%chk=000219368.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219368

0 1
O 3.138120 -1.844780 -0.001570
O 0.028479 3.640064 -0.000932
O -3.166717 -1.795384 -0.000060
C 1.376154 -0.286176 0.000878
C -0.440328 1.334856 0.001600
C -0.935942 -1.048780 0.001341
C 0.935512 1.039233 0.001169
C 0.432217 -1.329877 0.000919
C -1.367845 0.290545 0.001635
C 2.828016 -0.672013 0.000313
C -0.832115 2.785124 0.001841
C -1.996018 -2.113210 0.001324
C 3.844582 0.447153 0.003218
C -2.309626 3.105914 0.003620
C -1.535074 -3.553167 0.002780
C 5.272877 -0.082865 0.005457
C -2.564765 4.607864 0.004904
C -2.708229 -4.525100 0.004750
H 1.643753 1.877620 0.001002
H 0.804161 -2.362425 0.000521
H -2.448030 0.484706 0.001819
H 3.685439 1.098794 -0.882727
H 3.682202 1.097561 0.889434
H -2.793847 2.641798 -0.882375
H -2.792251 2.640558 0.889787
H -0.891576 -3.740418 -0.883622
H -0.890201 -3.738493 0.888540
H 5.467920 -0.712321 -0.873701
H 6.002995 0.733471 0.006745
H 5.465124 -0.712561 0.885033
H -2.116641 5.091038 -0.874244
H -3.636792 4.831998 0.005438
H -2.116077 5.089670 0.884491
H -3.351301 -4.378532 -0.873970
H -2.366319 -5.565569 0.004981
H -3.349259 -4.377496 0.884764


%chk=000219368-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219368

0 1
O 3.190723 -1.894956 0.001672
O 0.046016 3.710593 0.002273
O -3.235557 -1.812866 0.001270
C 1.392302 -0.296629 0.002452
C -0.437562 1.353389 0.001942
C -0.951644 -1.056293 0.002013
C 0.949429 1.044889 0.002276
C 0.431652 -1.343585 0.002292
C -1.377912 0.299007 0.001840
C 2.856470 -0.674859 0.002793
C -0.842722 2.810334 0.001652
C -2.012041 -2.134505 0.001899
C 3.903258 0.440316 0.003088
C -2.332004 3.157579 0.002739
C -1.570770 -3.598664 0.002534
C 5.349159 -0.082591 0.003948
C -2.604712 4.670682 0.004417
C -2.747634 -4.588389 0.003784
H 1.648511 1.887597 0.002325
H 0.812014 -2.370449 0.002372
H -2.457348 0.482636 0.001581
H 3.721463 1.087879 -0.879434
H 3.720525 1.088520 0.884906
H -2.801561 2.676119 -0.879810
H -2.800974 2.674177 0.884509
H -0.919473 -3.765863 -0.880036
H -0.918289 -3.764968 0.884367
H 5.542567 -0.709540 -0.883031
H 6.063641 0.759524 0.003540
H 5.542044 -0.708165 0.892022
H -2.160155 5.153032 -0.882685
H -3.691673 4.866145 0.004695
H -2.160090 5.151111 0.892538
H -3.387066 -4.442128 -0.883263
H -2.376482 -5.628559 0.003727
H -3.385508 -4.441721 0.891896


