%chk=000227882.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227882

0 1
O -1.938675 -0.437571 -0.820503
O -5.276270 -1.272736 -0.084590
O -1.896986 1.631436 0.085039
C 4.417431 -0.286541 0.250994
C 2.922172 -0.067145 0.110442
C 5.057244 -0.496067 -1.126448
C 4.697675 -1.467522 1.187695
C 2.357114 1.148483 0.531002
C 2.092911 -1.061484 -0.434628
C 0.162257 0.369604 -0.136638
C 0.985782 1.368343 0.409276
C 0.721158 -0.847077 -0.558891
C -1.285416 0.640787 -0.249381
C -3.374030 -0.317800 -1.029064
C -4.101929 -0.517677 0.300885
C -6.205126 -1.473511 0.995325
H 4.878594 0.629030 0.706999
H 4.698468 -1.410662 -1.611759
H 6.147149 -0.576063 -1.046769
H 4.834365 0.339659 -1.800281
H 4.218651 -1.324251 2.163412
H 5.773120 -1.586699 1.360618
H 4.327228 -2.414014 0.778253
H 2.989571 1.927293 0.954835
H 2.524063 -2.006138 -0.763012
H 0.542196 2.313535 0.734974
H 0.073403 -1.619150 -0.983524
H -3.594999 0.656180 -1.496887
H -3.574420 -1.148821 -1.734826
H -4.398665 0.436206 0.769566
H -3.500294 -1.113598 1.010153
H -5.741573 -2.050400 1.800716
H -7.005320 -2.050922 0.515101
H -6.585749 -0.515308 1.361116


%chk=000227882-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227882

0 1
O -1.960071 -0.584039 -0.837513
O -5.585868 -0.892426 -0.127551
O -1.906458 1.571503 0.061562
C 4.499741 -0.218066 0.246813
C 2.986424 -0.042584 0.106484
C 5.176857 -0.441950 -1.132356
C 4.849344 -1.370181 1.227314
C 2.355972 1.164488 0.507011
C 2.172909 -1.079486 -0.426959
C 0.164294 0.295872 -0.157657
C 0.963518 1.336768 0.379646
C 0.781128 -0.918140 -0.560326
C -1.301515 0.523875 -0.278898
C -3.426850 -0.447770 -1.034602
C -4.173262 -0.820295 0.251744
C -6.450655 -1.187646 1.012792
H 4.907014 0.720909 0.672817
H 4.822148 -1.377901 -1.602356
H 6.273823 -0.517579 -1.015817
H 4.957487 0.389325 -1.826019
H 4.395142 -1.203121 2.220419
H 5.944859 -1.449267 1.354877
H 4.482932 -2.341408 0.846069
H 2.966574 1.975802 0.921380
H 2.633757 -2.022756 -0.742789
H 0.475259 2.267597 0.686972
H 0.161181 -1.717797 -0.975015
H -3.668579 0.584379 -1.338301
H -3.671786 -1.158016 -1.838897
H -4.010632 -0.049420 1.033947
H -3.817191 -1.803258 0.631510
H -6.202250 -2.170346 1.468036
H -7.479305 -1.215741 0.620693
H -6.374843 -0.401928 1.794173


