%chk=000215323.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215323

0 1
O 0.105845 -2.618900 1.815882
N -4.124163 0.349348 -0.077919
N -1.468110 -0.760402 -0.323617
N 0.839660 -1.340382 0.055559
N 1.693286 -0.472031 -0.505766
C -3.052770 1.067104 -0.845523
C -3.498693 -0.416829 1.050634
C -2.070667 0.034521 -1.437232
C -2.517148 -1.459225 0.482744
C -5.152629 1.318632 0.427615
C -0.386362 -1.668162 -0.770222
C -6.440848 0.550581 0.774227
C -7.557839 1.503017 1.189407
C 0.933955 -1.819798 1.417428
C 2.741685 -0.042976 0.195528
C 2.084573 -1.297299 2.154013
C 2.958647 -0.441090 1.573874
C 3.689942 0.876890 -0.472458
C 5.065329 0.593949 -0.449608
C 3.220195 2.029866 -1.119953
C 5.963286 1.468519 -1.065766
C 4.126269 2.899273 -1.733527
C 5.496493 2.621941 -1.705693
H -2.492898 1.800628 -0.225047
H -3.531727 1.627736 -1.676308
H -4.305445 -0.941521 1.606922
H -2.969732 0.238701 1.776778
H -2.604286 -0.603648 -2.175744
H -1.254590 0.567743 -1.971697
H -2.008239 -1.992461 1.323049
H -3.075530 -2.216438 -0.109090
H -4.805871 1.905676 1.304126
H -5.373623 2.053596 -0.376967
H -0.601502 -2.749923 -0.578885
H -0.124140 -1.539297 -1.847333
H -6.754594 -0.053286 -0.101700
H -6.244450 -0.180504 1.582628
H -7.282438 2.094630 2.069696
H -7.812391 2.204645 0.386807
H -8.471410 0.951107 1.439878
H 2.171749 -1.631799 3.188526
H 3.816067 -0.029842 2.108977
H 5.430383 -0.308943 0.036499
H 2.150829 2.239595 -1.146462
H 7.029872 1.249425 -1.050176
H 3.761962 3.794328 -2.235627
H 6.199769 3.301304 -2.183875


%chk=000215323-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215323

0 1
O 0.026639 -2.678332 1.881887
N -4.042080 0.398011 -0.021691
N -1.559593 -1.001528 -0.393533
N 0.814160 -1.379358 0.084541
N 1.678048 -0.511702 -0.522166
C -2.823511 1.117042 -0.474690
C -3.661065 -0.726106 0.874074
C -1.885734 0.163276 -1.234637
C -2.735892 -1.713234 0.142044
C -5.030334 1.322330 0.590959
C -0.389693 -1.771043 -0.738122
C -6.435494 0.706234 0.755338
C -7.457470 1.740663 1.275435
C 0.904924 -1.879136 1.427032
C 2.740535 -0.061717 0.185250
C 2.071597 -1.377494 2.144398
C 2.951457 -0.495641 1.548326
C 3.649748 0.886764 -0.513771
C 4.931244 1.210548 0.010672
C 3.248870 1.488174 -1.739881
C 5.781376 2.111935 -0.666001
C 4.098601 2.386356 -2.414132
C 5.370331 2.706411 -1.880239
H -2.260933 1.557076 0.388894
H -3.128238 1.943166 -1.144344
H -4.571670 -1.261873 1.193533
H -3.136092 -0.352454 1.790147
H -2.385973 -0.146271 -2.184700
H -0.951110 0.694599 -1.492596
H -2.381001 -2.481106 0.851186
H -3.320246 -2.207719 -0.670869
H -4.676393 1.703927 1.585879
H -5.113798 2.204005 -0.075340
H -0.560413 -2.841769 -0.538624
H -0.062845 -1.622750 -1.784497
H -6.757259 0.305829 -0.224782
H -6.401163 -0.150621 1.455594
H -7.149674 2.147734 2.257420
H -7.556272 2.591528 0.574937
H -8.457759 1.287165 1.397551
H 2.199640 -1.724771 3.173320
H 3.803358 -0.109735 2.115080
H 5.286128 0.750794 0.939180
H 2.265885 1.235413 -2.147824
H 6.766379 2.345182 -0.246717
H 3.770185 2.841347 -3.355291
H 6.030303 3.406850 -2.403629


