%chk=000230348.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230348

0 1
O -1.923492 -0.933598 -0.000077
O 5.600808 0.847280 -0.000544
O -0.880260 1.122538 -0.000225
N 0.304254 -0.920470 -0.000208
C 1.665337 -0.462488 -0.000299
C 2.675304 -1.438850 -0.000287
C 1.992243 0.911143 -0.000399
C 4.331103 0.309697 -0.000469
C 4.019278 -1.053781 -0.000373
C 3.323098 1.299132 -0.000486
C -3.202552 -0.338731 -0.000043
C -0.806358 -0.081669 -0.000188
C -3.824539 -0.113146 -1.230954
C -3.823902 -0.111670 1.230921
C -5.144102 0.347730 -1.215650
C -5.143468 0.349195 1.215749
C -5.799969 0.576479 0.000082
C 6.720861 -0.069349 -0.000682
H 2.427475 -2.499164 -0.000211
H 1.200199 1.670392 -0.000410
H 4.794032 -1.814129 -0.000362
H 3.606792 2.351208 -0.000568
H 0.144252 -1.931601 -0.000155
H -3.292317 -0.292870 -2.161772
H -3.291194 -0.290264 2.161679
H -5.661538 0.532867 -2.156710
H -5.660414 0.535470 2.156854
H -6.827006 0.938028 0.000133
H 6.713303 -0.680482 -0.907532
H 6.713563 -0.680409 0.906220
H 7.574210 0.622010 -0.000834


%chk=000230348-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230348

0 1
O -1.933707 -0.954933 -0.000553
O 5.727586 0.846827 -0.000157
O -0.925338 1.198422 0.000037
N 0.316646 -0.825048 -0.000631
C 1.671962 -0.383739 -0.000488
C 2.687120 -1.370603 -0.000688
C 2.036072 0.990866 -0.000178
C 4.408742 0.361747 -0.000283
C 4.051304 -1.008928 -0.000587
C 3.394016 1.350663 -0.000080
C -3.250860 -0.395716 -0.000276
C -0.822422 -0.047071 -0.000445
C -3.895803 -0.163474 -1.230823
C -3.894380 -0.160954 1.230543
C -5.225156 0.315399 -1.224610
C -5.223729 0.317926 1.224884
C -5.890613 0.556292 0.000277
C 6.807338 -0.141460 -0.000400
H 2.416690 -2.434240 -0.000925
H 1.258060 1.757073 -0.000026
H 4.811022 -1.795863 -0.000745
H 3.691604 2.403646 0.000153
H 0.148867 -1.833506 -0.000911
H -3.363162 -0.354855 -2.167642
H -3.360667 -0.350393 2.167147
H -5.737866 0.501018 -2.174611
H -5.735333 0.505515 2.175093
H -6.920865 0.928221 0.000493
H 6.770616 -0.779403 -0.905442
H 6.770649 -0.779812 0.904356
H 7.736609 0.446882 -0.000283


