%chk=000227449.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227449

0 1
O -1.062192 0.530774 0.069626
O 2.736271 -2.014379 0.902524
O 4.472086 0.233006 0.158883
O 3.074221 2.771283 -0.311257
O -0.214939 -2.800482 0.979366
C 0.894992 -0.691899 0.443250
C 0.326095 0.566490 0.098111
C 2.294493 -0.801768 0.511123
C -0.196927 -1.638458 0.670333
C -1.449173 -0.801951 0.410143
C 3.083968 0.337733 0.181011
C 1.051238 1.710445 -0.153560
C 2.462326 1.580939 -0.089297
C -2.732030 -1.172042 0.462310
C -3.917559 -0.354904 0.199756
C -5.166664 -0.999284 0.084371
C -3.854013 1.042478 0.065954
C 4.144706 -2.212315 1.216013
C 4.978876 -0.139193 -1.158045
C 4.504189 2.907914 -0.080092
C -6.321209 -0.257340 -0.164121
C -5.015407 1.780274 -0.180067
C -6.248906 1.134541 -0.296607
H 0.591779 2.667644 -0.381146
H -2.930410 -2.223990 0.731831
H -5.232496 -2.081644 0.186218
H -2.894701 1.558174 0.155743
H 4.098854 -3.109639 1.847291
H 4.558929 -1.353172 1.755129
H 4.687634 -2.398814 0.286266
H 6.059354 -0.176908 -0.988883
H 4.712378 0.622974 -1.894936
H 4.583364 -1.114629 -1.453901
H 4.604333 3.992826 0.047461
H 5.037938 2.552131 -0.965002
H 4.816558 2.360501 0.816777
H -7.281731 -0.762096 -0.254747
H -4.955411 2.862873 -0.281677
H -7.151713 1.710807 -0.489550


%chk=000227449-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227449

0 1
O -0.991854 0.612856 -0.082056
O 2.760804 -2.127856 0.791734
O 4.595245 0.034430 -0.031915
O 3.433404 2.552054 -0.741644
O -0.273798 -2.730467 1.087710
C 0.932393 -0.669212 0.347803
C 0.426979 0.583018 -0.078706
C 2.340698 -0.867131 0.411281
C -0.222422 -1.539315 0.662773
C -1.422576 -0.675334 0.364670
C 3.187074 0.215094 0.023645
C 1.221411 1.678045 -0.418638
C 2.619808 1.478073 -0.343567
C -2.731162 -1.045183 0.494301
C -3.957235 -0.295987 0.232785
C -5.207302 -0.946426 0.464468
C -3.971339 1.051831 -0.242966
C 4.094589 -2.348318 1.390963
C 5.105760 -0.093899 -1.421230
C 4.447389 3.014096 0.239666
C -6.426640 -0.281153 0.231983
C -5.193984 1.711982 -0.474523
C -6.425560 1.053170 -0.239723
H 0.814704 2.645441 -0.716917
H -2.838984 -2.078504 0.854722
H -5.210320 -1.981094 0.828927
H -3.024222 1.565076 -0.425730
H 3.995797 -3.318693 1.900921
H 4.339823 -1.550818 2.112499
H 4.877106 -2.392430 0.616966
H 6.193877 -0.231068 -1.325186
H 4.883847 0.821734 -1.998635
H 4.652217 -0.972719 -1.916848
H 5.001935 3.810896 -0.278077
H 5.121035 2.190493 0.529781
H 3.938754 3.425206 1.131240
H -7.375029 -0.797657 0.416066
H -5.190713 2.745193 -0.839661
H -7.372406 1.573475 -0.422280


