%chk=000245392.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245392

0 1
O 2.128774 -0.114936 -0.441122
O -1.065102 -0.373942 1.166424
O -3.661363 0.195528 0.046147
O 0.468936 1.287532 1.266605
O 0.874691 0.924050 -2.023392
C 1.018572 -0.853486 0.144551
C 0.245147 -1.678998 -0.893781
C 1.719901 -1.820113 1.121146
C 0.299387 -3.135078 -0.407059
C 1.493599 -3.232974 0.559891
C 0.157228 0.179198 0.901867
C -2.988491 1.163322 0.879393
C -2.277900 2.147841 -0.065339
C -2.063223 0.427662 1.864809
C -2.269363 1.462908 -1.443487
C -2.966227 0.113718 -1.228395
C 1.941880 0.780908 -1.476832
C 3.240852 1.450038 -1.752128
H 0.702568 -1.568385 -1.893922
H -0.807851 -1.323067 -0.999656
H 1.310910 -1.725115 2.142792
H 2.797358 -1.571789 1.191706
H 0.400594 -3.838972 -1.249000
H -0.640862 -3.399204 0.112383
H 2.395411 -3.585271 0.027301
H 1.301365 -3.960250 1.365896
H -3.821082 1.633808 1.449372
H -1.252009 2.385999 0.274849
H -2.816821 3.109250 -0.106034
H -2.614832 -0.361914 2.411415
H -1.561248 1.121390 2.561179
H -2.793709 2.075544 -2.194889
H -1.234365 1.330210 -1.819737
H -3.761046 -0.116727 -1.950898
H -2.242125 -0.725864 -1.149485
H 3.418827 1.540315 -2.834600
H 3.240526 2.470727 -1.331276
H 4.094493 0.917740 -1.301694


%chk=000245392-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245392

0 1
O 2.336342 -0.311392 -0.292821
O -1.062270 -0.300527 1.038634
O -3.867110 0.332255 0.135263
O 0.722392 1.135863 1.494215
O 0.972017 1.064011 -1.593876
C 1.119170 -0.986822 0.276728
C 0.414721 -1.863564 -0.807761
C 1.686721 -1.988824 1.324999
C 0.678667 -3.344477 -0.402405
C 1.928088 -3.281047 0.512216
C 0.269758 0.093587 0.972171
C -2.944546 1.316436 0.765223
C -2.244671 2.085787 -0.391467
C -2.011110 0.603286 1.752208
C -3.115584 1.757742 -1.634074
C -3.592670 0.327152 -1.321015
C 2.114452 0.727710 -1.202695
C 3.420093 1.375761 -1.598010
H 0.861710 -1.636537 -1.790004
H -0.657964 -1.628511 -0.868917
H 0.915895 -2.171036 2.097491
H 2.582507 -1.573955 1.814573
H 0.822343 -3.998063 -1.280389
H -0.180905 -3.738801 0.171684
H 2.847400 -3.176952 -0.094096
H 2.040699 -4.170634 1.156260
H -3.585306 1.991610 1.370105
H -1.217031 1.721914 -0.554120
H -2.192769 3.167833 -0.185766
H -2.593986 -0.063583 2.407579
H -1.431366 1.335312 2.344226
H -3.981938 2.440663 -1.701248
H -2.538858 1.819271 -2.572539
H -4.531246 0.039601 -1.822877
H -2.801440 -0.415533 -1.554628
H 3.298990 1.909655 -2.552219
H 3.704600 2.106301 -0.818568
H 4.227603 0.630112 -1.669081


