%chk=000192377.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192377

0 1
O 0.874166 0.831110 0.966778
O 4.782251 0.952173 -0.950589
O 4.045891 1.912891 0.966177
O -1.017830 -3.794494 1.184391
O -3.033601 -1.297365 -0.448969
O -1.440506 -2.576523 -1.374572
N 0.860776 0.461493 -1.274828
C 2.967487 -0.120402 0.054353
C 3.077691 -0.957938 1.343921
C 1.588999 0.386654 -0.172295
C 2.378632 -2.284954 1.199554
C -0.394298 1.186653 0.478965
C -0.408203 0.965040 -0.890975
C 3.946706 1.052390 0.128656
C 0.976654 -2.340120 1.266607
C 3.120762 -3.455611 1.005038
C -1.327426 1.663858 1.485116
C -1.478830 1.153396 -1.867462
C 0.354679 -3.579830 1.115776
C 2.467123 -4.690152 0.875126
C 1.079053 -4.771827 0.926160
C -2.676707 1.274334 1.431371
C -0.877167 2.506818 2.515977
C -2.383529 2.219863 -1.732103
C -1.609619 0.256059 -2.942539
C 5.790200 1.999020 -1.149814
C -3.569386 1.740124 2.398292
C -1.778542 2.965674 3.478979
C -3.415963 2.377159 -2.659801
C -2.645904 0.421025 -3.863329
C -3.123538 2.585820 3.420215
C -3.550832 1.478808 -3.723301
C 5.130840 3.239260 -1.711672
C -1.892190 -2.664537 1.068793
C -2.025111 -2.239868 -0.381367
H 3.246564 -0.767652 -0.835628
H 4.148136 -1.104882 1.601498
H 2.649813 -0.386438 2.200342
H 0.402868 -1.430866 1.431188
H 4.205639 -3.416864 0.949045
H 3.055200 -5.596566 0.725065
H 0.550890 -5.715506 0.813906
H -3.023439 0.604671 0.638090
H 0.174549 2.796172 2.557908
H -2.275469 2.926916 -0.909346
H -0.894204 -0.566452 -3.051934
H 6.464063 1.496551 -1.868255
H 6.300169 2.181344 -0.187796
H -4.616384 1.441788 2.356202
H -1.431275 3.621079 4.277034
H -4.114640 3.206182 -2.555767
H -2.742349 -0.272894 -4.698031
H -3.824259 2.947347 4.171691
H -4.355095 1.606623 -4.445802
H 4.487979 2.999475 -2.570485
H 4.493554 3.731046 -0.961479
H 5.872838 3.973845 -2.046193
H -1.570095 -1.818245 1.708508
H -2.853587 -3.072711 1.453706
H -3.162795 -0.936467 -1.374895


%chk=000192377-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192377

0 1
O 0.715787 1.051427 0.898219
O 5.000403 0.881460 -0.415814
O 3.380800 2.491830 0.070920
O -0.834359 -4.086828 1.060946
O -2.978825 -1.515714 -0.470577
O -1.331861 -2.836250 -1.462161
N 0.523287 0.513187 -1.307009
C 2.756687 0.085704 -0.154489
C 3.029437 -0.805654 1.115258
C 1.332318 0.527933 -0.261869
C 2.447991 -2.210579 1.013657
C -0.610048 1.379799 0.497860
C -0.713506 1.062731 -0.861039
C 3.698056 1.303316 -0.150066
C 1.046089 -2.431863 1.079959
C 3.315650 -3.318553 0.858459
C -1.490099 1.877667 1.559911
C -1.827619 1.223089 -1.812485
C 0.536040 -3.745681 0.981488
C 2.792300 -4.630773 0.774561
C 1.404537 -4.852558 0.835784
C -2.865627 1.514670 1.602180
C -0.958020 2.701889 2.590860
C -2.799520 2.251716 -1.679083
C -1.924142 0.324355 -2.914332
C 6.054107 1.947009 -0.459981
C -3.692565 1.991189 2.640532
C -1.790255 3.170284 3.628397
C -3.850614 2.367835 -2.613217
C -2.981526 0.442760 -3.844050
C -3.161651 2.823078 3.654933
C -3.952020 1.462066 -3.696103
C 6.127877 2.572016 -1.854998
C -1.829640 -3.038117 0.969226
C -1.974335 -2.489312 -0.454867
H 2.987968 -0.508550 -1.055648
H 4.123982 -0.875697 1.233189
H 2.627251 -0.273744 1.997204
H 0.377687 -1.575292 1.214027
H 4.398018 -3.154498 0.805404
H 3.469714 -5.483664 0.657523
H 0.974615 -5.855792 0.764276
H -3.273840 0.840400 0.842121
H 0.102698 2.972026 2.564558
H -2.724337 2.969065 -0.855470
H -1.155863 -0.446962 -3.033890
H 6.977050 1.406719 -0.195708
H 5.818451 2.703371 0.309215
H -4.748813 1.701354 2.665548
H -1.370577 3.808026 4.414041
H -4.587171 3.171128 -2.500536
H -3.041192 -0.256395 -4.685352
H -3.807169 3.189825 4.460574
H -4.769759 1.555595 -4.418946
H 6.306435 1.801050 -2.624029
H 5.194274 3.107672 -2.094700
H 6.961179 3.298037 -1.892835
H -1.643932 -2.198321 1.667315
H -2.782749 -3.509708 1.261413
H -3.027653 -1.087276 -1.375100


