%chk=000207639.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207639

0 1
O -1.559338 2.492290 0.441022
N -3.760460 -1.132004 0.732944
N -0.387702 0.539930 0.650429
N 0.718982 -0.214442 0.508605
C -4.479233 -2.174497 -0.073274
C -4.730680 0.008898 0.853897
C -5.539492 -1.465985 -0.945262
C -5.710168 -0.061103 -0.338814
C -2.474580 -0.708606 0.093925
C -1.575453 -0.167244 1.225574
C -0.496612 1.922441 0.267502
C 0.741058 2.495742 -0.304516
C 1.813877 0.339903 -0.005252
C 1.851629 1.724894 -0.432415
C 3.019537 -0.510605 -0.136154
C 0.665180 3.922572 -0.712907
C 4.251918 -0.048127 0.353542
C 2.935125 -1.770224 -0.748892
C 5.393380 -0.841641 0.219120
C 4.082869 -2.557087 -0.879560
C 5.311653 -2.094236 -0.399104
H -4.964700 -2.854686 0.659818
H -3.787062 -2.790947 -0.673040
H -4.217019 0.987734 0.911948
H -5.268163 -0.134325 1.815013
H -6.489527 -2.023514 -0.945890
H -5.212794 -1.404898 -1.996150
H -5.483144 0.721067 -1.082133
H -6.746845 0.113986 -0.010050
H -2.607755 0.057198 -0.700516
H -1.981460 -1.581257 -0.385024
H -1.241806 -0.997189 1.888367
H -2.130678 0.564580 1.860187
H 2.778715 2.111122 -0.857601
H 0.397869 4.564572 0.143652
H -0.126596 4.077587 -1.465113
H 1.604843 4.300181 -1.133798
H 4.316097 0.920300 0.846716
H 1.974574 -2.134173 -1.113239
H 6.349038 -0.484913 0.600291
H 4.017215 -3.534701 -1.354981
H 6.203808 -2.709291 -0.502467


%chk=000207639-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207639

0 1
O -1.686899 2.407157 0.552544
N -3.796373 -1.206877 0.654624
N -0.395623 0.447686 0.678528
N 0.747016 -0.292582 0.514789
C -4.578250 -2.141843 -0.204113
C -4.746910 -0.075627 0.902777
C -5.375400 -1.243245 -1.201755
C -5.649377 0.058896 -0.381632
C -2.509964 -0.758969 0.064335
C -1.565290 -0.295485 1.201792
C -0.562631 1.833398 0.369829
C 0.644910 2.485335 -0.153811
C 1.839551 0.335701 0.024798
C 1.799254 1.737610 -0.317758
C 3.061246 -0.501471 -0.134649
C 0.528505 3.947128 -0.493914
C 4.336012 0.080053 -0.375765
C 2.971513 -1.918629 -0.038878
C 5.483039 -0.729695 -0.523692
C 4.116907 -2.724980 -0.185574
C 5.380702 -2.135935 -0.431604
H -5.283611 -2.700313 0.442100
H -3.913800 -2.874447 -0.693264
H -4.190970 0.851546 1.122757
H -5.370963 -0.321973 1.781698
H -6.303735 -1.728100 -1.551852
H -4.756811 -1.021481 -2.090844
H -5.392474 0.961254 -0.962678
H -6.714163 0.140258 -0.099546
H -2.629178 0.076433 -0.664155
H -2.044213 -1.607818 -0.468753
H -1.188919 -1.159775 1.767818
H -2.116309 0.380685 1.874884
H 2.691428 2.217406 -0.731289
H 0.208511 4.523593 0.393585
H -0.259423 4.105941 -1.253214
H 1.480870 4.356763 -0.869351
H 4.451462 1.167676 -0.431902
H 1.992581 -2.367201 0.153374
H 6.456574 -0.260860 -0.705161
H 4.026162 -3.814407 -0.111138
H 6.271141 -2.763504 -0.547541


