%chk=000180382.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180382

0 1
O -0.692358 -0.585497 -0.167276
C 5.689159 -0.092506 -0.348009
C 4.901748 -1.053355 0.574042
C 7.157434 -0.550039 -0.486697
C 5.573631 1.360666 0.155297
C 3.414431 -0.903250 0.417416
C 7.934055 -0.598383 0.826515
C 6.066043 2.379227 -0.869972
C 2.768256 -1.437613 -0.716277
C 2.656577 -0.239359 1.388065
C 0.654614 -0.637338 0.117204
C 1.395065 -1.311883 -0.877469
C 1.269736 -0.098564 1.251270
C -2.944129 -0.060244 0.137372
C -1.569698 0.087392 0.786833
C -4.032726 0.593016 0.997649
C -5.381155 0.439912 0.345368
C -5.845636 1.413180 -0.552531
C -6.178188 -0.680384 0.626147
C -7.096515 1.267491 -1.158065
C -7.428261 -0.820887 0.017693
C -7.890744 0.151933 -0.874230
H 5.230171 -0.141008 -1.368309
H 5.204311 -0.890510 1.627315
H 5.193855 -2.100457 0.351971
H 7.674763 0.132229 -1.191528
H 7.182137 -1.548186 -0.966269
H 4.514200 1.575429 0.403375
H 6.136255 1.477687 1.101329
H 8.985890 -0.851131 0.652948
H 7.908527 0.369602 1.341802
H 7.525826 -1.347092 1.513818
H 5.951376 3.402286 -0.495094
H 5.504960 2.309859 -1.808865
H 7.126107 2.233351 -1.107663
H 3.354173 -1.955554 -1.475400
H 3.144885 0.177757 2.268352
H 0.879012 -1.717146 -1.744303
H 0.704453 0.419091 2.017043
H -2.928745 0.386021 -0.878660
H -3.168049 -1.134823 -0.026526
H -3.802056 1.666432 1.156963
H -4.041932 0.141725 2.011083
H -1.496631 -0.428975 1.758428
H -1.249904 1.138594 0.879910
H -5.231355 2.281632 -0.780711
H -5.822999 -1.442863 1.316134
H -7.452928 2.025435 -1.853766
H -8.043381 -1.691625 0.238949
H -8.864258 0.040822 -1.346269


%chk=000180382-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180382

0 1
O -0.720384 -0.617628 -0.398877
C 5.819129 -0.125105 -0.328609
C 4.960266 -1.067107 0.577750
C 7.310860 -0.568523 -0.341665
C 5.617159 1.362729 0.065212
C 3.459321 -0.934175 0.361324
C 8.048384 -0.459487 1.013053
C 6.319551 2.368847 -0.872934
C 2.851172 -1.438872 -0.822121
C 2.620857 -0.302867 1.309867
C 0.648742 -0.680653 -0.082526
C 1.468479 -1.318058 -1.047817
C 1.226911 -0.168620 1.104068
C -3.037472 -0.078842 0.009166
C -1.620140 0.015252 0.579010
C -4.082977 0.569246 0.959080
C -5.499327 0.457152 0.412266
C -6.031036 1.458623 -0.440486
C -6.303830 -0.673068 0.709402
C -7.329540 1.334577 -0.984601
C -7.602971 -0.802269 0.168375
C -8.120649 0.202005 -0.682210
H 5.442513 -0.242916 -1.368864
H 5.201169 -0.863259 1.639243
H 5.272134 -2.112721 0.376346
H 7.858874 0.027038 -1.098003
H 7.355962 -1.621023 -0.690437
H 4.530107 1.574418 0.072493
H 5.967540 1.518962 1.106319
H 9.090538 -0.816492 0.918398
H 8.087409 0.584543 1.373854
H 7.558769 -1.068733 1.794516
H 6.065193 3.409568 -0.599192
H 6.008493 2.212317 -1.923549
H 7.420182 2.273352 -0.830736
H 3.472322 -1.942520 -1.573627
H 3.061081 0.092350 2.233877
H 0.999297 -1.712373 -1.954691
H 0.615991 0.325706 1.865311
H -3.067018 0.418279 -0.978067
H -3.291600 -1.141729 -0.159356
H -3.819182 1.634659 1.111674
H -4.021266 0.077526 1.950336
H -1.548437 -0.515223 1.552639
H -1.322572 1.074761 0.732694
H -5.424622 2.342619 -0.675841
H -5.910488 -1.454550 1.372049
H -7.724816 2.120085 -1.638886
H -8.211307 -1.680934 0.411846
H -9.128770 0.105233 -1.100671


