%chk=000276318.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276318

0 1
O 0.201228 -0.232822 -1.195799
O -2.419262 -0.071863 1.893244
O -2.510215 -1.572501 -1.067978
O -1.395867 2.420526 0.141055
O 1.443669 0.749206 0.505120
O -0.056752 -3.721245 -0.760735
O 0.207030 -2.519629 -2.666040
O -4.315219 1.108573 1.528240
O -3.725243 -3.029663 0.172508
O -1.583975 3.173534 2.271259
C -1.985465 0.127365 0.515841
C -1.622985 -1.295474 0.050442
C -0.843300 1.153636 0.593588
C -0.181385 -1.418983 -0.469548
C 0.326268 0.923455 -0.386373
C 0.006022 -2.545783 -1.484037
C 2.735798 0.780310 -0.020630
C -3.619870 0.497995 2.302256
C -3.554974 -2.473408 -0.882264
C -1.771220 3.362634 1.096366
C 3.709741 1.162295 0.914973
C 3.055676 0.418000 -1.331643
C -3.805993 0.208222 3.744940
C -4.310511 -2.559839 -2.157151
C -2.384183 4.513244 0.387775
C 0.123059 -4.958622 -1.500031
C 5.396935 0.832477 -0.806624
C 5.042757 1.178818 0.509346
C 4.398443 0.451332 -1.715665
C 6.840759 0.855771 -1.231374
C 7.512434 -0.493489 -0.976200
H -2.831590 0.538028 -0.100543
H -1.816126 -2.041118 0.870843
H -0.472231 1.253848 1.651806
H 0.530520 -1.553839 0.389598
H 0.487548 1.738027 -1.125531
H 3.415880 1.431306 1.926852
H 2.283203 0.097648 -2.033105
H -3.179257 -0.630430 4.092464
H -3.530066 1.088870 4.352437
H -4.857225 -0.033144 3.968588
H -4.478355 -3.609268 -2.446554
H -3.788947 -2.055979 -2.990733
H -5.300825 -2.084604 -2.057013
H -2.196198 4.493721 -0.698747
H -2.010417 5.469727 0.785989
H -3.480973 4.505634 0.524036
H -0.220446 -5.715161 -0.785405
H -0.482960 -4.950518 -2.411670
H 1.185219 -5.072040 -1.737759
H 5.816371 1.465293 1.221200
H 4.668161 0.169785 -2.733523
H 7.388665 1.656689 -0.693608
H 6.922948 1.119367 -2.306009
H 7.013059 -1.299315 -1.527705
H 8.563080 -0.479589 -1.285251
H 7.480463 -0.761910 0.086583


%chk=000276318-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276318

0 1
O 0.303637 -0.496277 -1.067020
O -2.943997 0.309514 1.387681
O -2.518827 -1.879366 -0.997634
O -1.006205 2.335974 0.759581
O 1.676084 0.602599 0.600781
O -0.386357 -3.982366 -0.274033
O 0.469147 -3.018130 -2.222758
O -4.653092 0.543704 -0.193124
O -4.111101 -2.658321 0.528211
O -0.739912 2.434312 3.087610
C -1.942580 0.123666 0.311977
C -1.669819 -1.390239 0.120129
C -0.687819 0.892794 0.756579
C -0.191018 -1.624806 -0.266941
C 0.484582 0.689399 -0.231040
C 0.011603 -2.909472 -1.073579
C 2.942821 0.786939 -0.027375
C -4.290554 0.474584 1.000432
C -3.752521 -2.469756 -0.653950
C -1.005600 3.000888 2.010989
C 4.001213 1.128545 0.843039
C 3.165578 0.635818 -1.414976
C -5.174940 0.506476 2.220485
C -4.544326 -2.773983 -1.899709
C -1.355285 4.456048 1.804840
C -0.272616 -5.324965 -0.895376
C 5.549889 1.200650 -1.075710
C 5.292471 1.328936 0.315454
C 4.467384 0.854075 -1.921383
C 6.957575 1.377544 -1.627946
C 7.801564 0.078064 -1.526747
H -2.338683 0.535437 -0.634593
H -1.933149 -1.946788 1.037854
H -0.382619 0.595053 1.777325
H 0.407966 -1.707923 0.663497
H 0.565711 1.522501 -0.950836
H 3.794355 1.242470 1.911657
H 2.359764 0.316987 -2.082142
H -5.410644 -0.537103 2.500685
H -4.662000 0.978768 3.072469
H -6.115422 1.028705 1.990224
H -5.251670 -3.594160 -1.705789
H -3.882361 -3.016797 -2.745032
H -5.121038 -1.868966 -2.167387
H -0.572166 4.947920 1.201477
H -1.438283 4.958880 2.778697
H -2.303124 4.546730 1.247979
H -0.634658 -6.020809 -0.126438
H -0.894603 -5.375101 -1.804719
H 0.777921 -5.531624 -1.159550
H 6.111384 1.600144 0.993071
H 4.641949 0.738408 -2.998121
H 7.478105 2.186623 -1.079682
H 6.908275 1.692431 -2.687781
H 7.328274 -0.743103 -2.094905
H 8.819619 0.235230 -1.928537
H 7.893018 -0.251663 -0.475808


