%chk=000269324.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269324

0 1
O 2.572843 0.015327 0.221427
O -0.113183 0.771443 1.775563
O -1.894737 -1.648775 -2.679054
O -2.216924 0.019016 3.096233
O -4.066753 -2.433851 -1.429312
O 3.106384 -1.190923 -1.611564
C 1.662449 0.857385 -0.562762
C 0.301120 0.189666 -0.516278
C 1.748764 2.231095 0.105507
C -0.494097 0.202995 0.755435
C -1.788111 -0.504519 0.764060
C -2.278215 -1.149672 -0.413992
C -0.168347 -0.431264 -1.608842
C -1.484436 -1.120032 -1.650492
C 0.959392 3.245839 -0.658337
C 4.113771 -1.719007 0.597654
C 3.249156 -0.999718 -0.428535
C -2.561800 -0.550768 1.922031
C -3.508603 -1.800309 -0.376455
C -0.009611 4.015700 -0.137191
C -3.832992 -1.232329 1.954890
C -4.297971 -1.844084 0.829739
C 3.656935 -3.174859 0.676035
C 5.575665 -1.587335 0.173841
C -0.733971 5.023167 -0.978835
C -0.447473 3.958729 1.291504
H 2.046992 0.892518 -1.613091
H 2.814571 2.541791 0.160671
H 1.420166 2.156208 1.170356
H 0.401549 -0.483310 -2.547505
H 3.970255 -1.229637 1.598401
H 1.241901 3.340734 -1.706427
H -4.386007 -1.231761 2.897638
H 4.280969 -3.744728 1.375338
H 3.722553 -3.675120 -0.300538
H 2.619126 -3.258051 1.021037
H 6.234738 -2.126733 0.865055
H 5.902639 -0.540529 0.158726
H 5.746953 -2.001961 -0.829697
H -5.253470 -2.373383 0.796177
H -1.784735 4.733613 -1.119547
H -0.731209 6.014549 -0.505811
H -0.295451 5.141437 -1.977698
H -0.124167 3.027535 1.790007
H -0.022505 4.794259 1.864413
H -1.538393 4.015772 1.390838
H -1.295962 0.497674 3.042743
H -3.470367 -2.378094 -2.279756


%chk=000269324-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269324

0 1
O 2.755498 0.175964 0.305712
O 0.097194 0.525463 1.934889
O -1.833955 -1.374944 -2.874629
O -1.934885 -0.346202 3.135419
O -3.904427 -2.263290 -1.720889
O 3.148033 -1.125586 -1.595060
C 1.757572 0.991099 -0.471988
C 0.417943 0.267290 -0.471161
C 1.760388 2.395674 0.168954
C -0.346257 0.083419 0.788367
C -1.629660 -0.613793 0.731069
C -2.140682 -1.110188 -0.506184
C -0.088529 -0.235097 -1.652342
C -1.377468 -0.929407 -1.734949
C 0.863450 3.355842 -0.588773
C 4.279740 -1.670198 0.551074
C 3.370372 -0.882721 -0.386771
C -2.386257 -0.801340 1.929017
C -3.397537 -1.783579 -0.546886
C -0.186706 4.077824 -0.099604
C -3.648970 -1.481288 1.874816
C -4.145289 -1.962191 0.664358
C 3.411844 -2.704574 1.326304
C 5.419489 -2.351399 -0.234270
C -0.963002 5.022434 -1.004213
C -0.672065 4.036629 1.338819
H 2.118723 1.042042 -1.516411
H 2.809340 2.752816 0.132391
H 1.479133 2.303182 1.227692
H 0.473874 -0.137666 -2.586956
H 4.692306 -0.954320 1.286098
H 1.115341 3.485954 -1.654100
H -4.204009 -1.608375 2.808507
H 4.044638 -3.253013 2.046380
H 2.966329 -3.438635 0.630475
H 2.601140 -2.206202 1.886132
H 6.042948 -2.953332 0.450745
H 6.068722 -1.609449 -0.732059
H 5.008964 -3.015587 -1.014341
H -5.105671 -2.482308 0.607915
H -2.034199 4.741465 -1.044326
H -0.923907 6.060729 -0.618810
H -0.569277 5.024511 -2.035337
H -0.159491 3.277847 1.950408
H -0.530047 5.023129 1.823716
H -1.759148 3.824680 1.373111
H -1.007461 0.109718 2.949393
H -3.204684 -2.027328 -2.468098


