%chk=000228328.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228328

0 1
O 0.306415 1.512180 0.671157
O -0.571028 2.866496 -0.913638
C 0.903083 -0.782287 0.397941
C -0.072946 0.301654 -0.098797
C 2.368775 -0.591574 -0.127018
C 0.355806 -2.170898 0.003806
C -2.020447 -1.338504 -0.158840
C -1.542175 0.059704 0.262287
C -1.087519 -2.395179 0.463233
C -3.480590 -1.584764 0.271538
C 3.267227 -1.694824 0.473026
C 2.426224 -0.668694 -1.663554
C 2.925065 0.770882 0.328105
C -4.476124 -0.761142 -0.541116
C -0.015419 2.739178 0.154097
C 0.433145 3.802965 1.097636
H 0.936467 -0.713619 1.513949
H 0.059780 0.529955 -1.177903
H 1.004978 -2.956984 0.437715
H 0.419809 -2.299567 -1.095441
H -1.960060 -1.417792 -1.272120
H -2.167155 0.838905 -0.219572
H -1.677752 0.198287 1.353121
H -1.415775 -3.411633 0.177350
H -1.147914 -2.354769 1.567101
H -3.601209 -1.362830 1.349382
H -3.719728 -2.660970 0.159919
H 3.258138 -1.667140 1.567038
H 4.307182 -1.572735 0.152698
H 2.951474 -2.695881 0.162664
H 1.791616 0.094004 -2.129323
H 2.096066 -1.644031 -2.035089
H 3.445645 -0.508312 -2.029474
H 2.455218 1.598494 -0.213783
H 4.003404 0.840754 0.158941
H 2.738910 0.944340 1.393289
H -4.303835 0.315523 -0.423074
H -4.407765 -0.984632 -1.612064
H -5.506340 -0.963920 -0.228061
H 0.954325 3.391421 1.975933
H -0.426383 4.388244 1.459266
H 1.115211 4.505999 0.595376


%chk=000228328-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228328

0 1
O 0.290422 1.598027 0.466903
O -0.529499 2.627930 -1.465326
C 0.896341 -0.829145 0.423167
C -0.102179 0.246341 -0.072458
C 2.416312 -0.574249 0.049900
C 0.357560 -2.194652 -0.106852
C -2.078915 -1.373997 -0.124502
C -1.552193 -0.011073 0.383601
C -1.098938 -2.482838 0.323798
C -3.522340 -1.666019 0.358583
C 3.243292 -1.882004 0.224004
C 2.573020 -0.089084 -1.417436
C 3.040766 0.477470 1.012287
C -4.592150 -0.694678 -0.187134
C -0.002488 2.706774 -0.329703
C 0.402455 3.993222 0.360571
H 0.836364 -0.859247 1.533846
H -0.076369 0.317293 -1.176980
H 1.004149 -3.009422 0.261684
H 0.421323 -2.213623 -1.215180
H -2.087958 -1.348739 -1.237227
H -2.186586 0.813747 0.011746
H -1.590233 0.006997 1.492160
H -1.421296 -3.459927 -0.087864
H -1.142635 -2.572629 1.430377
H -3.538653 -1.651907 1.468670
H -3.788205 -2.700533 0.058322
H 3.080274 -2.333988 1.221494
H 4.321435 -1.651281 0.134055
H 3.000722 -2.639326 -0.542599
H 2.135880 0.913562 -1.572477
H 2.094414 -0.784848 -2.132406
H 3.645538 -0.026687 -1.681370
H 2.502475 1.436221 0.972933
H 4.100969 0.652812 0.746066
H 3.010787 0.114695 2.058032
H -4.427928 0.339175 0.166498
H -4.582609 -0.675975 -1.293418
H -5.604770 -0.998198 0.136422
H 0.924368 3.794819 1.307844
H -0.499153 4.599355 0.559216
H 1.050030 4.581932 -0.311545


