%chk=000228068.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228068

0 1
O -3.113985 -1.352434 -0.409693
O 3.080001 -0.881513 -0.233880
O 0.974177 2.279564 -0.544118
O 1.593220 -1.968905 0.910368
O 1.657402 1.426956 1.327555
N 1.958009 -1.073121 0.183259
N 1.213941 1.354548 0.201173
C 0.856307 -0.073794 -0.317235
C -0.494033 -0.463914 0.298848
C -1.644958 0.454468 -0.117635
C -2.989366 -0.128491 0.350269
C 0.893909 -0.097904 -1.833010
C -4.160548 0.801709 0.059065
H -0.408791 -0.507538 1.407768
H -0.744168 -1.512350 -0.004890
H -1.671887 0.562714 -1.222917
H -1.516234 1.475503 0.290078
H -2.961428 -0.415604 1.426502
H 1.918737 -0.008883 -2.232433
H 0.321392 0.743011 -2.263808
H 0.454928 -1.021967 -2.238183
H -4.031370 1.781705 0.534641
H -4.277746 0.976856 -1.018783
H -5.108937 0.391940 0.424989
H -4.018173 -1.710156 -0.355632


%chk=000228068-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228068

0 1
O -3.183974 -1.377351 -0.395066
O 3.176943 -0.699585 -0.119907
O 1.268576 2.292155 -0.640394
O 1.643913 -2.049086 0.894246
O 1.359542 1.396917 1.455534
N 1.979020 -1.032964 0.195899
N 1.204814 1.316783 0.184398
C 0.830499 -0.107489 -0.379775
C -0.521396 -0.513175 0.218298
C -1.672034 0.459825 -0.126892
C -3.020315 -0.107474 0.350542
C 0.943978 -0.123629 -1.901092
C -4.192800 0.850286 0.085073
H -0.410011 -0.592031 1.314524
H -0.781840 -1.515668 -0.161846
H -1.744640 0.617133 -1.219459
H -1.512031 1.445689 0.349282
H -2.958554 -0.326926 1.440403
H 1.964615 0.138537 -2.219708
H 0.242983 0.601913 -2.340046
H 0.690360 -1.131797 -2.271105
H -4.051383 1.806244 0.622090
H -4.279156 1.064186 -0.995331
H -5.150433 0.414637 0.428072
H -4.046275 -1.794732 -0.145441


