%chk=000222846.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222846

0 1
O -5.203203 -1.054205 0.391368
O 5.661108 0.381204 0.729059
C -2.759259 -0.536295 0.122434
C -2.083365 0.791246 -0.341509
C -0.616967 0.833186 0.100756
C -4.240499 -0.258732 -0.293806
C -2.066006 -1.676931 -0.633655
C 0.156916 -0.328811 -0.614996
C -3.053253 1.887286 0.137765
C -4.453098 1.256410 -0.033880
C -0.552561 -1.673973 -0.351514
C -2.682717 -0.774565 1.636420
C 1.638336 -0.274624 -0.249245
C 0.029904 2.151965 -0.215088
C 2.197108 1.032151 -0.120964
C 1.361473 2.228219 -0.318921
C 2.507298 -1.372904 -0.105278
C 3.539580 1.239353 0.201748
C 3.862420 -1.176976 0.237933
C 2.124399 -2.807610 -0.298913
C 4.353693 0.116938 0.392991
H -2.090975 0.816252 -1.462958
H -0.548276 0.677668 1.208691
H -4.437001 -0.535451 -1.351477
H -2.249191 -1.586973 -1.720766
H -2.497961 -2.652230 -0.339294
H 0.108196 -0.134150 -1.720252
H -2.951559 2.812178 -0.450738
H -2.863906 2.163438 1.188098
H -5.079509 1.412986 0.859049
H -5.001966 1.719424 -0.869360
H -0.374204 -1.982759 0.696621
H -0.097543 -2.455049 -0.999449
H -3.207640 -1.696666 1.912383
H -1.643735 -0.882730 1.973202
H -3.116593 0.054614 2.204188
H -0.619768 3.015099 -0.329885
H -5.156603 -0.923620 1.358683
H 1.880840 3.160128 -0.535760
H 3.959322 2.235907 0.310046
H 4.514758 -2.032777 0.373191
H 1.422933 -2.944045 -1.139302
H 2.992507 -3.444813 -0.517490
H 1.652515 -3.214614 0.607309
H 6.187651 -0.445947 0.846567


%chk=000222846-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222846

0 1
O -5.321774 -1.112349 -0.003992
O 5.874087 0.437015 0.320307
C -2.820540 -0.534511 0.109207
C -2.096258 0.795968 -0.243957
C -0.617197 0.820719 0.195947
C -4.251794 -0.197358 -0.418494
C -2.085402 -1.670173 -0.628933
C 0.159391 -0.353162 -0.506107
C -3.064628 1.905510 0.250298
C -4.485855 1.289825 0.016177
C -0.574636 -1.705651 -0.267443
C -2.896510 -0.824727 1.630492
C 1.681300 -0.291478 -0.185176
C 0.043184 2.148996 -0.113709
C 2.250196 1.035077 -0.162533
C 1.388442 2.223309 -0.291362
C 2.584668 -1.392919 -0.040815
C 3.637750 1.255925 -0.005460
C 3.975239 -1.142945 0.141350
C 2.215246 -2.874902 -0.088578
C 4.502925 0.162831 0.155866
H -2.089614 0.852868 -1.357543
H -0.567923 0.665726 1.299240
H -4.261710 -0.288808 -1.520353
H -2.192277 -1.515554 -1.723547
H -2.541583 -2.652797 -0.399212
H 0.077223 -0.136610 -1.599618
H -2.933614 2.852309 -0.302156
H -2.894958 2.128189 1.320845
H -5.091534 1.316679 0.943430
H -5.059029 1.838669 -0.750505
H -0.456047 -2.010849 0.790333
H -0.110481 -2.495148 -0.879186
H -3.439482 -1.773249 1.801130
H -1.898893 -0.935886 2.086206
H -3.418647 -0.023411 2.186305
H -0.577219 3.053068 -0.143797
H -5.499923 -0.971827 0.960677
H 1.880163 3.186832 -0.475378
H 4.044413 2.272066 0.004080
H 4.651619 -2.000459 0.260954
H 1.841794 -3.176883 -1.084119
H 3.107948 -3.489378 0.120423
H 1.447541 -3.149963 0.652077
H 6.388001 -0.402379 0.420631


