%chk=000238962.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238962

0 1
O -1.831030 0.870741 -0.896493
O -2.827847 -1.124052 -0.493043
O -4.122908 1.498852 1.259712
O -4.944027 0.762776 -0.699249
C 0.880891 3.828754 0.198406
C 0.057859 -4.122023 -0.389176
C 1.861451 4.881681 0.538987
C 1.041844 -5.225313 -0.366796
C -0.953748 1.851677 -0.438842
C -1.788446 -2.056904 -0.424444
C -2.622973 0.162823 0.073219
C -0.202286 3.571323 1.051936
C 0.469610 -2.804569 -0.141488
C 1.030843 3.084971 -0.987813
C -1.296370 -4.392893 -0.665796
C -1.137170 2.580078 0.739515
C -0.451874 -1.752653 -0.161203
C 0.119626 2.084985 -1.314563
C -2.233963 -3.364986 -0.681419
C 2.093487 5.942542 -0.351122
C 1.215107 -6.037833 -1.498795
C 2.563825 4.824818 1.753426
C 1.806700 -5.464575 0.786120
C 3.019763 6.936559 -0.025801
C 2.146581 -7.078806 -1.474741
C 3.490545 5.821053 2.070956
C 2.734590 -6.508990 0.803805
C -4.034276 0.789932 0.076068
C 3.719734 6.877690 1.183726
C 2.906687 -7.316748 -0.324951
H -2.145796 0.125340 1.074855
H -0.324591 4.157165 1.964221
H 1.521212 -2.593318 0.058018
H 1.873379 3.288870 -1.650593
H -1.613016 -5.418532 -0.861640
H -1.994231 2.409847 1.390748
H -0.119360 -0.728523 -0.009112
H 0.213548 1.494994 -2.225324
H -3.286110 -3.548751 -0.892988
H 1.545285 5.993121 -1.290569
H 0.628443 -5.850213 -2.396708
H 2.390823 4.000563 2.442992
H 1.670348 -4.840393 1.667404
H 3.195952 7.759827 -0.716548
H 2.281071 -7.705770 -2.354883
H 4.036160 5.773379 3.012106
H 3.324581 -6.694354 1.700000
H 4.441391 7.652768 1.433982
H 3.630686 -8.128872 -0.308755
H -4.992201 1.971944 1.365855


%chk=000238962-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238962

0 1
O -2.319494 1.022654 -0.969361
O -3.150882 -1.145396 -0.502192
O -4.456686 1.667046 1.202799
O -5.454289 0.441403 -0.513330
C 0.839779 3.644223 0.180794
C 0.083639 -3.919344 -0.397732
C 1.960323 4.556180 0.548302
C 1.184696 -4.923729 -0.362862
C -1.292408 1.892176 -0.516092
C -2.018309 -2.001807 -0.450264
C -3.025381 0.178599 0.013410
C -0.202669 3.351721 1.100269
C 0.309132 -2.568403 -0.023067
C 0.772707 3.041832 -1.108269
C -1.230905 -4.278764 -0.810704
C -1.270754 2.491812 0.765001
C -0.722244 -1.605665 -0.049079
C -0.276561 2.173185 -1.458274
C -2.272937 -3.335437 -0.838995
C 2.572700 5.394504 -0.424631
C 1.241223 -5.986409 -1.307244
C 2.449900 4.612197 1.883087
C 2.211452 -4.846322 0.619147
C 3.635488 6.255113 -0.076762
C 2.284152 -6.936560 -1.270258
C 3.510161 5.474808 2.233350
C 3.256656 -5.793352 0.655390
C -4.453684 0.724113 0.161110
C 4.110276 6.300889 1.254683
C 3.298747 -6.845255 -0.289101
H -2.489490 0.203517 0.983573
H -0.208433 3.838478 2.081834
H 1.318179 -2.246785 0.256933
H 1.572525 3.225646 -1.833755
H -1.448679 -5.317331 -1.081903
H -2.095510 2.341772 1.468250
H -0.487798 -0.569031 0.209317
H -0.316978 1.691722 -2.439789
H -3.286750 -3.612137 -1.142695
H 2.193539 5.395809 -1.452965
H 0.481199 -6.050747 -2.094366
H 2.018103 3.952727 2.644762
H 2.173645 -4.057174 1.378856
H 4.086098 6.897516 -0.841692
H 2.311096 -7.741483 -2.013432
H 3.875642 5.494532 3.266278
H 4.031853 -5.717475 1.426282
H 4.934868 6.969586 1.525148
H 4.109058 -7.582089 -0.261238
H -5.356200 2.086936 1.274681


