372 -0.176180 -0.244107
H -0.863656 0.895525 1.107567
H 0.323855 -0.441139 -1.406546
H -1.926384 1.179684 -1.763044
H -0.969792 -1.605056 1.159355
H -0.082686 -2.570607 -0.022047
H -1.650437 -1.927440 -1.832223
H -2.533991 -2.635729 -0.470653
H -0.486326 3.023002 -0.220810
H 0.270483 2.095244 -1.519740
H -3.734620 2.290180 -0.688658
H -2.491095 2.671773 0.498458
H 1.283340 2.358413 1.389585
H 2.006559 3.072598 -0.052778
H -4.851958 1.262239 1.141165
H -3.378039 1.130463 2.088681
H 2.257917 -1.579861 -1.292377
H 1.939493 -2.534863 0.160195
H -3.389232 -0.535821 -2.806857
H -4.474550 -1.462794 -1.765737
H -4.559218 0.302189 -1.785261
H 0.702738 0.177033 2.347326
H 1.070326 -1.544103 2.210077
H 2.379106 -0.383165 2.421916
H 4.401218 -2.335219 -0.306635
H 3.998583 -1.637944 1.260244
H 4.065242 1.948813 -0.345286


%chk=000249335-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249335

0 1
O -4.082855 -1.419261 1.258710
O 5.715762 -0.042655 -0.598991
C -0.708134 0.863027 -0.001458
C 0.130793 -0.418232 -0.271614
C -2.086581 0.864838 -0.740335
C -2.854194 -0.496601 -0.702908
C 1.554266 -0.411493 0.430481
C -0.706129 -1.674496 0.072229
C -1.966665 -1.755175 -0.810837
C 0.096535 2.119566 -0.406023
C -3.083131 1.860389 -0.051742
C 2.266106 0.924599 0.155628
C -3.624935 -0.429868 0.637840
C 1.450071 2.190667 0.337035
C -3.752909 1.036728 1.077813
C 2.397270 -1.586873 -0.158198
C -3.942759 -0.544135 -1.822319
C 1.424649 -0.578013 1.979531
C 3.902639 -1.503296 0.167064
C 3.591337 1.000859 -0.193457
C 4.498413 -0.162491 -0.258343
H -0.905798 0.912627 1.092787
H 0.332336 -0.442322 -1.368150
H -1.904482 1.156411 -1.794523
H -1.008219 -1.650847 1.138038
H -0.110434 -2.594696 -0.069364
H -1.666784 -1.896275 -1.869277
H -2.576689 -2.632327 -0.521013
H -0.482331 3.040254 -0.201429
H 0.279782 2.091067 -1.499834
H -3.841718 2.209011 -0.775378
H -2.571761 2.758674 0.334466
H 1.246085 2.335406 1.419829
H 2.034609 3.068324 0.006055
H -4.809844 1.294430 1.269057
H -3.226712 1.149134 2.045683
H 2.275227 -1.587609 -1.260409
H 2.000778 -2.550757 0.210468
H -3.454529 -0.507024 -2.813762
H -4.518647 -1.484284 -1.751366
H -4.656542 0.297017 -1.762321
H 0.782216 0.199568 2.429287
H 0.991668 -1.561845 2.231610
H 2.413971 -0.509206 2.465882
H 4.468973 -2.314032 -0.324641
H 4.073577 -1.617759 1.257262
H 4.055722 1.974278 -0.399764


