%chk=000275202.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275202

0 1
O -2.865774 -1.661199 -0.124718
O -4.133869 2.723725 0.955180
O -6.507787 2.265817 -0.642187
N -2.072320 1.124231 -0.130721
C 5.446833 0.513252 -0.016771
C 4.111373 -0.242630 -0.037612
C 6.638472 -0.453830 -0.017270
C 2.920298 0.725095 -0.036907
C 7.973917 0.302106 0.003502
C 1.585284 -0.031455 -0.057993
C 9.165926 -0.664552 0.003141
C 0.395989 0.937740 -0.057677
C 10.501011 0.091572 0.023870
C -0.929984 0.166315 -0.077964
C 11.694523 -0.874094 0.023631
C -3.368590 0.642432 0.072782
C 13.026087 -0.126672 0.044315
C -3.808329 -0.649391 -0.016211
C -5.224592 -1.025916 0.060889
C -4.393962 1.713640 0.356453
C -6.216684 -0.023158 -0.022463
C -5.823008 1.398434 -0.166259
C -5.617353 -2.364896 0.209881
C -7.574343 -0.367277 0.010957
C -6.973791 -2.697437 0.257947
C -7.953512 -1.704194 0.153474
H 5.494982 1.168662 0.874245
H 5.510866 1.189174 -0.891329
H 4.048565 -0.918620 0.836987
H 4.064388 -0.897762 -0.928913
H 6.591282 -1.109148 -0.908317
H 6.575400 -1.129636 0.857345
H 2.984727 1.401163 -0.911596
H 2.969157 1.380497 0.854223
H 8.021783 0.957609 0.894402
H 8.037725 0.977938 -0.871063
H 1.538818 -0.685929 -0.950472
H 1.522766 -0.707944 0.816876
H 9.118571 -1.319924 -0.887826
H 9.102645 -1.340216 0.877815
H 0.456713 1.610247 -0.937627
H 0.448840 1.596269 0.831466
H 10.566061 0.767653 -0.850181
H 10.550096 0.747481 0.914182
H -0.995265 -0.486126 -0.980305
H -1.009303 -0.515029 0.800843
H 11.631934 -1.549805 0.898991
H 11.647992 -1.529521 -0.867999
H -1.886187 2.023431 0.329764
H 13.871520 -0.823610 0.043859
H 13.137124 0.524384 -0.830237
H 13.121189 0.503897 0.935596
H -4.862479 -3.144749 0.310092
H -8.329083 0.419891 -0.074930
H -7.269918 -3.740659 0.379246
H -9.009004 -1.971104 0.185062
H -3.187922 -2.365371 -0.742067


%chk=000275202-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275202

0 1
O -3.210151 -1.921127 -0.245097
O -3.766001 2.831032 0.047873
O -6.554986 2.544603 0.131127
N -2.086984 0.754473 -0.127687
C 5.526331 0.431794 0.011940
C 4.203507 -0.365795 -0.034849
C 6.784076 -0.465913 0.000176
C 2.947649 0.534339 -0.019093
C 8.106509 0.333048 0.034790
C 1.625111 -0.262051 -0.086760
C 9.365063 -0.563800 0.023813
C 0.374439 0.643753 -0.059502
C 10.687629 0.235247 0.052664
C -0.935108 -0.163208 -0.161286
C 11.946142 -0.662485 0.041042
C -3.431444 0.463463 -0.054819
C 13.262724 0.143888 0.069237
C -4.044543 -0.792836 -0.094510
C -5.489467 -0.990098 0.053603
C -4.289882 1.672367 0.042295
C -6.378679 0.133134 0.113069
C -5.826783 1.513631 0.094485
C -6.058713 -2.292000 0.136526
C -7.773920 -0.055064 0.210497
C -7.458400 -2.469151 0.228268
C -8.326514 -1.354445 0.258466
H 5.538938 1.068052 0.921659
H 5.564905 1.126931 -0.852892
H 4.165821 -1.063831 0.827657
H 4.190109 -0.998433 -0.947176
H 6.767969 -1.107449 -0.905919
H 6.750290 -1.156008 0.869294
H 2.993344 1.240967 -0.873983
H 2.954923 1.157285 0.899583
H 8.122729 0.975943 0.939838
H 8.140480 1.022086 -0.835146
H 1.615852 -0.876500 -1.010998
H 1.582780 -0.974703 0.762858
H 9.347154 -1.209067 -0.879656
H 9.333320 -1.250550 0.895736
H 0.426596 1.366629 -0.899991
H 0.368831 1.238626 0.876712
H 10.720979 0.921930 -0.819232
H 10.707658 0.880575 0.955985
H -0.937395 -0.756596 -1.096059
H -1.002346 -0.885552 0.673917
H 11.911992 -1.348005 0.912512
H 11.924642 -1.307051 -0.861565
H -1.896226 1.763853 -0.113053
H 14.146653 -0.520289 0.059926
H 13.334705 0.815030 -0.807573
H 13.322059 0.773195 0.977456
H -5.425732 -3.187712 0.167833
H -8.408409 0.836561 0.251425
H -7.868083 -3.483397 0.288246
H -9.409082 -1.496075 0.329650
H -3.723261 -2.692447 -0.593909


