%chk=000245508.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245508

0 1
O 1.909796 -0.948764 -1.534359
O -4.130509 0.027324 -0.098761
C 2.424189 0.259637 0.467091
C 3.311515 1.306589 -0.233429
C 3.273889 -0.865755 1.088138
C 1.475086 -0.353157 -0.567192
C 2.519621 2.539050 -0.659785
C 2.444614 -1.790590 1.974046
C 0.006406 -0.206291 -0.366900
C -0.550996 0.467726 0.725991
C -0.849541 -0.779949 -1.334401
C -1.934241 0.582687 0.876266
C -2.226789 -0.682746 -1.213171
C -2.759320 0.003823 -0.098916
C -4.803994 0.702316 0.992813
H 1.849701 0.765388 1.282058
H 3.796939 0.843864 -1.119251
H 4.134986 1.605813 0.443615
H 3.757261 -1.451854 0.277417
H 4.099790 -0.422914 1.677893
H 3.166995 3.266408 -1.164034
H 2.059572 3.046996 0.194452
H 1.716931 2.282111 -1.362646
H 1.638124 -2.276437 1.410244
H 3.065608 -2.588713 2.398048
H 1.984841 -1.253919 2.810687
H 0.108142 0.914221 1.478792
H -0.401808 -1.305534 -2.186251
H -2.346108 1.108615 1.729678
H -2.900959 -1.117839 -1.947679
H -4.543596 1.764468 1.000671
H -4.569629 0.214482 1.943140
H -5.859715 0.557944 0.726234


%chk=000245508-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245508

0 1
O 1.927185 -0.930991 -1.528314
O -4.247089 0.004708 -0.112302
C 2.463040 0.280129 0.493698
C 3.371357 1.320612 -0.226044
C 3.322562 -0.867890 1.102381
C 1.463322 -0.312324 -0.516782
C 2.616142 2.569173 -0.730384
C 2.516040 -1.872645 1.952953
C -0.016967 -0.183204 -0.335390
C -0.627138 0.497662 0.750450
C -0.867092 -0.780703 -1.315929
C -2.030122 0.587087 0.867647
C -2.259831 -0.702435 -1.215208
C -2.850612 -0.016034 -0.119223
C -4.917700 0.697906 0.993477
H 1.933242 0.792318 1.319039
H 3.865817 0.810872 -1.074952
H 4.167666 1.628909 0.480454
H 3.823332 -1.396505 0.268658
H 4.117356 -0.408901 1.723744
H 3.311333 3.283996 -1.207263
H 2.108649 3.095824 0.100633
H 1.848260 2.300198 -1.478565
H 1.751974 -2.391981 1.346085
H 3.179619 -2.643518 2.385622
H 1.996774 -1.366732 2.789419
H -0.012924 0.971083 1.522291
H -0.391060 -1.303542 -2.151706
H -2.467095 1.119656 1.717350
H -2.917138 -1.157883 -1.962001
H -4.648323 1.771274 1.014979
H -4.671432 0.230961 1.966335
H -5.992346 0.587920 0.789346


