%chk=000269458.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269458

0 1
O 3.043145 1.633345 0.152470
O -2.906347 -1.544560 -0.008099
N -1.614531 0.384384 0.037591
N -0.441206 -0.327169 0.058355
C -5.351808 -0.203492 -0.051953
C -6.576470 0.718972 -0.071974
C -4.044047 0.598818 -0.015717
C -7.875115 -0.083004 -0.108032
C -2.849397 -0.340448 0.003408
C 1.949829 -0.437317 0.111883
C 3.186883 0.264999 0.145152
C 1.990973 -1.837038 0.101939
C 4.412704 -0.408189 0.167535
C 0.692178 0.322557 0.089519
C 3.213450 -2.519726 0.124145
C 4.253067 2.458522 0.186258
C 4.412622 -1.808148 0.156668
C 3.705290 3.871971 0.184827
H -5.395821 -0.886284 0.821326
H -5.356052 -0.871667 -0.937552
H -6.530429 1.392778 -0.949933
H -6.570427 1.378048 0.818267
H -4.031794 1.255652 0.877741
H -3.991725 1.270481 -0.896609
H -7.931744 -0.721731 -0.997519
H -7.971653 -0.736451 0.767213
H -8.749354 0.577385 -0.122294
H -1.612375 1.409339 0.045977
H 1.050660 -2.399068 0.076408
H 5.354691 0.127187 0.192899
H 0.817319 1.418661 0.101407
H 4.812852 2.216512 1.105938
H 4.853961 2.230610 -0.710805
H 3.221559 -3.607338 0.115859
H 5.362893 -2.341909 0.173922
H 4.513404 4.612234 0.208796
H 3.095859 4.063058 -0.709387
H 3.056058 4.049426 1.053472


%chk=000269458-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269458

0 1
O 3.004221 1.670879 0.153813
O -3.000603 -1.731372 -0.012712
N -1.627561 0.173560 0.035181
N -0.439925 -0.535529 0.057328
C -5.419158 -0.206289 -0.057374
C -6.603195 0.785510 -0.068796
C -4.054398 0.507443 -0.018360
C -7.972029 0.072235 -0.108221
C -2.875417 -0.481317 0.000390
C 1.977285 -0.501699 0.113555
C 3.178521 0.275547 0.146796
C 2.086895 -1.918851 0.104946
C 4.444583 -0.357115 0.170196
C 0.674639 0.169681 0.088794
C 3.344360 -2.551291 0.128346
C 4.209686 2.523185 0.185185
C 4.522010 -1.767305 0.160902
C 3.728196 3.971503 0.184163
H -5.500600 -0.882486 0.814493
H -5.463376 -0.858414 -0.950000
H -6.513873 1.459943 -0.945710
H -6.551546 1.434735 0.829863
H -3.996906 1.160085 0.878081
H -3.954507 1.176919 -0.898502
H -8.062998 -0.559450 -1.011618
H -8.101420 -0.584483 0.772352
H -8.806607 0.797132 -0.116003
H -1.617484 1.206637 0.043825
H 1.158480 -2.498290 0.079328
H 5.365903 0.231261 0.195260
H 0.686392 1.275280 0.097423
H 4.797348 2.294559 1.097657
H 4.835890 2.305891 -0.704092
H 3.409902 -3.643994 0.121279
H 5.505154 -2.250594 0.179246
H 4.594321 4.657503 0.207626
H 3.138003 4.186100 -0.722999
H 3.098917 4.174292 1.067462


