%chk=000219294.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219294

0 1
O -2.735517 -0.842440 -1.682390
O -4.187829 -1.415461 2.812917
O -5.220212 1.225226 2.552364
O 5.470292 -0.666005 -0.788097
C -0.721860 -1.528046 0.572255
C -2.104095 -2.075809 0.952544
C 0.393081 -2.525991 0.914916
C -3.212618 -1.107320 0.664250
C -3.478929 -0.596097 -0.566511
C 1.732914 -2.000768 0.477576
C -4.631469 0.279663 -0.866844
C -4.095063 -0.771938 1.797955
C -5.365938 0.814468 0.213098
C -4.947698 0.519920 1.615740
C 2.280305 -2.396748 -0.754555
C 2.440062 -1.106916 1.297698
C -5.003215 0.579761 -2.181075
C -6.462444 1.644339 -0.032471
C 3.515443 -1.904969 -1.174235
C 3.681574 -0.605933 0.902590
C -6.110778 1.404266 -2.418977
C 4.197394 -1.014161 -0.332332
C -6.838227 1.933271 -1.351226
C 5.969934 0.612147 -0.536243
C 5.171572 1.757756 -0.455926
C 7.371418 0.658828 -0.464954
C 5.809446 2.991491 -0.293879
C 7.979168 1.904113 -0.308728
C 7.203587 3.067964 -0.218919
H -0.540742 -0.565982 1.093301
H -0.687310 -1.288598 -0.516260
H -2.117362 -2.340338 2.036819
H -2.303792 -3.035356 0.430244
H 0.187049 -3.509743 0.446395
H 0.397415 -2.726675 2.007468
H 1.738840 -3.094726 -1.392175
H 2.020842 -0.801977 2.256929
H -4.425959 0.170397 -3.014135
H -7.018052 2.066637 0.809909
H 3.957531 -2.200893 -2.123512
H 4.239926 0.073456 1.543614
H -6.401649 1.633268 -3.445147
H -7.698759 2.576038 -1.539750
H -1.886476 -1.355715 -1.466385
H 4.089192 1.694363 -0.531139
H 7.950039 -0.259181 -0.536594
H 5.210678 3.900097 -0.229521
H 9.065830 1.970238 -0.252807
H 7.688961 4.033083 -0.092692


%chk=000219294-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219294

0 1
O -3.616255 -1.663850 -1.760297
O -2.900552 -0.305257 2.817270
O -4.913255 1.630691 2.517897
O 5.663086 -0.653936 -0.655318
C -0.714786 -1.589706 0.370094
C -2.127178 -2.118029 0.750141
C 0.394786 -2.643178 0.634194
C -3.211804 -1.073874 0.567059
C -3.883247 -0.889431 -0.632529
C 1.784919 -2.117062 0.309665
C -4.927517 0.124588 -0.853466
C -3.513942 -0.201018 1.709229
C -5.289939 0.995368 0.217700
C -4.616711 0.883870 1.545362
C 2.460266 -2.496830 -0.878087
C 2.432552 -1.203013 1.182238
C -5.577143 0.249681 -2.105379
C -6.293030 1.973657 0.021917
C 3.732095 -1.974511 -1.198277
C 3.705402 -0.674495 0.883837
C -6.577813 1.229625 -2.288925
C 4.346369 -1.059617 -0.317456
C -6.938421 2.093360 -1.227031
C 6.123041 0.657588 -0.372374
C 5.280698 1.794253 -0.394287
C 7.513451 0.785462 -0.157739
C 5.848823 3.071006 -0.185522
C 8.066240 2.068393 0.045000
C 7.238193 3.216081 0.036616
H -0.507194 -0.685575 0.972149
H -0.681938 -1.274956 -0.692356
H -2.111296 -2.402312 1.818255
H -2.347424 -3.052182 0.185918
H 0.186187 -3.552917 0.036742
H 0.338830 -2.941412 1.700174
H 1.988225 -3.212060 -1.562883
H 1.940603 -0.909798 2.117911
H -5.293396 -0.419993 -2.921016
H -6.548233 2.626515 0.863061
H 4.259450 -2.267185 -2.111096
H 4.199320 0.012922 1.577659
H -7.075991 1.319957 -3.260022
H -7.714624 2.851239 -1.374526
H -2.911890 -2.334117 -1.566372
H 4.208034 1.686482 -0.582289
H 8.134417 -0.115358 -0.156521
H 5.200803 3.954388 -0.204526
H 9.144202 2.170080 0.212209
H 7.670088 4.209471 0.197101


