%chk=000289506.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289506

0 1
O -2.145101 0.929403 -2.644101
O -1.770403 2.614585 0.254116
O -3.405945 -2.111663 0.459324
O -2.920107 2.154988 2.142923
O -2.109444 -2.385633 -1.370018
O 5.870551 -0.613185 0.176023
C -0.441670 0.077018 1.001942
C 0.350096 0.631328 -0.206202
C -1.964885 0.306532 0.856030
C -2.561627 -0.112425 -0.509741
C -0.097655 -1.403828 1.229422
C -0.197637 0.087180 -1.537646
C 1.822980 0.312596 -0.090871
C -1.664207 0.378680 -1.687554
C 1.381567 -1.543170 1.604594
C 2.301049 -0.727917 0.735693
C -3.982650 0.423390 -0.694038
C -2.296105 1.755282 1.189808
C -2.629991 -1.641016 -0.574159
C 2.733248 1.068006 -0.842315
C 3.670727 -0.999778 0.792003
C 4.105509 0.812937 -0.800957
C 4.557360 -0.228049 0.019748
C -2.013577 4.035076 0.448517
C -3.600301 -3.551660 0.523656
C 6.879900 0.102059 -0.576400
H -0.105467 0.644575 1.911279
H 0.219119 1.749338 -0.210384
H -2.490100 -0.305471 1.649822
H -0.299093 -1.996514 0.313408
H -0.731765 -1.838335 2.024538
H -0.031863 -1.013076 -1.612740
H 0.364707 0.518765 -2.391904
H 1.671274 -2.614645 1.563660
H 1.536058 -1.236660 2.662703
H -3.991381 1.521322 -0.762324
H -4.424179 0.068636 -1.637577
H -4.645526 0.120222 0.126378
H 2.367554 1.876426 -1.478113
H 4.069928 -1.794463 1.417732
H 4.787849 1.411048 -1.392982
H -3.042150 4.207878 0.783783
H -1.834245 4.448369 -0.550340
H -1.296050 4.408667 1.184608
H -2.633387 -4.048110 0.649348
H -4.096595 -3.895447 -0.389787
H -4.240958 -3.663745 1.405044
H 6.899671 1.154710 -0.280599
H 6.710129 -0.018228 -1.650150
H 7.798389 -0.411798 -0.263700


%chk=000289506-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289506

0 1
O -2.191458 1.056865 -2.656812
O -1.920678 2.684837 0.183438
O -3.286571 -2.171519 0.488981
O -2.849035 2.220454 2.264215
O -2.214989 -2.310976 -1.566058
O 5.965184 -0.740123 0.163696
C -0.456029 0.104315 1.028977
C 0.368131 0.661471 -0.164238
C -1.996369 0.359996 0.877473
C -2.596439 -0.076453 -0.515656
C -0.108722 -1.385350 1.281604
C -0.210375 0.174870 -1.536515
C 1.851719 0.301174 -0.051383
C -1.699153 0.447581 -1.676962
C 1.367362 -1.507992 1.713868
C 2.320693 -0.742586 0.799931
C -4.061876 0.414658 -0.679624
C -2.318671 1.817580 1.204625
C -2.636381 -1.616172 -0.612961
C 2.795516 1.012350 -0.829275
C 3.698267 -1.048568 0.831406
C 4.174580 0.716036 -0.799101
C 4.625386 -0.332979 0.040141
C -2.204785 4.125536 0.398269
C -3.453207 -3.645958 0.461205
C 6.961970 -0.032539 -0.642092
H -0.137852 0.654233 1.940932
H 0.276815 1.763975 -0.160533
H -2.519553 -0.223696 1.655505
H -0.273386 -1.988456 0.369066
H -0.765507 -1.797849 2.070871
H -0.051274 -0.915840 -1.641835
H 0.315657 0.667233 -2.371612
H 1.666264 -2.572516 1.758255
H 1.471833 -1.114316 2.746790
H -4.079082 1.513210 -0.765006
H -4.502324 0.013325 -1.607482
H -4.673057 0.096146 0.181156
H 2.444550 1.826192 -1.476878
H 4.077992 -1.849218 1.476070
H 4.869024 1.293415 -1.416314
H -3.283843 4.277325 0.567449
H -1.874632 4.615939 -0.527676
H -1.644188 4.496418 1.272519
H -2.466328 -4.138887 0.474241
H -3.997861 -3.950038 -0.447811
H -4.026705 -3.879460 1.368739
H 7.004543 1.042855 -0.379799
H 6.756822 -0.141222 -1.725136
H 7.921621 -0.511072 -0.397167


