%chk=000249561.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249561

0 1
O -1.161093 0.506115 0.225070
O -4.949655 -1.276852 -0.005829
C 1.165793 0.137977 0.762160
C 2.458077 0.065774 -0.151715
C 1.687416 -0.675903 -1.308276
C 0.165860 0.871978 -0.202542
C 0.713696 -1.353460 0.820228
C 0.501571 0.283850 -1.602231
C 1.094315 -1.911550 -0.576421
C 1.309583 0.803794 2.110106
C 3.029178 1.426231 -0.563202
C 3.604970 -0.749184 0.450628
C -2.217184 1.325041 -0.335672
C -3.502474 0.675928 0.170139
C -3.740690 -0.681384 -0.498435
H 2.289932 -0.921502 -2.187635
H 0.267912 1.970578 -0.161088
H -0.371620 -1.422797 1.006597
H 1.213852 -1.895886 1.633274
H 0.775919 1.061883 -2.326242
H -0.362249 -0.255496 -2.020571
H 1.827910 -2.727684 -0.506161
H 0.219867 -2.318365 -1.104716
H 2.008804 0.258796 2.754637
H 1.679062 1.831235 2.021356
H 0.341860 0.843381 2.628360
H 3.852811 1.301839 -1.275611
H 2.297117 2.083302 -1.039772
H 3.424995 1.962460 0.306673
H 4.382360 -0.942902 -0.296169
H 4.070357 -0.213499 1.285448
H 3.282239 -1.720709 0.838451
H -2.101512 2.356759 0.040584
H -2.142446 1.320621 -1.436250
H -4.367816 1.343867 -0.005969
H -3.436414 0.544950 1.270133
H -3.939522 -0.590250 -1.581936
H -2.891519 -1.369159 -0.328511
H -4.871063 -1.474979 0.946610


%chk=000249561-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249561

0 1
O -1.204241 0.409396 0.225309
O -5.276026 -1.071815 0.129785
C 1.193477 0.058790 0.752390
C 2.496796 0.086748 -0.154931
C 1.791817 -0.661374 -1.346546
C 0.162541 0.755507 -0.191542
C 0.831046 -1.464262 0.754424
C 0.549947 0.238696 -1.624867
C 1.267253 -1.962980 -0.669691
C 1.276621 0.690931 2.144030
C 3.008559 1.506260 -0.512984
C 3.695633 -0.680269 0.454331
C -2.229356 1.242148 -0.417349
C -3.597445 0.782628 0.099709
C -3.933949 -0.660690 -0.320021
H 2.426388 -0.837362 -2.232541
H 0.267490 1.860817 -0.121018
H -0.246808 -1.601422 0.936974
H 1.377439 -1.988697 1.559023
H 0.780360 1.067334 -2.317622
H -0.278474 -0.347027 -2.064188
H 2.056588 -2.733482 -0.610111
H 0.425888 -2.399987 -1.236770
H 2.011881 0.165530 2.781369
H 1.570743 1.756795 2.090615
H 0.293741 0.639209 2.646883
H 3.886031 1.433764 -1.182995
H 2.259708 2.137396 -1.019861
H 3.334514 2.041173 0.399370
H 4.504786 -0.778726 -0.294519
H 4.110932 -0.125361 1.316789
H 3.437295 -1.693495 0.802462
H -2.053845 2.312457 -0.167502
H -2.174864 1.135423 -1.523997
H -4.381958 1.461242 -0.286915
H -3.601814 0.862896 1.205247
H -3.980897 -0.742063 -1.419918
H -3.154719 -1.355197 0.052410
H -5.292880 -1.066136 1.120271


