%chk=000257349.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257349

0 1
O -4.427844 -1.939496 -1.789204
O -1.623397 2.222331 2.751601
O 4.427778 1.941564 -1.788650
O 1.621926 -2.225189 2.747280
N -2.567270 0.022857 -0.090239
N 2.567611 -0.022729 -0.091548
C -4.043116 -0.235146 -0.063592
C -2.234516 1.316704 0.583739
C 4.043511 0.234922 -0.065200
C 2.234868 -1.317405 0.580821
C -2.048320 -0.021762 -1.502759
C 2.048010 0.023979 -1.503749
C -4.313858 -1.715989 -0.375759
C -2.012548 1.017540 2.077696
C 4.314428 1.716133 -0.375460
C 2.012405 -1.019896 2.075039
C -0.603435 -0.004580 -1.501298
C 0.603126 0.006864 -1.501608
H -4.417076 -0.005618 0.959781
H -4.616743 0.412492 -0.760832
H -1.298785 1.743710 0.157044
H -3.006170 2.104710 0.462045
H 4.616690 -0.411881 -0.763580
H 4.417854 0.003921 0.957702
H 3.006695 -2.105128 0.458461
H 1.299348 -1.744140 0.153402
H -2.441071 0.808211 -2.139181
H -2.415333 -0.978386 -1.972022
H 2.414866 0.981265 -1.971778
H 2.440415 -0.805086 -2.141562
H -5.231041 -2.073452 0.122180
H -3.458543 -2.365321 -0.095038
H -1.247045 0.236831 2.230386
H -2.943283 0.731436 2.599111
H 3.459392 2.365266 -0.093430
H 5.231929 2.072711 0.122528
H 2.943110 -0.735185 2.597255
H 1.247445 -0.238760 2.228291
H -5.213773 -1.487012 -2.149965
H -0.739165 2.512672 2.453026
H 5.213416 1.489381 -2.150421
H 0.737609 -2.514439 2.447886


%chk=000257349-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257349

0 1
O -4.326547 -2.280116 -1.485919
O -1.810688 2.609555 2.586924
O 4.326739 2.280925 -1.485230
O 1.810625 -2.612896 2.582419
N -2.643435 0.093236 -0.139652
N 2.643332 -0.092591 -0.140525
C -4.089123 -0.208815 -0.049798
C -2.293610 1.412325 0.449541
C 4.089222 0.208534 -0.050777
C 2.293020 -1.412409 0.446761
C -2.087472 -0.126567 -1.509697
C 2.087065 0.129459 -1.510078
C -4.430215 -1.708194 -0.127696
C -2.034610 1.294045 1.966334
C 4.431089 1.707788 -0.127575
C 2.034998 -1.296487 1.963903
C -0.615759 -0.041665 -1.533322
C 0.615322 0.044986 -1.533415
H -4.440441 0.157764 0.933478
H -4.687632 0.346121 -0.823603
H -1.369397 1.774988 -0.038119
H -3.082404 2.181463 0.275306
H 4.687171 -0.346066 -0.825254
H 4.440639 -0.159102 0.932069
H 3.081212 -2.181774 0.270785
H 1.368279 -1.773663 -0.040949
H -2.503521 0.611809 -2.245009
H -2.418197 -1.126492 -1.843639
H 2.417952 1.129820 -1.842566
H 2.502728 -0.607896 -2.246628
H -5.451863 -1.875366 0.275640
H -3.706945 -2.280688 0.474106
H -1.181506 0.605988 2.139424
H -2.917321 0.892882 2.492284
H 3.708533 2.280139 0.475218
H 5.453102 1.874067 0.275208
H 2.918269 -0.896763 2.490004
H 1.182433 -0.608189 2.138667
H -5.010971 -1.854498 -2.062517
H -0.977071 2.998688 2.219813
H 5.010543 1.855460 -2.062674
H 0.976552 -3.000905 2.215155


