%chk=000203368.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203368

0 1
N 1.866174 -0.469885 -0.033081
C 1.099367 0.807514 0.204315
C 1.261953 1.762740 -1.011693
C 1.664831 1.535762 1.460640
C 2.713082 2.219736 -1.204999
C 3.115819 1.991596 1.266495
C 1.454320 -1.187765 -1.285317
C 1.808846 -1.417488 1.130543
C 3.248644 2.918338 0.051292
C 2.443770 -2.331733 -1.567886
C 2.810609 -2.563348 0.904542
C -0.378285 0.511558 0.465503
C 2.498237 -3.317563 -0.394050
C -1.329446 0.446502 -0.470813
C -2.737806 0.128160 -0.174408
C -3.075784 -0.942559 0.669450
C -3.758911 0.899718 -0.756296
C -4.417559 -1.233441 0.929837
C -5.097489 0.606817 -0.487585
C -5.430146 -0.459855 0.354578
H 0.609406 2.642748 -0.854021
H 0.905435 1.273922 -1.938852
H 1.601976 0.878917 2.349520
H 1.023129 2.411472 1.676240
H 2.781900 2.893904 -2.077303
H 3.346655 1.337423 -1.433480
H 3.762073 1.100618 1.122580
H 3.475817 2.500642 2.178316
H 1.475526 -0.465277 -2.130945
H 0.418492 -1.587639 -1.225911
H 0.791205 -1.833357 1.292161
H 2.085541 -0.861554 2.053780
H 4.306715 3.202760 -0.094893
H 2.697122 3.860420 0.228146
H 3.452580 -1.907183 -1.742916
H 2.154315 -2.851915 -2.498148
H 2.790726 -3.251477 1.767973
H 3.836713 -2.147072 0.854579
H -0.619276 0.326695 1.514113
H 1.534807 -3.853145 -0.301544
H 3.264951 -4.091447 -0.580419
H -1.121738 0.638686 -1.526340
H -2.290568 -1.550092 1.114995
H -3.505186 1.730994 -1.411066
H -4.674166 -2.065742 1.583088
H -5.884914 1.210465 -0.935909
H -6.473859 -0.686872 0.560089


%chk=000203368-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203368

0 1
N 1.863784 -0.528696 -0.060049
C 1.056388 0.734847 0.211127
C 1.242549 1.734773 -0.970918
C 1.604144 1.462483 1.484108
C 2.719009 2.150145 -1.161754
C 3.087684 1.875061 1.346033
C 1.449342 -1.282811 -1.276396
C 2.049819 -1.459779 1.085598
C 3.291330 2.797855 0.121158
C 2.515470 -2.329299 -1.668505
C 3.139863 -2.508426 0.768090
C -0.407152 0.370989 0.463424
C 2.783072 -3.306184 -0.503913
C -1.485115 0.688100 -0.309567
C -2.893186 0.298856 -0.077495
C -3.312805 -0.525182 1.007570
C -3.891458 0.768578 -0.978432
C -4.670439 -0.859240 1.181314
C -5.251967 0.435326 -0.806393
C -5.650167 -0.381584 0.276400
H 0.634935 2.633607 -0.742351
H 0.840194 1.324527 -1.915655
H 1.446268 0.848921 2.391011
H 0.982461 2.369553 1.622860
H 2.800103 2.853940 -2.013494
H 3.314705 1.251921 -1.412518
H 3.713180 0.970021 1.225069
H 3.418663 2.386722 2.271263
H 1.313341 -0.577263 -2.112374
H 0.468998 -1.799726 -1.122797
H 1.104199 -2.003645 1.342175
H 2.354660 -0.888668 1.977451
H 4.366583 3.026621 -0.012048
H 2.776347 3.764690 0.304038
H 3.453618 -1.802528 -1.932566
H 2.172539 -2.876334 -2.568432
H 3.256764 -3.185000 1.637277
H 4.103744 -1.983775 0.617320
H -0.560093 -0.238797 1.368412
H 1.872414 -3.912244 -0.315489
H 3.594122 -4.012867 -0.763400
H -1.324327 1.306752 -1.204043
H -2.573022 -0.907704 1.719631
H -3.590402 1.404425 -1.820887
H -4.970199 -1.494782 2.022728
H -5.999408 0.811359 -1.514261
H -6.704950 -0.643845 0.414578


