%chk=000180828.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180828

0 1
O -2.017439 -1.160607 0.068484
O -4.630326 0.687405 -0.707297
O -8.077453 1.239689 -1.034682
O -7.075562 -0.687665 -1.585259
C 3.678089 -1.388051 0.179957
C 4.319679 -0.081563 -0.366568
C 3.888296 1.176838 0.395862
C 2.152674 -1.301538 0.145695
C 4.097160 -2.564091 -0.730859
C 4.218181 -1.651553 1.598427
C 4.529324 2.438112 -0.198461
C 4.094798 3.699099 0.561952
C 1.356001 -1.733552 1.221344
C 1.514312 -0.813425 -1.004661
C -0.033066 -1.670421 1.162805
C 0.121162 -0.737074 -1.096073
C -0.639144 -1.167190 -0.003683
C 4.728489 4.959359 -0.023264
C -2.759763 -0.656381 -1.081434
C -4.206785 -0.705690 -0.603207
C -5.908293 0.967213 -0.153106
C -7.014543 0.368765 -1.006619
H 5.421370 -0.180355 -0.329532
H 4.071933 0.032102 -1.439449
H 2.783919 1.268761 0.377006
H 4.161209 1.083677 1.464740
H 5.182533 -2.700878 -0.736632
H 3.776116 -2.411669 -1.765880
H 3.647984 -3.503501 -0.390012
H 3.887494 -2.620024 1.987335
H 3.895125 -0.875524 2.301265
H 5.313558 -1.659499 1.606601
H 5.632184 2.348829 -0.176663
H 4.257013 2.533674 -1.266902
H 4.366891 3.606038 1.631486
H 2.990998 3.790152 0.538440
H 1.819085 -2.131033 2.125239
H 2.112205 -0.478886 -1.854449
H -0.653957 -1.999468 1.991763
H -0.338994 -0.350369 -1.997869
H 4.446639 5.102507 -1.072537
H 5.822688 4.917864 0.019104
H 4.412261 5.853004 0.526133
H -2.442610 0.382630 -1.301084
H -2.565507 -1.317421 -1.941930
H -4.863222 -1.317748 -1.250201
H -4.274756 -1.044811 0.447981
H -5.941563 2.080278 -0.165290
H -5.995087 0.605150 0.890374
H -8.844204 0.902743 -1.572389


%chk=000180828-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180828

0 1
O -2.137844 -1.079694 -0.106621
O -4.570775 0.615390 -0.615185
O -8.208200 0.960997 -0.108886
O -7.079462 0.326460 -2.043652
C 3.659794 -1.391599 0.262639
C 4.317908 -0.076366 -0.282406
C 3.967135 1.221335 0.479179
C 2.117983 -1.300101 0.166250
C 4.151729 -2.581156 -0.618579
C 4.144681 -1.648502 1.713388
C 4.563675 2.480740 -0.190191
C 4.243600 3.785992 0.573532
C 1.261010 -1.452325 1.289649
C 1.496040 -1.064400 -1.087336
C -0.140753 -1.373587 1.170811
C 0.094046 -0.980541 -1.231396
C -0.732931 -1.136889 -0.091115
C 4.838213 5.041462 -0.100584
C -2.791027 -0.817540 -1.397004
C -4.286417 -0.730779 -1.149365
C -5.829308 0.729888 0.078912
C -7.053312 0.641669 -0.837124
H 5.419343 -0.217978 -0.275888
H 4.030944 0.051356 -1.346656
H 2.865499 1.326730 0.541265
H 4.338383 1.161562 1.522101
H 5.254014 -2.667781 -0.569497
H 3.869605 -2.445994 -1.678484
H 3.712619 -3.534425 -0.271400
H 3.784285 -2.622983 2.092279
H 3.810227 -0.863526 2.414444
H 5.250121 -1.668965 1.736902
H 5.665477 2.368526 -0.276078
H 4.178526 2.562118 -1.228569
H 4.628531 3.704098 1.610780
H 3.143229 3.895448 0.659135
H 1.685311 -1.634811 2.281445
H 2.114328 -0.938603 -1.984158
H -0.791828 -1.489352 2.043086
H -0.332922 -0.795978 -2.221916
H 4.446210 5.162184 -1.128311
H 5.940376 4.969760 -0.169514
H 4.594011 5.960250 0.464011
H -2.431096 0.137611 -1.828808
H -2.568519 -1.643791 -2.104146
H -4.845152 -0.874591 -2.094054
H -4.590723 -1.510526 -0.419457
H -5.828421 1.718084 0.569377
H -5.944237 -0.041074 0.873193
H -9.006830 0.896099 -0.699999


