%chk=000186579.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186579

0 1
O 0.950948 3.432588 -0.060843
O 3.596006 2.322477 -0.094656
C 1.213259 2.095020 0.378750
C 2.426592 1.555179 -0.423214
C 0.018516 1.184406 0.235307
C 0.240713 -0.232776 0.125387
C 2.709869 0.119032 -0.060480
C 1.624076 -0.748287 0.193071
C -1.255355 1.692494 0.226234
C -0.843599 -1.068336 -0.038652
C -2.181046 -0.565067 -0.074869
C -2.387384 0.831544 0.069941
C 4.025262 -0.346980 0.008760
C 1.893990 -2.084963 0.525150
C -3.326768 -1.423435 -0.246692
C -3.715090 1.362086 0.052811
C 4.277067 -1.683251 0.334234
C 3.211133 -2.548887 0.591957
C -4.592687 -0.877745 -0.261215
C -4.788125 0.522989 -0.108731
C -3.143422 -2.898237 -0.407866
H 1.481048 2.246243 1.455462
H 2.261974 1.658381 -1.522370
H -1.423213 2.765689 0.343545
H -0.690639 -2.143402 -0.145477
H 4.848589 0.347457 -0.179995
H 1.074178 -2.768467 0.742918
H 0.555915 3.438396 -0.959629
H -3.853542 2.434982 0.171515
H 3.355754 3.279012 -0.042073
H 5.302457 -2.044506 0.390488
H 3.404894 -3.588856 0.850453
H -5.469418 -1.510470 -0.389134
H -5.805700 0.912260 -0.123132
H -2.656885 -3.339937 0.473884
H -2.522976 -3.131900 -1.285335
H -4.095590 -3.429131 -0.543103


%chk=000186579-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186579

0 1
O 0.992600 3.498506 0.028778
O 3.612387 2.395231 -0.224879
C 1.247678 2.091484 0.407435
C 2.432505 1.555716 -0.423137
C 0.034654 1.186438 0.244860
C 0.252043 -0.239984 0.122065
C 2.739183 0.118883 -0.043114
C 1.644091 -0.765202 0.197562
C -1.259075 1.703758 0.225114
C -0.863187 -1.073875 -0.047484
C -2.202332 -0.570061 -0.083663
C -2.404611 0.857900 0.064058
C 4.069342 -0.339939 0.047794
C 1.930669 -2.117374 0.525215
C -3.348758 -1.435855 -0.257829
C -3.732732 1.392681 0.044183
C 4.335242 -1.690528 0.365588
C 3.260415 -2.579933 0.601164
C -4.628730 -0.864955 -0.271801
C -4.827150 0.542874 -0.120091
C -3.176772 -2.935519 -0.420053
H 1.563152 2.167504 1.464765
H 2.123753 1.594663 -1.497744
H -1.408051 2.782094 0.355943
H -0.708072 -2.149329 -0.176260
H 4.879245 0.374516 -0.123350
H 1.111862 -2.807899 0.754026
H 0.550930 3.504222 -0.861425
H -3.875429 2.473315 0.160806
H 3.289180 3.335764 -0.228174
H 5.369589 -2.044134 0.437636
H 3.458786 -3.625994 0.859667
H -5.502249 -1.514848 -0.401861
H -5.845111 0.947257 -0.134733
H -2.681694 -3.387968 0.460554
H -2.558302 -3.183558 -1.303764
H -4.154252 -3.430249 -0.545450


