%chk=000224451.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224451

0 1
O -3.163813 -0.018730 1.879594
O 0.285554 1.958692 -1.548857
O -5.103335 -0.176328 -0.943989
O -5.726439 2.341480 -0.144517
O 6.332877 0.501527 1.237188
C -1.862950 0.004651 -0.230832
C -0.937233 -1.188276 0.173053
C 0.412655 -1.077786 -0.547642
C 1.102837 0.205144 -0.001537
C -3.189053 -0.420159 0.500783
C -1.226061 1.310562 0.256759
C -1.820226 -2.431329 -0.026290
C 0.239254 1.476391 -0.203492
C -3.237265 -1.962330 0.372035
C 2.562376 0.307489 -0.543140
C -2.147235 0.076488 -1.736174
C 1.280903 -2.291059 -0.361039
C -4.452112 0.278450 -0.032619
C 3.302767 -0.926780 -0.015077
C 2.602463 -2.212601 -0.156467
C 2.653566 0.299678 -2.079252
C 3.208008 1.601702 -0.083519
C -4.848973 1.566694 0.665610
C 4.508787 -0.848069 0.570912
C 4.400467 1.662497 0.513089
C 5.197930 0.441985 0.810504
H -0.727091 -1.112895 1.273010
H 0.244405 -0.965953 -1.651766
H 1.198293 0.084280 1.112688
H -1.283933 1.372260 1.361926
H -1.803569 2.184670 -0.110406
H -1.484220 -3.278919 0.592187
H -1.798277 -2.783272 -1.072189
H 0.702094 2.335658 0.345913
H -3.983831 -2.263061 -0.390151
H -3.573208 -2.420386 1.317460
H -2.661441 -0.820185 -2.107627
H -2.788590 0.932234 -1.989288
H -1.220753 0.184018 -2.321428
H 0.770904 -3.251417 -0.435520
H 3.219519 -3.108387 -0.058862
H 2.090072 1.143079 -2.506627
H 3.694673 0.398431 -2.412850
H 2.262884 -0.626488 -2.511381
H -2.523035 -0.559454 2.388517
H 2.641156 2.505659 -0.327472
H -0.190782 1.346470 -2.161282
H -3.987112 2.237563 0.857097
H -5.335596 1.340322 1.638669
H 5.052928 -1.725274 0.923309
H 4.869930 2.601789 0.808532
H -6.363072 1.750773 -0.620742


%chk=000224451-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000224451

0 1
O -3.072947 -0.129854 1.956119
O 0.304692 2.037978 -1.679950
O -5.130575 0.035432 -0.929267
O -5.994228 2.264240 0.292942
O 6.333051 0.640230 1.502998
C -1.894790 0.013768 -0.294356
C -0.976121 -1.204733 0.060630
C 0.421439 -1.091760 -0.592746
C 1.094038 0.220569 -0.077877
C -3.207552 -0.420072 0.513051
C -1.229821 1.324336 0.189023
C -1.875841 -2.434457 -0.206925
C 0.235614 1.499863 -0.303395
C -3.300605 -1.958647 0.238008
C 2.604565 0.299152 -0.540344
C -2.237035 0.064596 -1.812574
C 1.302411 -2.292388 -0.302403
C -4.455382 0.357562 0.090592
C 3.314280 -0.891841 0.110038
C 2.622613 -2.183351 0.036900
C 2.765323 0.159996 -2.101510
C 3.249247 1.624002 -0.181759
C -4.884798 1.569317 0.909419
C 4.536731 -0.766542 0.728616
C 4.444205 1.732882 0.466160
C 5.193894 0.539217 0.933391
H -0.786109 -1.161556 1.159681
H 0.284021 -1.033504 -1.695625
H 1.134200 0.120784 1.030764
H -1.232939 1.335226 1.296216
H -1.799681 2.213275 -0.142976
H -1.547188 -3.327162 0.352287
H -1.865650 -2.697541 -1.280925
H 0.684300 2.316875 0.287704
H -4.056799 -2.151888 -0.541315
H -3.645474 -2.464599 1.157496
H -2.977408 -0.698383 -2.103363
H -2.672242 1.042980 -2.083612
H -1.345183 -0.105382 -2.445167
H 0.835924 -3.284772 -0.357599
H 3.198124 -3.081925 0.294900
H 2.255391 0.996860 -2.604649
H 3.837582 0.180175 -2.362411
H 2.349135 -0.796266 -2.462470
H -2.379573 -0.720445 2.342687
H 2.747038 2.519629 -0.569694
H -0.282311 1.510289 -2.275864
H -4.026565 2.259619 1.030315
H -5.151478 1.218602 1.927014
H 5.051987 -1.641248 1.145957
H 4.915110 2.705176 0.651963
H -6.288521 1.717183 -0.489292


