%chk=000277981.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277981

0 1
O 4.814999 -0.468162 -0.855280
O 4.992156 0.485569 2.229392
O 3.697754 2.606845 -0.278163
O 7.463773 2.047495 -0.946276
O -7.064206 2.457029 -1.852391
O -6.141435 3.409493 -0.143543
N 2.677124 -0.995113 -0.128224
N 0.977315 -1.656677 -1.529100
N 1.369238 -0.873092 2.013476
N -1.856941 -2.189989 -0.410201
N -0.987300 -1.466883 1.698794
N -6.301959 2.465104 -0.899130
C 4.070933 0.662402 1.158912
C 4.046605 -0.661472 0.338565
C 4.688272 1.715136 0.201997
C 5.325275 0.898228 -0.942367
C 6.851603 0.768257 -0.796293
C 1.531778 -1.107787 0.667502
C 2.275821 -1.350822 -1.462165
C 0.479482 -1.519210 -0.221475
C -0.816865 -1.715288 0.351215
C 0.096409 -1.075379 2.443938
C -3.233470 -2.320908 0.113296
C -4.039054 -1.068969 -0.157056
C -4.929283 -1.023840 -1.240905
C -3.889268 0.046187 0.682104
C -5.672598 0.130374 -1.487569
C -4.625654 1.205402 0.444121
C -5.515214 1.238656 -0.641542
H 3.076210 0.978331 1.543104
H 4.500134 -1.532373 0.871133
H 5.416760 2.389014 0.719313
H 5.019265 1.258302 -1.945283
H 7.262654 0.044847 -1.521919
H 7.141883 0.461901 0.230910
H 4.506090 0.239959 3.052976
H 2.976641 2.134187 -0.750496
H 2.994009 -1.353278 -2.274590
H 7.401627 2.359152 -1.873329
H -1.731867 -2.244669 -1.422840
H -0.101210 -0.902354 3.516658
H -3.206743 -2.531933 1.215516
H -3.699414 -3.218072 -0.358711
H -5.046628 -1.887853 -1.895128
H -3.188768 0.003188 1.523188
H -6.372927 0.182086 -2.328778
H -4.519907 2.084577 1.089846


%chk=000277981-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000277981

0 1
O 4.913571 -0.420354 -1.095322
O 4.148264 0.281868 2.434371
O 5.917802 2.464969 0.938779
O 7.646402 2.153168 -1.467952
O -8.448464 1.405604 -1.590742
O -6.881857 3.061941 -1.675131
N 2.704105 -0.931256 -0.286764
N 0.869261 -1.540160 -1.522147
N 1.607913 -0.636973 1.937529
N -1.898753 -1.743666 -0.168686
N -0.796649 -1.096431 1.837113
N -7.243493 1.845014 -1.437717
C 4.239971 0.570826 1.027211
C 4.109134 -0.679330 0.103915
C 5.638283 1.065117 0.634372
C 5.637177 0.882933 -0.896711
C 7.034547 0.821637 -1.520924
C 1.623247 -0.933785 0.597044
C 2.197548 -1.309238 -1.541908
C 0.501401 -1.311896 -0.184544
C -0.752714 -1.389214 0.491733
C 0.355051 -0.745456 2.475663
C -3.207080 -1.880698 0.483336
C -4.254218 -0.909550 -0.051635
C -5.592520 -1.337923 -0.242396
C -3.913257 0.440146 -0.329731
C -6.581816 -0.442567 -0.693839
C -4.885944 1.349996 -0.783053
C -6.211160 0.893148 -0.958584
H 3.489991 1.327690 0.706109
H 4.503224 -1.577575 0.618986
H 6.393518 0.401560 1.108078
H 5.057765 1.703489 -1.364565
H 6.977631 0.553540 -2.588244
H 7.651243 0.062841 -0.993928
H 3.189349 -0.039378 2.581902
H 5.843095 2.600464 1.917443
H 2.843191 -1.377154 -2.412534
H 7.444229 2.567050 -0.584486
H -1.809432 -1.939561 -1.168913
H 0.263999 -0.522544 3.542202
H -3.030076 -1.694474 1.559665
H -3.572408 -2.920575 0.380883
H -5.863582 -2.380099 -0.037110
H -2.880418 0.774339 -0.187908
H -7.618204 -0.754010 -0.847868
H -4.645768 2.394124 -0.999791


