%chk=000218304.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218304

0 1
O 3.939102 1.160334 1.334079
O 2.623363 2.900075 0.839895
C 0.976719 0.475006 -0.239516
C 0.524081 -0.907810 -0.291440
C 2.444555 0.784787 -0.453779
C -0.854822 -1.192719 -0.134224
C -1.801438 -0.107224 0.088305
C -1.323619 1.222138 0.142601
C 0.085207 1.483205 -0.031806
C 1.428949 -1.984783 -0.495777
C -1.289136 -2.545204 -0.195041
C 2.684196 1.384572 -1.840689
C -3.193567 -0.338540 0.256240
C -2.232903 2.291660 0.365574
C 2.943052 1.761681 0.597111
C 0.984977 -3.290150 -0.549915
C -0.391739 -3.573679 -0.399735
C -4.064374 0.711564 0.470328
C -3.580519 2.039936 0.526573
H 3.053181 -0.162781 -0.358178
H 0.417674 2.526354 0.016931
H 2.494695 -1.764949 -0.604990
H 2.278745 0.727490 -2.622175
H 2.190698 2.360474 -1.953276
H 3.752183 1.524843 -2.044686
H -2.351969 -2.764044 -0.075783
H -3.570189 -1.361746 0.214825
H -1.849953 3.310998 0.409357
H 1.685721 -4.108717 -0.706007
H -0.732798 -4.606716 -0.445207
H -5.130026 0.528184 0.598660
H -4.280953 2.855719 0.698193
H 4.305907 1.749642 2.045754


%chk=000218304-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218304

0 1
O 3.554124 1.527759 1.667394
O 2.802476 3.178776 0.224589
C 1.018480 0.461218 -0.168263
C 0.543767 -0.914249 -0.311162
C 2.510485 0.782932 -0.379737
C -0.865990 -1.205244 -0.155797
C -1.809479 -0.121393 0.132639
C -1.303530 1.221596 0.243671
C 0.107602 1.473451 0.085315
C 1.435174 -1.993546 -0.613871
C -1.301094 -2.559121 -0.297725
C 2.808480 1.076110 -1.875973
C -3.213638 -0.326538 0.304376
C -2.201486 2.300938 0.512774
C 2.943309 1.962195 0.482861
C 0.977635 -3.309227 -0.750068
C -0.405425 -3.595544 -0.587193
C -4.079041 0.743923 0.569837
C -3.572221 2.071317 0.674228
H 3.115830 -0.073873 -0.040982
H 0.452153 2.511018 0.167669
H 2.502909 -1.796158 -0.746565
H 2.454598 0.239978 -2.503078
H 2.289923 1.996288 -2.192830
H 3.891617 1.211360 -2.047853
H -2.361269 -2.801769 -0.181775
H -3.635257 -1.333258 0.229803
H -1.795875 3.316439 0.591809
H 1.682381 -4.115281 -0.981174
H -0.769801 -4.623340 -0.690336
H -5.151346 0.559093 0.697322
H -4.253830 2.903538 0.880269
H 3.793338 2.320210 2.222030


