%chk=000255259.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255259

0 1
O 4.471310 -1.454900 -0.323615
O 4.986022 1.403418 0.302146
O -6.401811 0.320649 -0.069029
C 0.104978 0.683234 -0.156797
C 1.523625 0.542399 0.407584
C -0.766024 -0.470851 0.414809
C 2.162650 -0.819968 -0.026977
C -2.202527 -0.423802 -0.211860
C -0.113628 -1.860626 0.240267
C 1.362692 -1.932046 0.666415
C 3.626093 -0.634007 0.485915
C 2.580818 1.594240 0.041010
C -0.507637 2.039353 0.241343
C -2.759200 0.996431 -0.136692
C -3.103622 -1.391225 0.605637
C 2.197267 -1.036434 -1.543568
C 3.903732 0.878581 0.268371
C -1.990563 2.077811 0.051966
C -2.179730 -0.834036 -1.695948
C -4.236563 1.156856 -0.369287
C -4.589058 -1.279256 0.259065
C -5.063586 0.165919 0.456500
C 5.844670 -1.507839 0.124295
H 0.126501 0.613126 -1.269499
H -0.876831 -0.286464 1.512788
H 1.434321 0.542901 1.526093
H -0.194520 -2.176875 -0.821430
H -0.689112 -2.607829 0.819790
H 1.448489 -1.849895 1.765121
H 1.781564 -2.922801 0.405260
H 3.747511 -0.895865 1.555560
H 2.504147 2.513800 0.644299
H 2.499953 1.924005 -1.011792
H -0.031420 2.847328 -0.350302
H -0.278329 2.272562 1.302934
H -2.964144 -1.191392 1.686386
H -2.768288 -2.433147 0.441868
H 2.776813 -1.940625 -1.783942
H 1.195278 -1.155681 -1.967270
H 2.688392 -0.208552 -2.065442
H -2.419588 3.079282 0.086827
H -1.737824 -1.826921 -1.835381
H -3.190765 -0.861181 -2.117836
H -1.595801 -0.123642 -2.292596
H -4.581334 2.188091 -0.151407
H -4.463042 1.008639 -1.449082
H -4.769130 -1.587467 -0.790468
H -5.179991 -1.974360 0.881675
H -5.085622 0.446229 1.531756
H 5.907832 -1.990847 1.101933
H 6.280375 -0.500452 0.145081
H 6.317245 -2.121228 -0.651332
H -7.022091 -0.281641 0.375457


%chk=000255259-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255259

0 1
O 4.609535 -1.527303 -0.118538
O 5.073365 1.432000 0.064268
O -6.524345 0.371259 0.260631
C 0.101265 0.698705 -0.253036
C 1.546437 0.545314 0.257011
C -0.757285 -0.504822 0.253621
C 2.223211 -0.800398 -0.173741
C -2.241972 -0.442251 -0.276341
C -0.077886 -1.882065 -0.013177
C 1.403119 -1.954149 0.444822
C 3.642564 -0.594320 0.424953
C 2.593228 1.631183 -0.087112
C -0.511346 2.030262 0.241568
C -2.805460 0.987030 -0.128436
C -3.119117 -1.406519 0.597582
C 2.353230 -0.969444 -1.711120
C 3.935715 0.909733 0.130402
C -2.017802 2.069126 0.115856
C -2.334444 -0.863617 -1.776392
C -4.313039 1.151894 -0.287058
C -4.639525 -1.271976 0.352169
C -5.101579 0.174906 0.601111
C 5.881269 -1.574101 0.620005
H 0.103011 0.706449 -1.362510
H -0.819542 -0.381148 1.360427
H 1.475623 0.508057 1.369907
H -0.125706 -2.120763 -1.091630
H -0.645583 -2.678698 0.504019
H 1.452750 -1.881078 1.552254
H 1.835507 -2.933604 0.164341
H 3.585272 -0.704799 1.538841
H 2.536244 2.545719 0.528960
H 2.532321 1.954585 -1.145380
H -0.069439 2.880723 -0.316479
H -0.225832 2.192828 1.305703
H -2.909311 -1.195309 1.667190
H -2.813786 -2.453603 0.411983
H 2.911133 -1.895893 -1.927358
H 1.369477 -1.029644 -2.205468
H 2.914934 -0.140362 -2.178480
H -2.496027 3.053374 0.230948
H -2.166538 -1.948331 -1.904804
H -3.327934 -0.632973 -2.197156
H -1.589002 -0.321965 -2.385865
H -4.614179 2.188668 -0.053613
H -4.628441 0.957076 -1.332884
H -4.899952 -1.551523 -0.687059
H -5.185017 -1.969740 1.020806
H -4.931278 0.428403 1.672541
H 5.705161 -1.802171 1.693396
H 6.428312 -0.619558 0.529120
H 6.459351 -2.391635 0.161026
H -7.070169 -0.260534 0.794774


