%chk=000205953.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205953

0 1
O 2.632669 2.366519 1.223394
O -5.409882 0.403571 0.636287
C 3.172048 0.387310 -0.060926
C 2.251011 -0.762050 0.408849
C 4.126776 -0.159481 -1.131120
C 4.669098 0.254232 0.224340
C 0.849590 -0.619251 -0.259972
C 2.602319 1.792155 -0.095941
C 0.252490 0.797212 -0.032821
C 2.941942 -2.057763 -0.133597
C 3.842338 -1.643341 -1.318444
C 1.173899 1.859424 -0.650040
C -1.137939 0.836721 -0.684008
C -2.095369 -0.208806 -0.027520
C -0.108621 -1.741492 0.200214
C 2.169060 -0.769782 1.939549
C -1.535525 -1.605284 -0.355138
C -1.946756 2.143278 -0.650805
C -3.446974 0.147431 -0.729963
C -3.409331 1.692799 -0.872011
C -2.244078 -0.032779 1.490565
C -4.664920 -0.339400 0.037068
C -4.914088 -1.823652 -0.013192
H 4.395465 0.399630 -2.022601
H 5.025454 -0.497180 0.923002
H 5.262280 1.162082 0.312574
H 1.004107 -0.739059 -1.362869
H 3.270181 2.490151 -0.656554
H 0.157443 0.992259 1.061591
H 2.203260 -2.816501 -0.437389
H 3.548347 -2.528648 0.658268
H 4.774358 -2.232650 -1.341488
H 3.332431 -1.817981 -2.281829
H 1.201947 1.754324 -1.750777
H 0.764608 2.869971 -0.447540
H -1.008242 0.558751 -1.762149
H -0.149304 -1.767437 1.307984
H 0.310574 -2.720538 -0.107182
H 1.810673 0.198829 2.319137
H 1.489299 -1.545053 2.309894
H 3.151814 -0.945403 2.392739
H -1.533576 -1.773655 -1.447870
H -2.186346 -2.394254 0.070531
H -1.617046 2.851497 -1.425846
H -1.833823 2.663768 0.315236
H -3.466672 -0.312647 -1.744365
H -4.083772 2.165342 -0.131100
H -3.777869 1.998496 -1.863160
H 2.230921 1.746620 1.875688
H -2.761632 0.903472 1.738160
H -2.817240 -0.848547 1.941644
H -1.269534 -0.000687 1.991483
H -5.346726 -2.118732 -0.977494
H -3.991741 -2.405999 0.128385
H -5.630095 -2.129492 0.763325


%chk=000205953-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205953

0 1
O 2.759177 2.491826 1.191654
O -5.407134 0.207657 0.706381
C 3.211665 0.391399 -0.091491
C 2.345554 -0.766569 0.490521
C 4.017580 -0.164504 -1.287982
C 4.736556 0.239614 0.006787
C 0.882093 -0.646760 -0.084736
C 2.649262 1.805571 -0.123618
C 0.290220 0.794948 0.057170
C 3.053115 -2.049688 -0.079837
C 3.674781 -1.647153 -1.448665
C 1.198756 1.830628 -0.644529
C -1.131783 0.813303 -0.544432
C -2.112690 -0.210690 0.117025
C -0.085852 -1.718726 0.491609
C 2.359372 -0.792760 2.042833
C -1.524158 -1.627426 -0.087844
C -1.930807 2.138107 -0.568413
C -3.420993 0.123079 -0.717714
C -3.407206 1.683898 -0.828051
C -2.360807 0.071049 1.623271
C -4.709949 -0.443426 -0.120571
C -5.124531 -1.840722 -0.569287
H 4.178444 0.444094 -2.184373
H 5.169973 -0.543605 0.637148
H 5.313092 1.169866 -0.000865
H 0.961724 -0.828905 -1.181539
H 3.284148 2.440595 -0.768944
H 0.220758 1.063979 1.133581
H 2.357180 -2.901873 -0.170607
H 3.850557 -2.369648 0.617350
H 4.556168 -2.267622 -1.697992
H 2.940518 -1.772686 -2.267878
H 1.209451 1.618841 -1.734848
H 0.798038 2.851704 -0.509028
H -1.021578 0.483023 -1.605000
H -0.137698 -1.623006 1.592475
H 0.312507 -2.731589 0.289826
H 1.700281 -0.021569 2.489115
H 2.018152 -1.767705 2.436168
H 3.384428 -0.620773 2.417958
H -1.497212 -1.857732 -1.174218
H -2.156386 -2.399320 0.395252
H -1.569803 2.831876 -1.347730
H -1.841088 2.664663 0.400546
H -3.278695 -0.334678 -1.718863
H -4.103862 2.109223 -0.085061
H -3.760322 2.000237 -1.825925
H 2.365961 1.908167 1.888469
H -2.900407 1.019845 1.780413
H -2.981614 -0.727597 2.069578
H -1.418185 0.116028 2.194413
H -5.494114 -1.794850 -1.612992
H -4.263905 -2.533982 -0.566460
H -5.929432 -2.229353 0.074145


