%chk=000230968.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230968

0 1
O 0.057061 -0.022387 -1.197157
O -0.275253 1.490566 0.511158
O 3.532520 0.218014 -0.057600
O 3.635940 -2.037611 -0.216070
C -0.915845 0.910457 -0.647017
C 1.135884 -0.236773 -0.259142
C 0.752852 0.589843 0.981422
C -2.160998 0.143247 -0.249776
C 2.401976 0.262281 -0.968987
C -1.152958 2.016179 -1.653993
C -2.538863 -0.999487 -0.964996
C -2.940959 0.594969 0.822480
C -3.703802 -1.686247 -0.610803
C -4.104601 -0.094515 1.173086
C -4.487344 -1.233271 0.455617
C 4.095957 -1.013536 0.226077
C 5.268950 -0.804522 1.116087
H 1.171269 -1.333433 -0.078227
H 0.328353 -0.019641 1.795318
H 1.553376 1.247845 1.358735
H 2.350514 1.336819 -1.224769
H 2.622813 -0.338635 -1.868932
H -1.349555 1.598206 -2.650456
H -2.008133 2.642453 -1.370079
H -0.274038 2.670299 -1.732744
H -1.913273 -1.351732 -1.787357
H -2.627311 1.477909 1.381747
H -3.998996 -2.575059 -1.165313
H -4.712573 0.254495 2.005458
H -5.395010 -1.768349 0.729286
H 5.159086 -1.376430 2.051226
H 5.416063 0.255099 1.381472
H 6.193299 -1.157253 0.629650


%chk=000230968-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230968

0 1
O 0.121453 0.163854 -1.344810
O -0.287115 1.743999 0.337323
O 3.543042 0.199850 0.194206
O 3.898751 -1.923142 -0.711908
C -0.944706 1.040622 -0.780203
C 1.119220 -0.080966 -0.267204
C 0.577658 0.711826 0.951461
C -2.121225 0.188956 -0.278873
C 2.460784 0.438301 -0.805042
C -1.340917 2.069035 -1.834903
C -2.384315 -1.083816 -0.839022
C -2.983273 0.704248 0.721425
C -3.499323 -1.835482 -0.403098
C -4.095996 -0.048601 1.157524
C -4.358686 -1.319855 0.594458
C 4.198232 -1.040876 0.122925
C 5.290413 -1.133135 1.165816
H 1.179099 -1.166407 -0.071551
H -0.014519 0.062251 1.623286
H 1.364765 1.234899 1.514976
H 2.433524 1.531648 -0.932850
H 2.710941 -0.067668 -1.752422
H -1.752938 1.556984 -2.720102
H -2.111512 2.748339 -1.433392
H -0.455661 2.654481 -2.131809
H -1.705205 -1.477325 -1.602436
H -2.765052 1.683062 1.163132
H -3.695033 -2.821930 -0.838586
H -4.755239 0.353023 1.935507
H -5.222530 -1.903248 0.932811
H 5.130310 -2.030511 1.787767
H 5.316966 -0.235891 1.800240
H 6.264488 -1.256721 0.660752


