%chk=000244974.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244974

0 1
O -3.480343 -1.171200 0.110788
O -1.703183 1.650706 1.198002
O 0.737777 1.620904 0.485503
O -1.831282 -2.684847 -0.242762
O -2.456399 1.481972 -0.930817
N 1.042575 0.263269 0.689457
C 2.432516 0.014105 0.336116
C -1.273627 -0.371093 0.100785
C 0.049314 -0.637509 0.292300
C 3.021748 -1.173701 0.802943
C 3.174645 0.957132 -0.390919
C 4.367970 -1.413507 0.519213
C 4.521114 0.699458 -0.658220
C -2.169701 -1.534987 -0.049388
C -1.880756 0.966987 -0.008035
C 5.117545 -0.483241 -0.209302
C -4.503750 -2.200882 -0.098147
C -2.300202 2.981679 1.314918
C -4.712446 -2.411426 -1.582021
C -1.440346 4.000361 0.596556
H 0.387990 -1.697904 0.260422
H 2.450345 -1.892729 1.388040
H 2.701444 1.879115 -0.735171
H 4.836206 -2.332700 0.872741
H 5.106491 1.425630 -1.222982
H 6.166855 -0.679968 -0.424975
H -4.191086 -3.120171 0.427722
H -5.367535 -1.727909 0.404257
H -3.329053 2.937538 0.913521
H -2.314813 3.110774 2.412233
H -3.851202 -2.921379 -2.038915
H -4.832350 -1.453516 -2.108346
H -5.602360 -3.018285 -1.782906
H -1.457039 3.830900 -0.492740
H -0.390402 3.954992 0.911077
H -1.797360 5.022198 0.772244
H 0.135296 1.870636 1.297410


%chk=000244974-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244974

0 1
O -3.502813 -1.339261 0.118149
O -1.299387 1.992111 1.174478
O 0.908579 1.856820 0.014256
O -1.596897 -2.539724 -0.474306
O -3.281145 1.387867 0.078006
N 1.064813 0.440573 0.118196
C 2.441744 0.024330 0.128073
C -1.388564 -0.183329 0.107056
C 0.002874 -0.398676 0.080274
C 2.799825 -1.291978 0.521301
C 3.441153 0.953505 -0.252277
C 4.155702 -1.677667 0.497272
C 4.793635 0.553145 -0.259670
C -2.142771 -1.448809 -0.134447
C -2.117292 1.059031 0.377932
C 5.160188 -0.761941 0.106657
C -4.324213 -2.561506 -0.135999
C -1.953514 3.288668 1.541101
C -4.722036 -2.647492 -1.612268
C -1.749990 4.345289 0.450976
H 0.276709 -1.451877 -0.055155
H 2.047326 -2.006573 0.867898
H 3.146896 1.965099 -0.536294
H 4.426643 -2.694173 0.801973
H 5.562511 1.274000 -0.557935
H 6.211670 -1.067032 0.097835
H -3.748464 -3.449379 0.179423
H -5.198487 -2.417355 0.518696
H -3.022947 3.077173 1.702816
H -1.472351 3.564164 2.493773
H -3.835008 -2.805237 -2.248261
H -5.233040 -1.723411 -1.932201
H -5.412307 -3.498419 -1.763894
H -2.226961 4.028825 -0.491426
H -0.678611 4.538002 0.263538
H -2.216193 5.296204 0.768752
H 0.047320 2.060433 0.576303


