%chk=000282515.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282515

0 1
O 4.178114 -0.255032 -0.045206
O -6.090886 1.406804 -1.395315
O 4.171101 1.962619 -0.495757
C 0.635452 -1.122136 -0.471860
C -0.686130 -1.052578 0.316680
C 1.675005 -0.084730 0.076270
C -1.251390 0.391100 0.093758
C -2.623137 0.602615 0.813202
C 1.122518 1.322855 -0.184714
C -0.235018 1.475189 0.512731
C -1.715770 -2.124202 -0.132042
C 2.925870 -0.454391 -0.778168
C 1.455064 -2.425357 -0.529194
C 2.857868 -1.979260 -0.997576
C -3.094351 -1.880270 0.532208
C -3.547166 -0.478112 0.257267
C 1.997903 -0.274682 1.564404
C -3.197462 2.021889 0.547337
C -2.499102 0.440315 2.340211
C -1.278489 -3.554519 0.204480
C -3.902849 2.167354 -0.798247
C -4.630231 -0.225775 -0.493219
C -5.006204 1.133435 -0.927860
C 4.705198 1.013048 0.027284
C 5.969997 0.954217 0.843508
C 7.067312 1.787444 0.195979
H 0.394606 -0.845963 -1.531852
H -0.477614 -1.195365 1.403352
H -1.440553 0.511504 -1.002922
H 1.022920 1.510296 -1.270255
H 1.836594 2.092861 0.171504
H -0.090575 1.453970 1.610307
H -0.653902 2.477574 0.284693
H -1.847171 -2.043540 -1.239478
H 2.994401 0.130407 -1.715042
H 1.009383 -3.162680 -1.217171
H 1.508310 -2.907559 0.461980
H 3.655969 -2.482744 -0.420578
H 3.033390 -2.234291 -2.054587
H -3.034644 -2.065667 1.623585
H -3.824665 -2.622834 0.152639
H 2.563398 -1.198077 1.736857
H 2.609679 0.551383 1.941680
H 1.087463 -0.322351 2.172117
H -2.385909 2.774960 0.622783
H -3.916101 2.280599 1.352499
H -1.956383 -0.473017 2.611460
H -1.954766 1.279822 2.787211
H -3.484045 0.394153 2.818680
H -0.865271 -3.631096 1.215474
H -2.117317 -4.257850 0.141184
H -0.517206 -3.918546 -0.496988
H -3.192780 2.043122 -1.640212
H -4.321656 3.187293 -0.912543
H -5.290815 -1.014696 -0.853391
H 5.744079 1.328871 1.865892
H 6.297805 -0.100365 0.974278
H 6.727742 2.815742 0.000642
H 7.952139 1.846347 0.840793
H 7.385677 1.364697 -0.765452


%chk=000282515-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000282515

0 1
O 4.235847 -0.223279 0.017497
O -5.475651 1.661359 -2.275262
O 4.323764 1.719056 -1.286946
C 0.635857 -1.220378 -0.267223
C -0.746915 -1.134473 0.448101
C 1.709566 -0.265899 0.367088
C -1.227884 0.364703 0.291164
C -2.695627 0.612192 0.840947
C 1.216484 1.193543 0.260544
C -0.188878 1.354822 0.887056
C -1.790910 -2.173238 -0.086320
C 2.913295 -0.603182 -0.559580
C 1.404772 -2.567381 -0.422315
C 2.875784 -2.141790 -0.748017
C -3.256365 -1.834527 0.361324
C -3.570791 -0.389767 0.085019
C 2.052076 -0.626679 1.836597
C -3.220566 2.059791 0.591488
C -2.769051 0.368687 2.379245
C -1.514146 -3.630482 0.363174
C -3.586295 2.362564 -0.875416
C -4.464433 -0.025583 -0.891956
C -4.606695 1.352670 -1.402394
C 4.837679 0.959137 -0.435079
C 6.181422 1.152009 0.253281
C 6.909703 2.429230 -0.200596
H 0.463324 -0.843447 -1.303295
H -0.598701 -1.346983 1.528538
H -1.271311 0.558147 -0.804842
H 1.178375 1.487878 -0.807814
H 1.928234 1.885601 0.751217
H -0.130084 1.218781 1.984318
H -0.524852 2.394224 0.718701
H -1.773831 -2.128235 -1.197039
H 2.804901 -0.059886 -1.517440
H 0.980294 -3.195709 -1.223940
H 1.368250 -3.156229 0.511501
H 3.598099 -2.611456 -0.057698
H 3.174253 -2.423287 -1.772571
H -3.350543 -2.066704 1.440655
H -3.953518 -2.500648 -0.179426
H 2.368991 -1.678353 1.948005
H 2.885927 0.004805 2.190148
H 1.193939 -0.461213 2.509707
H -2.492900 2.801909 0.965882
H -4.133727 2.188345 1.207242
H -2.266461 -0.560387 2.695373
H -2.291635 1.207956 2.916684
H -3.821944 0.316726 2.712133
H -1.426822 -3.685414 1.465628
H -2.353138 -4.286434 0.062933
H -0.596260 -4.051257 -0.071126
H -2.688434 2.306775 -1.525094
H -4.000202 3.379777 -0.990463
H -5.075617 -0.785955 -1.395813
H 6.004023 1.157740 1.346096
H 6.792683 0.250123 0.057823
H 6.301986 3.326800 0.005652
H 7.873939 2.529252 0.328260
H 7.106120 2.408458 -1.286057


