%chk=000236996.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236996

0 1
O -2.146240 1.586265 0.813375
O -2.146186 -1.586234 0.813915
O -0.953540 -0.000400 -1.754659
O -1.038612 3.430775 0.100157
O -1.038464 -3.430931 0.101326
C 2.464500 0.704603 0.159030
C 2.464524 -0.704586 0.159289
C 0.019753 1.249156 0.024601
C 0.019801 -1.249291 0.025045
C 1.277934 1.533666 0.396209
C 1.277989 -1.533608 0.396773
C -0.379263 -0.000203 -0.695865
C 3.679050 1.393732 -0.061872
C 3.679098 -1.393755 -0.061364
C 4.860994 0.701625 -0.298045
C 4.861017 -0.701693 -0.297791
C -1.068150 2.235747 0.279695
C -1.068062 -2.235845 0.280465
C -3.404175 2.325142 0.966856
C -3.404071 -2.325139 0.967698
C -4.312780 1.882492 -0.160037
C -4.312794 -1.882805 -0.159224
H 1.483377 2.495072 0.897050
H 1.483471 -2.494818 0.897974
H 3.684545 2.485644 -0.060765
H 3.684631 -2.485666 -0.059858
H 5.787975 1.245441 -0.482107
H 5.788017 -1.245544 -0.481657
H -3.744778 1.987932 1.962115
H -3.203214 3.411801 0.967521
H -3.203055 -3.411788 0.968604
H -3.744605 -1.987708 1.962905
H -5.340885 2.230016 -0.012320
H -3.966718 2.258538 -1.132890
H -4.331271 0.776909 -0.239929
H -5.340939 -2.230066 -0.011168
H -4.331096 -0.777250 -0.239578
H -3.966981 -2.259327 -1.131979


%chk=000236996-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236996

0 1
O -2.332659 2.013901 0.811743
O -2.332050 -2.014235 0.812589
O -1.736535 0.000495 -1.150106
O -0.751441 3.658962 0.324188
O -0.751084 -3.658959 0.323324
C 2.352069 0.722354 0.005290
C 2.352031 -0.722336 0.004857
C -0.165624 1.287287 0.122644
C -0.165694 -1.287221 0.121871
C 1.183093 1.569028 0.181905
C 1.183012 -1.569053 0.180973
C -0.763376 0.000194 -0.337309
C 3.604256 1.401634 -0.115142
C 3.604185 -1.401608 -0.115975
C 4.815955 0.709566 -0.263673
C 4.815919 -0.709514 -0.264091
C -1.086667 2.448325 0.394103
C -1.086752 -2.448410 0.392649
C -3.368383 3.066191 1.049207
C -3.367242 -3.066705 1.051576
C -4.063993 3.429381 -0.265563
C -4.065121 -3.429576 -0.262078
H 1.406119 2.632008 0.358815
H 1.405988 -2.632145 0.357273
H 3.604731 2.497531 -0.096665
H 3.604604 -2.497516 -0.098150
H 5.755404 1.261821 -0.368217
H 5.755340 -1.261754 -0.368961
H -4.055410 2.588387 1.765305
H -2.881993 3.944387 1.509393
H -2.879956 -3.944988 1.510648
H -4.053060 -2.589186 1.769023
H -4.899823 4.125213 -0.064459
H -3.362175 3.922985 -0.958273
H -4.467900 2.526688 -0.753904
H -4.900520 -4.125560 -0.059712
H -4.469982 -2.526779 -0.749435
H -3.364467 -3.922893 -0.956167


