%chk=000237909.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237909

0 1
O 1.562880 1.133427 -0.502546
O 1.610207 -0.931841 0.593160
C 3.754257 0.105639 -0.037101
C 5.104094 -0.201626 -0.720846
C 2.911340 0.991951 -0.991562
C 2.961298 -1.210289 0.173799
C 3.912034 0.812199 1.327781
C 0.866126 -0.111103 -0.323368
C 6.031917 -1.095336 0.111421
C -0.426355 0.245360 0.403777
C 4.723287 2.102749 1.284323
C -1.667383 -0.190882 -0.378274
C 7.367360 -1.335692 -0.608115
C -2.953407 0.179029 0.373465
C -4.201670 -0.256014 -0.405941
C -5.487709 0.113918 0.345422
C 8.296349 -2.226757 0.213146
C -6.736952 -0.320808 -0.432832
C -8.022597 0.049332 0.318653
C -9.273365 -0.385051 -0.458419
C -10.556065 -0.018752 0.285030
H 5.619691 0.754786 -0.942053
H 4.923848 -0.675878 -1.705406
H 2.877434 0.590876 -2.017646
H 3.261659 2.040075 -1.009771
H 3.345786 -1.809230 1.018069
H 2.933204 -1.830030 -0.737476
H 2.887484 1.026777 1.709985
H 4.365151 0.113816 2.057010
H 0.771503 -0.629321 -1.295071
H 6.218786 -0.630282 1.099636
H 5.544360 -2.065550 0.323306
H -0.440985 1.341961 0.589747
H -0.409682 -0.222472 1.412728
H 5.757689 1.926616 0.969435
H 4.757140 2.572458 2.274561
H 4.282860 2.834547 0.596303
H -1.637829 -1.284300 -0.554545
H -1.669043 0.283616 -1.379460
H 7.864696 -0.367470 -0.813346
H 7.185773 -1.797960 -1.598026
H -2.952033 -0.291501 1.375928
H -2.983201 1.271286 0.553554
H -4.172182 -1.348089 -0.585469
H -4.203237 0.214679 -1.408026
H -5.517755 1.205942 0.525292
H -5.486564 -0.356183 1.347807
H 8.527236 -1.780772 1.187431
H 9.247805 -2.391111 -0.305147
H 7.851763 -3.210677 0.401224
H -6.738339 0.149434 -1.435052
H -6.707218 -1.412808 -0.612349
H -8.022649 -0.419903 1.321203
H -8.053882 1.141033 0.498925
H -9.275527 0.085423 -1.461110
H -9.244446 -1.477706 -0.637334
H -10.603500 -0.499355 1.268803
H -11.442825 -0.332711 -0.276649
H -10.634816 1.062532 0.445216


%chk=000237909-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237909

0 1
O 1.252953 0.360362 -0.344566
O 1.865397 -1.190213 1.399209
C 3.690916 -0.116620 0.043641
C 4.987283 -0.451819 -0.751540
C 2.572564 0.211068 -0.988293
C 3.206958 -1.381889 0.810285
C 3.874627 1.053936 1.055871
C 0.887954 -0.872672 0.356950
C 6.237005 -0.791030 0.095217
C -0.467905 -0.673867 1.020154
C 4.407064 2.377254 0.465017
C -1.626118 -0.529765 0.008550
C 7.468793 -1.114443 -0.782021
C -2.986343 -0.304066 0.705008
C -4.175658 -0.232195 -0.278642
C -5.530848 0.007852 0.424303
C 8.726284 -1.450395 0.048200
C -6.732998 0.033426 -0.546407
C -8.084987 0.276785 0.161670
C -9.291726 0.282487 -0.804452
C -10.637698 0.524378 -0.087347
H 5.232171 0.404066 -1.414433
H 4.777131 -1.307846 -1.429199
H 2.519679 -0.601518 -1.749534
H 2.753819 1.167665 -1.504758
H 3.858936 -1.618145 1.666621
H 3.181757 -2.255358 0.117716
H 2.896580 1.234410 1.538193
H 4.557927 0.716096 1.860752
H 0.887000 -1.708156 -0.389712
H 6.483863 0.058512 0.762636
H 6.030566 -1.658329 0.754769
H -0.401474 0.225606 1.660630
H -0.645498 -1.539817 1.685708
H 5.413773 2.261303 0.022541
H 4.480125 3.145359 1.256614
H 3.736138 2.779647 -0.315739
H -1.685154 -1.443578 -0.619907
H -1.407584 0.312245 -0.675832
H 7.680463 -0.249525 -1.443816
H 7.226552 -1.965164 -1.451564
H -3.166596 -1.122521 1.433798
H -2.941928 0.633656 1.297345
H -4.227200 -1.176825 -0.859956
H -3.995243 0.576951 -1.016853
H -5.488843 0.966928 0.982015
H -5.693150 -0.785045 1.184660
H 9.002609 -0.606109 0.707641
H 9.593721 -1.669995 -0.600898
H 8.553226 -2.334128 0.690955
H -6.571953 0.822500 -1.310783
H -6.777523 -0.928655 -1.099039
H -8.240414 -0.505190 0.934601
H -8.046503 1.244692 0.704347
H -9.136383 1.063581 -1.576759
H -9.328508 -0.685211 -1.345664
H -10.830718 -0.261509 0.667313
H -11.483623 0.524265 -0.799396
H -10.637457 1.498569 0.437378


