%chk=000207182.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207182

0 1
O 1.455883 1.081542 0.662194
O 1.826773 1.844495 -1.433495
O 6.781896 -2.069644 -0.461988
N -6.076091 -0.526744 -0.028398
C -4.761875 1.603429 -0.077771
C -3.399565 0.939265 -0.312838
C -5.909258 0.797857 -0.713928
C -2.262961 1.736777 0.339268
C -0.905476 1.073165 0.083031
C -6.874925 -1.475558 -0.874646
C -6.694832 -0.357203 1.329263
C 0.222936 1.862565 0.738957
C -6.019560 -1.990250 -2.033877
C -6.435457 -1.600386 2.181947
C 2.181932 1.142043 -0.511891
C 3.371331 0.276624 -0.430410
C 4.250872 0.249279 -1.535203
C 3.638643 -0.506229 0.702495
C 5.382753 -0.549150 -1.507810
C 4.772406 -1.317762 0.751898
C 5.633657 -1.330255 -0.355721
C 7.157539 -2.917851 0.652552
H -4.939669 1.715994 1.011033
H -4.765791 2.626806 -0.498564
H -3.427357 -0.095331 0.089756
H -3.214619 0.829439 -1.398176
H -5.669993 0.608225 -1.784603
H -6.839515 1.405781 -0.704103
H -2.443610 1.823172 1.428223
H -2.255876 2.772187 -0.053986
H -0.714805 0.992841 -1.007754
H -0.904277 0.031967 0.462333
H -7.177157 -2.337980 -0.238115
H -7.813447 -1.023798 -1.261676
H -6.216322 0.522882 1.818941
H -7.783979 -0.142675 1.284418
H 0.106141 1.969290 1.831709
H 0.388630 2.845200 0.263259
H -5.791920 -1.200556 -2.758719
H -5.056666 -2.371460 -1.666455
H -6.524230 -2.802286 -2.565813
H -6.978680 -2.475481 1.807964
H -5.367939 -1.861039 2.172767
H -6.734681 -1.434913 3.221204
H 4.025187 0.866725 -2.411236
H 2.947911 -0.475849 1.551552
H 6.077715 -0.589914 -2.344062
H 4.969908 -1.919246 1.632352
H 8.088919 -3.368901 0.284298
H 7.340891 -2.312595 1.544896
H 6.392809 -3.680989 0.823026


%chk=000207182-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207182

0 1
O 1.472655 0.958339 0.754878
O 1.936680 1.948738 -1.311344
O 7.000090 -2.021195 -0.586195
N -6.234263 -0.460968 -0.023329
C -4.833237 1.645425 -0.159124
C -3.472216 0.937389 -0.327730
C -6.013462 0.828054 -0.734547
C -2.301389 1.702903 0.327513
C -0.947984 0.975010 0.151397
C -6.843877 -1.503016 -0.893919
C -6.971668 -0.279364 1.256416
C 0.201287 1.735560 0.826095
C -5.839587 -2.121583 -1.885603
C -6.704956 -1.406628 2.272772
C 2.252933 1.145358 -0.395569
C 3.472937 0.297298 -0.383335
C 4.379092 0.397539 -1.476151
C 3.758624 -0.605609 0.670695
C 5.541295 -0.384901 -1.513168
C 4.923309 -1.398467 0.645397
C 5.817864 -1.287377 -0.451466
C 7.341200 -2.972572 0.476903
H -5.008893 1.851256 0.916833
H -4.811457 2.633301 -0.664867
H -3.553300 -0.078396 0.105385
H -3.261164 0.803296 -1.409664
H -5.794059 0.602079 -1.794928
H -6.940873 1.456042 -0.730580
H -2.513105 1.835842 1.409711
H -2.234492 2.722374 -0.106980
H -0.722815 0.860439 -0.925691
H -1.014438 -0.041747 0.585309
H -7.227487 -2.307514 -0.240085
H -7.729331 -1.101541 -1.451321
H -6.641206 0.677377 1.701301
H -8.074097 -0.179925 1.080516
H 0.027306 1.858350 1.908635
H 0.360447 2.720019 0.349783
H -5.434890 -1.370764 -2.588236
H -4.989804 -2.563013 -1.336267
H -6.326246 -2.913363 -2.485623
H -7.031389 -2.391790 1.893277
H -5.625080 -1.469947 2.493500
H -7.250544 -1.214623 3.215805
H 4.147523 1.097467 -2.285486
H 3.060099 -0.680446 1.508520
H 6.249417 -0.321628 -2.344522
H 5.122913 -2.088867 1.469979
H 8.292086 -3.425038 0.160553
H 7.476364 -2.457669 1.447439
H 6.567386 -3.757998 0.575219


