%chk=000248270.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248270

0 1
O -5.061139 1.386397 0.667310
O 5.745894 -0.244671 -0.089841
O -5.637181 -1.454874 -0.038066
C 0.099588 0.481607 0.324961
C -0.744394 -0.688285 -0.254899
C -2.178267 -0.558106 0.274122
C 1.550169 0.446530 -0.269510
C -2.815406 0.792303 -0.183875
C -0.564390 1.862440 0.125280
C -2.050577 1.919770 0.515777
C -0.125880 -2.032404 0.172653
C 2.120719 -0.966871 -0.172978
C 2.422858 1.427189 0.561771
C -3.210832 -1.633079 -0.104371
C -4.279129 0.588537 0.242716
C 1.360833 -2.055374 0.010816
C 1.556044 0.847368 -1.756426
C 3.603584 -1.112547 -0.376568
C -2.853338 1.000364 -1.703254
C 3.915927 1.329655 0.247240
C -4.556801 -0.944683 0.032450
C 4.408265 -0.107396 0.458382
C 6.799407 0.222840 0.767814
H 0.188896 0.307976 1.426980
H -0.740004 -0.629769 -1.368308
H -2.116770 -0.544193 1.395625
H -0.458305 2.175739 -0.934615
H -0.011700 2.619102 0.715839
H -2.167419 1.842573 1.613591
H -2.476959 2.904987 0.244428
H -0.580762 -2.854188 -0.416564
H -0.371279 -2.253808 1.233336
H 2.263259 1.230770 1.640378
H 2.080500 2.464850 0.386459
H -3.146710 -2.528386 0.538920
H -3.072489 -2.006602 -1.136635
H 1.800144 -3.051540 0.062630
H 1.002283 0.123132 -2.364126
H 1.102596 1.832388 -1.912718
H 2.577996 0.891065 -2.151388
H 3.953922 -2.138827 -0.146576
H 3.847566 -0.967218 -1.453023
H -3.346198 0.177316 -2.231370
H -3.382871 1.926907 -1.960028
H -1.839000 1.083710 -2.116128
H 4.120851 1.637491 -0.797535
H 4.487841 2.031672 0.880183
H 4.417193 -0.383859 1.532788
H 7.701869 -0.007128 0.187385
H 6.800196 -0.325502 1.714269
H 6.713499 1.300133 0.933700


%chk=000248270-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248270

0 1
O -5.096316 1.408610 0.822909
O 5.878940 -0.355634 0.043828
O -5.679432 -1.519141 0.439552
C 0.105804 0.494770 0.205371
C -0.752155 -0.703186 -0.318268
C -2.187897 -0.570738 0.225440
C 1.579822 0.459021 -0.356074
C -2.868363 0.786870 -0.152511
C -0.585620 1.875836 -0.008044
C -2.057657 1.935584 0.480292
C -0.120722 -2.041870 0.130457
C 2.155378 -0.969499 -0.267802
C 2.471549 1.394606 0.533188
C -3.241681 -1.657598 -0.111323
C -4.286664 0.565975 0.379785
C 1.382510 -2.064815 -0.035151
C 1.639765 0.932185 -1.842415
C 3.659313 -1.116453 -0.467023
C -3.040287 0.994239 -1.693159
C 3.987250 1.289214 0.245824
C -4.568111 -0.979079 0.256032
C 4.470358 -0.163236 0.430636
C 6.833858 0.244239 0.973756
H 0.191348 0.339491 1.306246
H -0.772216 -0.684374 -1.427732
H -2.093581 -0.559114 1.336353
H -0.557711 2.147187 -1.079674
H -0.011044 2.659071 0.520990
H -2.096182 1.840217 1.584074
H -2.502168 2.916609 0.228555
H -0.569549 -2.882307 -0.437083
H -0.378062 -2.231353 1.197158
H 2.292063 1.137366 1.598290
H 2.152032 2.445583 0.399887
H -3.123371 -2.603328 0.444370
H -3.244174 -1.914985 -1.189739
H 1.869805 -3.048290 0.038807
H 0.880089 0.413321 -2.454754
H 1.473886 2.021386 -1.930785
H 2.622721 0.714998 -2.293529
H 3.973810 -2.157504 -0.274071
H 3.946256 -0.888404 -1.514140
H -3.627978 0.189013 -2.170414
H -3.569219 1.946639 -1.875887
H -2.063673 1.039198 -2.202501
H 4.216650 1.606994 -0.789649
H 4.533464 1.973393 0.923403
H 4.342974 -0.455613 1.500564
H 7.830259 -0.092294 0.645194
H 6.655295 -0.100466 2.015390
H 6.802732 1.353169 0.954379


