%chk=000189541.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189541

0 1
O 0.712336 -0.322681 0.014453
O -2.712833 2.999655 -0.555802
O -4.638221 0.964361 0.228372
O -0.143428 3.679963 -0.061010
C -2.372251 1.850099 0.221927
C -3.333556 0.765063 -0.340562
C -0.925485 1.447026 0.082985
C -2.928813 -0.647260 0.014303
C -1.562422 -0.968084 0.176284
C -0.596739 0.131586 0.085977
C 0.112629 2.486671 -0.020330
C -3.893177 -1.651874 0.139424
C -1.176355 -2.289383 0.444205
C 1.733599 0.631845 -0.059720
C 1.480557 1.954288 -0.078547
C -3.502334 -2.965738 0.414858
C -2.147691 -3.285905 0.560017
C 3.030817 -0.060814 -0.116646
C 4.137756 0.480328 0.558769
C 3.164074 -1.253589 -0.846682
C 5.372370 -0.169198 0.494005
C 4.402951 -1.895587 -0.906294
C 5.506320 -1.354266 -0.237984
H -2.605193 2.078001 1.291186
H -3.415527 0.879187 -1.452186
H -4.950702 -1.390469 0.035635
H -0.118123 -2.527973 0.565822
H 2.276982 2.696631 -0.157325
H -2.016991 3.717442 -0.451397
H -4.931504 1.889296 0.037446
H -4.259187 -3.744292 0.517658
H -1.850175 -4.312695 0.769165
H 4.033156 1.401158 1.134236
H 2.298825 -1.671841 -1.363974
H 6.233012 0.249173 1.015765
H 4.509122 -2.818815 -1.475386
H 6.472601 -1.856710 -0.287047


%chk=000189541-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189541

0 1
O 0.701246 -0.367543 0.008306
O -2.738566 3.099843 -0.245518
O -4.726548 1.077192 -0.143835
O -0.170776 3.688696 0.289321
C -2.417581 1.794587 0.329073
C -3.321352 0.792792 -0.409882
C -0.951631 1.406306 0.165657
C -2.998546 -0.644441 -0.038852
C -1.628509 -1.010908 0.136941
C -0.629498 0.064998 0.086404
C 0.098642 2.427875 0.183734
C -3.999955 -1.628336 0.062118
C -1.281185 -2.363478 0.382446
C 1.746490 0.574454 0.002771
C 1.463960 1.922615 0.077750
C -3.649528 -2.975312 0.318930
C -2.291294 -3.343836 0.468811
C 3.076049 -0.060284 -0.100030
C 4.257203 0.687386 0.164264
C 3.195980 -1.429111 -0.468086
C 5.524375 0.082069 0.055026
C 4.466540 -2.030692 -0.574933
C 5.636016 -1.279259 -0.315645
H -2.672160 1.788827 1.414422
H -3.107356 0.940293 -1.495500
H -5.042870 -1.323048 -0.058100
H -0.230114 -2.632914 0.521998
H 2.270045 2.658731 0.051431
H -1.954545 3.704025 -0.043222
H -4.845200 2.051781 -0.294760
H -4.434247 -3.735393 0.400950
H -2.023587 -4.387824 0.663041
H 4.190080 1.735790 0.472502
H 2.292472 -2.008036 -0.678382
H 6.424915 0.668640 0.265488
H 4.544847 -3.084139 -0.864261
H 6.622588 -1.747748 -0.398777


