%chk=000247996.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247996

0 1
O 2.334308 -2.409773 0.561239
O 1.679040 3.479914 0.411450
O 5.349350 0.078400 -1.049116
O -6.260145 -0.330774 0.843363
C 2.187456 -0.089678 -0.046076
C 1.264982 1.152834 0.175064
C -0.124228 0.948471 -0.438449
C -0.803546 -0.244427 0.290622
C 1.529339 -1.228989 0.772901
C 3.551443 0.444378 0.498291
C -2.220398 -0.538646 -0.304744
C 2.134130 2.323288 -0.315788
C 0.092470 -1.499181 0.284438
C 3.577463 1.938243 0.087696
C -0.988603 2.205853 -0.269667
C 2.328544 -0.499629 -1.514013
C -3.050187 0.747925 -0.334215
C -2.382726 1.989362 -0.859107
C -2.909039 -1.593928 0.604887
C -2.140442 -1.058906 -1.750421
C 4.761410 -0.304595 -0.060735
C -4.404157 -1.737858 0.334882
C -4.346810 0.779592 0.015537
C -5.115339 -0.402783 0.447853
C 5.188126 -1.519348 0.700809
H 1.125713 1.320008 1.278397
H -0.024488 0.711623 -1.525724
H -0.956140 0.060280 1.358114
H 1.555411 -1.013928 1.863664
H 3.560676 0.364188 1.609046
H 2.029970 2.535544 -1.396983
H -0.364671 -2.285970 0.913099
H 0.141974 -1.924928 -0.739454
H 3.932579 2.566430 0.921147
H 4.282343 2.098467 -0.752414
H -0.494539 3.075761 -0.748053
H -1.062902 2.484347 0.800934
H 2.766068 -1.506834 -1.589910
H 1.364847 -0.521258 -2.034154
H 2.987953 0.179556 -2.070694
H -2.323154 1.913367 -1.967151
H -3.005966 2.888034 -0.665710
H -2.761732 -1.314892 1.668347
H -2.417224 -2.576907 0.476190
H -1.659917 -2.042084 -1.799870
H -3.138631 -1.163178 -2.192414
H -1.565809 -0.380940 -2.392431
H 1.872412 -3.207318 0.878246
H -4.860729 -2.466135 1.035631
H -4.590722 -2.152881 -0.676752
H 2.252020 4.248074 0.234414
H -4.930456 1.702349 -0.002797
H 5.529984 -1.278100 1.713055
H 4.347131 -2.233833 0.801653
H 6.006457 -2.046784 0.190972


%chk=000247996-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247996

0 1
O 2.357471 -2.502742 0.460829
O 1.697729 3.531754 0.321903
O 5.456586 -0.108048 -0.935216
O -6.297342 -0.300056 1.161809
C 2.210267 -0.121943 -0.148518
C 1.289580 1.128270 0.077919
C -0.132631 0.970021 -0.502689
C -0.806840 -0.276869 0.156288
C 1.531418 -1.285726 0.606758
C 3.554949 0.409326 0.503035
C -2.280271 -0.554005 -0.360413
C 2.165847 2.313295 -0.368292
C 0.099372 -1.537108 0.076892
C 3.616094 1.900239 0.038110
C -1.007480 2.219809 -0.257643
C 2.430498 -0.469715 -1.643080
C -3.091261 0.752163 -0.261810
C -2.439333 2.009551 -0.803550
C -2.927220 -1.651343 0.543095
C -2.291718 -1.023461 -1.850194
C 4.829893 -0.366756 0.130206
C -4.461882 -1.743013 0.418753
C -4.362670 0.796663 0.253943
C -5.129583 -0.392524 0.671961
C 5.304006 -1.435081 1.097412
H 1.181176 1.256760 1.180002
H -0.056660 0.812798 -1.599122
H -0.913904 -0.017942 1.235597
H 1.474095 -1.017120 1.687565
H 3.424034 0.351937 1.602273
H 2.097609 2.468866 -1.466281
H -0.350503 -2.356387 0.673043
H 0.177891 -1.900122 -0.964369
H 3.967996 2.547761 0.861927
H 4.324847 1.990430 -0.803584
H -0.548342 3.107503 -0.725324
H -1.046241 2.432376 0.829262
H 2.921459 -1.453395 -1.727444
H 1.481576 -0.513852 -2.203808
H 3.085998 0.267166 -2.136491
H -2.381014 1.932991 -1.911046
H -3.073042 2.887453 -0.582571
H -2.673538 -1.430014 1.600139
H -2.487191 -2.637539 0.303599
H -1.778565 -1.995046 -1.960507
H -3.328179 -1.147940 -2.211000
H -1.794656 -0.298751 -2.518263
H 1.835768 -3.284371 0.773919
H -4.881376 -2.482903 1.123383
H -4.752096 -2.077063 -0.598529
H 2.279158 4.289080 0.058028
H -4.894258 1.754210 0.332132
H 5.528057 -0.984017 2.083914
H 4.489967 -2.169567 1.242222
H 6.205356 -1.934201 0.708922


