%chk=000269311.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269311

0 1
O 3.473943 -1.740148 -0.957578
O -2.639364 0.108934 -0.506707
O -1.593534 -2.523373 0.148130
O -2.626194 2.259523 0.273892
C 2.903017 2.072532 0.380621
C 2.035110 1.749369 -0.845023
C 4.091519 1.118683 0.551309
C 1.042664 0.652993 -0.573284
C 3.677243 -0.303614 0.943748
C 1.468222 -0.655289 -0.278437
C 2.932655 -0.978737 -0.190656
C -0.330735 0.924451 -0.631459
C 0.549138 -1.680233 -0.058280
C -1.257166 -0.093440 -0.395234
C -0.830658 -1.408230 -0.104332
C -3.034685 -2.398388 0.070464
C -3.241487 1.316150 -0.142034
C -4.702055 1.157149 -0.378757
H 3.284471 3.109195 0.288257
H 2.275111 2.066335 1.294173
H 2.675709 1.463116 -1.707056
H 1.512147 2.672351 -1.171805
H 4.770806 1.518827 1.331518
H 4.693453 1.087733 -0.380051
H 3.053180 -0.286997 1.859107
H 4.578846 -0.900749 1.194232
H -0.684119 1.936791 -0.842317
H 0.876705 -2.701996 0.144470
H -3.356148 -3.431622 0.249697
H -3.331214 -2.050661 -0.924721
H -3.393246 -1.722171 0.851328
H -4.954989 0.209160 -0.879858
H -5.084551 1.979314 -1.006709
H -5.257190 1.193244 0.572950


%chk=000269311-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269311

0 1
O 3.171972 -2.241812 -0.064235
O -2.753644 0.217285 -0.409925
O -1.877752 -2.356621 0.491380
O -2.715002 2.274260 0.741380
C 3.073281 2.183420 0.126963
C 1.978480 1.754061 -0.882427
C 4.206293 1.151771 0.306573
C 0.999824 0.672735 -0.430652
C 3.780734 -0.158913 1.017515
C 1.391961 -0.627325 0.014105
C 2.816361 -1.068917 0.254403
C -0.384189 0.935838 -0.567808
C 0.405284 -1.617057 0.256349
C -1.356275 -0.037521 -0.266312
C -0.970295 -1.345746 0.130665
C -2.835907 -2.793052 -0.547909
C -3.349346 1.393906 0.136251
C -4.834197 1.358575 -0.140453
H 3.518615 3.129495 -0.238930
H 2.609853 2.409581 1.107717
H 2.484099 1.417320 -1.812312
H 1.391485 2.648694 -1.161299
H 5.015229 1.606747 0.910501
H 4.649330 0.910244 -0.680391
H 3.303381 0.107388 1.983395
H 4.675215 -0.769542 1.234565
H -0.711302 1.923401 -0.904538
H 0.713091 -2.622163 0.558935
H -3.422760 -3.594414 -0.074378
H -2.292350 -3.193629 -1.424896
H -3.494639 -1.964053 -0.857621
H -5.020216 1.212621 -1.218023
H -5.296600 2.296362 0.198685
H -5.293412 0.507265 0.392326


