%chk=000220189.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220189

0 1
O -0.358276 0.439090 -1.273393
O -1.181956 1.019364 0.764034
O 0.089716 -2.334493 -0.033280
O 2.465315 0.114317 -1.532239
O 1.798310 0.101988 1.899883
O -3.217859 -0.552873 0.650034
C -0.947424 -0.125954 -0.077508
C 0.576824 1.433732 -0.767934
C 0.089286 -1.059773 0.604154
C 1.847768 0.654693 -0.368860
C 1.537494 -0.499289 0.623562
C -0.159474 2.014196 0.458128
C -2.309208 -0.738950 -0.428956
H 0.737349 2.132421 -1.608757
H -0.259055 -1.292504 1.641975
H 2.636933 1.318266 0.063508
H 2.255974 -1.337917 0.452333
H 0.467628 2.098738 1.364984
H -0.709048 2.944943 0.255551
H -2.250670 -1.842968 -0.537485
H -2.713643 -0.279484 -1.351840
H 0.337352 -2.251356 -0.981534
H 1.790818 -0.306585 -2.117630
H 1.844910 -0.580583 2.602742
H -3.251063 0.404481 0.905330


%chk=000220189-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220189

0 1
O -0.378622 0.489020 -1.343168
O -1.078170 1.046967 0.824104
O 0.220090 -2.285689 -0.381525
O 2.245705 -0.292592 -1.566116
O 1.571185 0.290344 2.004864
O -3.024854 -0.893199 0.889390
C -0.935033 -0.103258 -0.107378
C 0.664935 1.410697 -0.776132
C 0.076517 -1.118686 0.497792
C 1.853611 0.505894 -0.380728
C 1.475093 -0.476579 0.755995
C -0.090602 2.080033 0.394335
C -2.329886 -0.669363 -0.379715
H 0.940526 2.107062 -1.583496
H -0.359539 -1.513607 1.433687
H 2.731121 1.099430 -0.073800
H 2.215490 -1.302252 0.758731
H 0.564103 2.311789 1.248047
H -0.648384 2.969205 0.055810
H -2.251630 -1.654793 -0.862878
H -2.874581 0.039729 -1.034153
H 0.910835 -2.069634 -1.064130
H 1.494731 -0.243837 -2.218274
H 1.162960 -0.227264 2.742627
H -3.037600 -0.025918 1.372915


