%chk=000276855.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276855

0 1
O 0.940467 1.208317 1.618945
O -0.809020 -0.936026 1.758299
O 1.349613 1.150121 -3.102472
O -1.888458 -0.587415 -2.785264
O 0.596363 3.920134 -2.948383
O -4.020261 1.199072 -1.855356
C 0.307916 -0.372209 -0.896404
C 0.804036 1.051766 -0.786532
C -1.153717 -0.456559 -0.513591
C 1.067442 1.719652 0.368372
C -1.674696 -0.715187 0.708626
C 1.172937 -1.326161 -0.109531
C 1.560099 3.116183 0.418263
C -3.127036 -0.787494 0.988021
C 1.082763 1.719258 -2.075208
C -2.105917 -0.274834 -1.646414
C 1.552825 3.878658 -0.768365
C -4.021358 -0.262523 0.032120
C 1.033907 3.274589 -2.032463
C -3.475401 0.332722 -1.226931
C 1.852906 -2.326049 -0.678747
C 2.025305 3.685384 1.608365
C -3.630626 -1.354487 2.163675
C 2.004216 5.200252 -0.753871
C -5.398185 -0.287249 0.265434
C 2.486986 5.008022 1.613640
C -5.012619 -1.392110 2.387234
C 2.477654 5.762727 0.439035
C -5.894027 -0.858046 1.444632
C 2.700942 -3.263160 0.078573
C 3.622115 -2.797193 1.030621
C 2.593556 -4.643243 -0.166041
C 4.421844 -3.703239 1.732474
C 3.391543 -5.543062 0.543410
C 4.306674 -5.075881 1.493245
H 0.372186 -0.664537 -1.996542
H 1.207362 -1.148150 0.971720
H 1.811969 -2.511158 -1.757686
H 2.023784 3.094274 2.527565
H -2.951035 -1.777852 2.905362
H 1.980370 5.787967 -1.676147
H -6.079672 0.141461 -0.476065
H 2.853151 5.447487 2.542198
H -5.399634 -1.841545 3.303396
H 2.835565 6.792682 0.446618
H -6.969940 -0.883896 1.623897
H 0.635229 0.230492 1.613638
H -1.282587 -1.040664 2.628312
H 3.722027 -1.728638 1.211577
H 1.885111 -5.010281 -0.906810
H 5.138541 -3.337435 2.465900
H 3.303296 -6.611707 0.353819
H 4.929889 -5.779428 2.041140


%chk=000276855-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276855

0 1
O 0.472710 1.684631 1.664498
O -0.819704 -0.599701 1.938373
O 1.605112 0.879718 -2.973180
O -1.758337 0.148810 -2.681537
O 2.519722 3.515828 -3.159620
O -4.485070 -0.258876 -2.232719
C 0.284204 -0.214558 -0.730015
C 0.861940 1.212528 -0.709944
C -1.210308 -0.305320 -0.381458
C 0.929865 2.034349 0.411047
C -1.738745 -0.567699 0.866216
C 1.193099 -1.197076 0.002930
C 1.518229 3.392879 0.386412
C -3.167727 -0.763808 1.174165
C 1.495768 1.647043 -1.968828
C -2.153313 -0.140235 -1.517255
C 2.064084 3.913728 -0.823033
C -4.121246 -0.677464 0.114789
C 2.069017 3.087146 -2.062546
C -3.676026 -0.355187 -1.271739
C 1.630057 -2.350757 -0.577149
C 1.537916 4.193197 1.555212
C -3.636379 -1.036160 2.485879
C 2.613667 5.217587 -0.850720
C -5.496788 -0.877803 0.371827
C 2.089952 5.492361 1.518853
C -5.011313 -1.242661 2.733569
C 2.628430 6.009432 0.315814
C -5.947373 -1.166628 1.676375
C 2.533364 -3.358606 0.015278
C 3.118645 -3.223015 1.307915
C 2.842950 -4.526010 -0.738605
C 3.973749 -4.217479 1.822355
C 3.698184 -5.523642 -0.224296
C 4.267993 -5.375212 1.060861
H 0.327690 -0.478788 -1.806510
H 1.525434 -0.930552 1.013483
H 1.287130 -2.570487 -1.599537
H 1.118759 3.787594 2.478940
H -2.956912 -1.084971 3.347235
H 3.023709 5.583349 -1.797771
H -6.192316 -0.798024 -0.469956
H 2.100026 6.102609 2.428443
H -5.350800 -1.455798 3.752295
H 3.055014 7.017559 0.292093
H -7.012352 -1.324463 1.872072
H 0.080248 0.758045 1.750963
H -1.174732 -1.009562 2.762877
H 2.914329 -2.330540 1.910278
H 2.408795 -4.644084 -1.739234
H 4.418446 -4.091819 2.816319
H 3.922488 -6.411925 -0.825280
H 4.935115 -6.145682 1.462870


