%chk=000228418.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228418

0 1
O -1.985269 0.735807 -1.371424
O -2.027648 2.038670 2.664191
O -1.096236 2.880800 0.735730
O 3.137306 1.284164 -1.254348
O 2.414985 -2.795952 1.335923
O 4.106130 -1.174316 -0.361971
C -2.312288 0.031402 -0.118563
C -3.746326 0.476356 0.257266
C -2.268596 -1.503232 -0.364230
C -1.285528 0.420946 1.040538
C -4.784404 0.029981 -0.798455
C -3.305949 -1.936573 -1.425513
C -4.734645 -1.498058 -1.030282
C 0.162065 0.057763 0.700232
C -1.428243 1.890683 1.405710
C 0.701410 -1.150369 1.183297
C 0.961086 0.898907 -0.121737
C 2.272446 0.503899 -0.470441
C 2.012914 -1.553783 0.831576
C 2.804981 -0.746471 -0.031496
C 2.645831 2.591270 -1.706144
C 3.816285 -2.991536 1.766822
C 4.385356 -1.345237 -1.805239
H -3.769522 1.577134 0.359403
H -4.002971 0.042200 1.244421
H -2.477791 -2.027793 0.591613
H -1.252281 -1.800003 -0.681714
H -1.604414 -0.151750 1.927669
H -4.566663 0.551066 -1.749739
H -5.796136 0.341869 -0.474216
H -3.257397 -3.034499 -1.559942
H -3.038331 -1.471354 -2.393540
H -5.040661 -2.025872 -0.102236
H -5.455995 -1.788073 -1.818439
H -0.997131 0.816203 -1.443467
H 0.125290 -1.810772 1.838150
H 0.581460 1.887500 -0.398785
H -2.120846 3.010414 2.866634
H 3.470872 3.017209 -2.295558
H 2.417857 3.250050 -0.847377
H 1.745110 2.486304 -2.341030
H 4.259743 -2.047675 2.127002
H 4.426478 -3.380441 0.936122
H 3.759077 -3.727943 2.585295
H 4.300568 -0.380567 -2.332272
H 3.692486 -2.087252 -2.246581
H 5.419535 -1.719275 -1.853954


%chk=000228418-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228418

0 1
O -1.840639 0.612076 -1.380986
O -2.076107 1.843526 2.740747
O -1.011241 2.814028 0.928756
O 3.093152 1.281854 -1.334860
O 2.525681 -2.843340 1.211808
O 4.135465 -1.165299 -0.456560
C -2.281432 -0.003661 -0.118838
C -3.676063 0.600971 0.161958
C -2.371559 -1.548134 -0.279413
C -1.250116 0.330282 1.062043
C -4.722174 0.170491 -0.893035
C -3.410632 -1.956173 -1.348480
C -4.802547 -1.367857 -1.024453
C 0.190160 -0.014292 0.682832
C -1.395485 1.775379 1.511802
C 0.764993 -1.215053 1.149701
C 0.949767 0.838127 -0.162641
C 2.264256 0.476549 -0.536967
C 2.072096 -1.592040 0.760127
C 2.832100 -0.762965 -0.111228
C 2.577542 2.600121 -1.726385
C 3.829119 -2.879678 1.913084
C 4.426716 -1.288812 -1.902498
H -3.590919 1.703735 0.168026
H -4.001969 0.285734 1.172833
H -2.659585 -1.990996 0.696498
H -1.374087 -1.954800 -0.534284
H -1.556693 -0.295787 1.917280
H -4.437636 0.605496 -1.869603
H -5.710379 0.588618 -0.620021
H -3.457914 -3.060368 -1.413032
H -3.079110 -1.582289 -2.336633
H -5.175220 -1.803574 -0.073179
H -5.529289 -1.645876 -1.811826
H -0.905973 0.321997 -1.559303
H 0.218688 -1.887881 1.817909
H 0.526957 1.805274 -0.446603
H -2.177608 2.800345 3.000415
H 3.392492 3.064800 -2.300450
H 2.342646 3.215225 -0.837803
H 1.675137 2.507939 -2.360474
H 3.769488 -2.293782 2.850709
H 4.632276 -2.487332 1.268990
H 3.996266 -3.942350 2.146167
H 4.353227 -0.306425 -2.396990
H 3.732521 -2.010844 -2.372835
H 5.457635 -1.671157 -1.953402


