%chk=000200294.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200294

0 1
O 2.429326 0.024565 -0.381843
O 3.957709 1.236302 0.809816
N -4.343353 0.835531 -0.594553
C -2.361717 -0.627733 -0.207631
C -2.481315 -0.307421 -1.730359
C -3.706702 -0.097905 0.387641
C -2.246225 -2.153747 0.020426
C -3.856634 0.360138 -1.931444
C -1.121324 0.053821 0.361160
C -2.121279 -2.536576 1.501460
C -3.963206 2.256576 -0.339981
C 0.126268 -0.221056 -0.217935
C -1.180544 0.935828 1.453370
C -2.038536 -4.050472 1.683247
C 1.269977 0.398402 0.305488
C -0.024601 1.538698 1.954193
C 1.225817 1.280820 1.385928
C 3.715521 0.470649 -0.081742
C 4.638968 -0.206885 -1.089323
C 5.629196 -1.078318 -0.318994
C 5.329696 0.879829 -1.911029
H -2.386034 -1.214276 -2.346743
H -1.674874 0.369923 -2.060614
H -4.422970 -0.937287 0.526899
H -3.582227 0.369941 1.382468
H -1.371692 -2.547231 -0.533602
H -3.128739 -2.655690 -0.422651
H -3.818665 1.176753 -2.673854
H -4.604595 -0.374737 -2.298912
H -2.981298 -2.138917 2.073989
H -1.221355 -2.057537 1.938543
H -4.446789 2.896292 -1.094719
H -2.880901 2.455287 -0.355766
H -4.359662 2.560601 0.641340
H 0.226844 -0.904924 -1.057637
H -2.142825 1.153967 1.920762
H -2.930369 -4.555140 1.295146
H -1.170105 -4.472879 1.165064
H -1.946924 -4.315703 2.742733
H -0.094522 2.221120 2.801904
H 2.129982 1.751200 1.775666
H 4.024328 -0.854677 -1.770261
H 5.121880 -1.873497 0.241523
H 6.216562 -0.490431 0.400455
H 6.340267 -1.560715 -1.000906
H 5.900713 1.571224 -1.275274
H 6.034700 0.441066 -2.627829
H 4.609526 1.477419 -2.483717


%chk=000200294-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200294

0 1
O 2.507145 0.060902 -0.432662
O 4.211356 0.850674 0.993291
N -4.215587 0.893537 -0.840213
C -2.353292 -0.616775 -0.120552
C -2.374466 -0.438263 -1.688245
C -3.703664 0.109733 0.316676
C -2.439524 -2.146806 0.223458
C -3.816992 0.056431 -2.006456
C -1.072355 -0.038656 0.512981
C -2.565927 -2.497028 1.723474
C -3.685525 2.278947 -0.900180
C 0.166036 -0.182679 -0.161574
C -1.048264 0.569367 1.797782
C -2.700120 -4.018439 1.953141
C 1.368378 0.282082 0.411559
C 0.160623 1.031681 2.360615
C 1.393053 0.901835 1.681706
C 3.843890 0.363642 -0.096808
C 4.758882 0.030439 -1.271857
C 5.948157 -0.832342 -0.783541
C 5.253454 1.358001 -1.910979
H -2.126718 -1.377225 -2.215615
H -1.644565 0.329000 -2.001438
H -4.454427 -0.665958 0.563536
H -3.598350 0.765952 1.194798
H -1.540631 -2.652970 -0.184425
H -3.313731 -2.565511 -0.319271
H -3.887296 0.630284 -2.946109
H -4.513605 -0.802044 -2.076265
H -3.446638 -1.982134 2.157726
H -1.680272 -2.117935 2.267879
H -4.096232 2.782526 -1.793365
H -2.572157 2.351723 -0.938531
H -4.030888 2.836521 -0.011833
H 0.220518 -0.659236 -1.145320
H -1.972902 0.683376 2.371940
H -3.599171 -4.421513 1.449215
H -1.821132 -4.557837 1.552004
H -2.779834 -4.258043 3.029376
H 0.150434 1.501189 3.350662
H 2.325966 1.256344 2.119267
H 4.165577 -0.529520 -2.015419
H 5.607043 -1.801381 -0.377332
H 6.505302 -0.303713 0.009593
H 6.636819 -1.033840 -1.623486
H 5.826932 1.948543 -1.174524
H 5.911566 1.135896 -2.769970
H 4.410430 1.973418 -2.272808


