%chk=000251513.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251513

0 1
O -1.574282 -0.311738 0.021583
O -0.880697 1.613681 -0.939947
C -2.989520 0.061868 -0.185770
C -3.696141 -1.296059 -0.203868
C -3.409602 0.948547 0.989107
C -5.216654 -1.098491 -0.185042
C -4.932408 1.125638 1.000640
C -5.653830 -0.229745 1.003134
C -0.604334 0.562433 -0.401982
C 0.722659 -0.004449 -0.093368
C 1.843321 0.643773 -0.440608
C 3.199584 0.145622 -0.165958
C 3.500650 -1.224956 -0.228071
C 4.214858 1.065218 0.153744
C 4.800172 -1.668932 0.031111
C 5.509001 0.614059 0.419602
C 5.804170 -0.752485 0.357719
H -3.062678 0.596307 -1.156783
H -3.370462 -1.893919 0.671168
H -3.385474 -1.875470 -1.092905
H -2.903547 1.931272 0.916996
H -3.064542 0.496599 1.939403
H -5.718825 -2.083204 -0.138089
H -5.547255 -0.631997 -1.133469
H -5.247659 1.718860 0.120018
H -5.232155 1.715198 1.887519
H -6.748232 -0.074009 0.973140
H -5.445104 -0.761825 1.951411
H 0.712899 -0.961638 0.432782
H 1.790422 1.614370 -0.956088
H 2.722829 -1.942595 -0.487233
H 3.990775 2.130359 0.201510
H 5.029663 -2.732400 -0.021278
H 6.291111 1.328324 0.673675
H 6.815282 -1.100917 0.562296


%chk=000251513-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251513

0 1
O -1.594081 -0.484794 0.044117
O -0.826917 1.643325 -0.577369
C -3.012571 -0.013840 -0.088107
C -3.858974 -1.259163 -0.381440
C -3.447482 0.695104 1.208374
C -5.360655 -0.881561 -0.455462
C -4.947872 1.074614 1.132093
C -5.826677 -0.163947 0.835134
C -0.589292 0.458134 -0.221112
C 0.740659 -0.154145 -0.024651
C 1.879101 0.578980 -0.220497
C 3.269033 0.129117 -0.067495
C 3.623062 -1.197738 0.317151
C 4.316899 1.062839 -0.313930
C 4.974083 -1.570881 0.449328
C 5.670398 0.689356 -0.181428
C 6.004784 -0.630139 0.201142
H -3.049481 0.703416 -0.931749
H -3.698354 -1.998433 0.427900
H -3.523421 -1.726212 -1.325859
H -2.825598 1.593983 1.368512
H -3.277985 0.007538 2.060966
H -5.963919 -1.792542 -0.630670
H -5.530610 -0.214002 -1.325527
H -5.095483 1.829132 0.332165
H -5.258871 1.551639 2.080793
H -6.888885 0.133970 0.742928
H -5.762448 -0.870464 1.688417
H 0.747599 -1.204724 0.281713
H 1.734272 1.626029 -0.526562
H 2.838761 -1.937288 0.512211
H 4.058686 2.086900 -0.610426
H 5.230190 -2.594265 0.745252
H 6.461217 1.422228 -0.374976
H 7.054824 -0.924869 0.305165


