%chk=000267177.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267177

0 1
O -0.739511 -0.798904 -0.553211
O 3.382127 1.079253 0.002157
O 0.835854 1.730545 -2.329599
O 3.597589 -0.769842 -1.291035
O -1.248261 -0.546570 1.641772
C 0.643186 -0.954728 -0.363199
C 1.406538 0.098224 -0.711446
C 1.066260 -2.299149 0.062293
C 0.808717 1.407443 -1.165914
C 0.187630 2.240964 -0.097633
C 1.872857 -3.063996 -0.797964
C 0.678634 -2.818021 1.307688
C 2.883337 0.033761 -0.740580
C 0.716745 2.262909 1.200071
C -0.927250 3.031243 -0.418881
C 2.272583 -4.346849 -0.416468
C 1.087843 -4.098920 1.683732
C -2.988531 -0.381277 -0.052791
C -1.632584 -0.568219 0.501398
C 1.879376 -4.865566 0.821335
C 0.120262 3.063122 2.178591
C -1.524438 3.822282 0.564469
C -1.001262 3.836741 1.862832
C 4.835660 1.269722 0.023515
C -4.038063 -0.142953 0.852335
C -3.237934 -0.431976 -1.433028
C -5.334584 0.041044 0.370665
C -4.539454 -0.246391 -1.905369
C -5.584788 -0.011017 -1.006145
C 5.282799 1.912435 -1.271264
H 2.203242 -2.645685 -1.754479
H 0.067739 -2.215150 1.987549
H 1.600726 1.663402 1.438563
H -1.316588 3.025074 -1.439046
H 2.897697 -4.938528 -1.084327
H 0.789704 -4.499797 2.651403
H 2.193313 -5.866354 1.116505
H 0.528183 3.079454 3.187881
H -2.392645 4.431261 0.319666
H -1.467902 4.455093 2.629002
H 5.314731 0.291354 0.204997
H 4.940674 1.932203 0.901989
H -3.830234 -0.102311 1.924980
H -2.412892 -0.615628 -2.128816
H -6.152087 0.225402 1.066894
H -4.737909 -0.284998 -2.976343
H -6.599830 0.133090 -1.378696
H 4.679988 2.799177 -1.511196
H 5.179061 1.218007 -2.119340
H 6.332792 2.223226 -1.226311


%chk=000267177-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267177

0 1
O -1.080610 -1.205046 -0.306860
O 2.894021 1.373684 -0.683593
O -0.659480 1.471556 -1.572619
O 2.944871 -0.104087 1.126325
O -1.694928 0.306659 1.391132
C 0.316585 -1.016243 -0.186448
C 0.880302 0.241343 -0.177860
C 1.026458 -2.313808 -0.174831
C 0.104762 1.486558 -0.560780
C 0.276947 2.723748 0.263400
C 2.242142 -2.482408 -0.891847
C 0.469453 -3.425285 0.513702
C 2.319434 0.430863 0.178738
C 0.675023 2.662332 1.624551
C -0.023124 3.980664 -0.324116
C 2.900450 -3.727305 -0.894107
C 1.133256 -4.668778 0.514305
C -3.412714 -0.746121 0.010882
C -2.030863 -0.448647 0.458541
C 2.352525 -4.823705 -0.186473
C 0.787525 3.847989 2.380820
C 0.099202 5.164245 0.429943
C 0.507474 5.100453 1.784997
C 4.299280 1.785486 -0.380714
C -4.483521 -0.163803 0.740908
C -3.682334 -1.568915 -1.114401
C -5.814637 -0.409214 0.351564
C -5.017319 -1.808455 -1.499867
C -6.083665 -1.232538 -0.768769
C 5.301613 0.814616 -1.012070
H 2.649930 -1.646556 -1.470846
H -0.476405 -3.305306 1.051566
H 0.857519 1.691700 2.097607
H -0.347799 4.002995 -1.369782
H 3.832934 -3.848062 -1.455839
H 0.702088 -5.515800 1.058744
H 2.866095 -5.791525 -0.189310
H 1.081682 3.796042 3.434775
H -0.122897 6.133315 -0.030380
H 0.599260 6.020332 2.373878
H 4.421578 1.831615 0.715813
H 4.368564 2.795162 -0.815845
H -4.250812 0.475480 1.598934
H -2.848440 -2.001412 -1.672913
H -6.640275 0.039734 0.913664
H -5.228129 -2.439399 -2.369777
H -7.119527 -1.421171 -1.072406
H 5.126160 0.719819 -2.097794
H 5.229347 -0.181552 -0.543981
H 6.330097 1.192354 -0.861357


