%chk=000230015.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230015

0 1
O -3.425954 -0.339052 0.042294
O 3.549933 -0.005505 0.157200
O 0.016333 2.054132 0.069205
O -2.849551 1.872818 0.023436
N -1.242280 0.115978 0.073642
N 1.127485 -2.556517 0.147373
C -4.852490 0.038650 0.013101
C 4.808103 0.779670 0.169470
C -5.564033 -1.295114 0.018610
C 5.866541 -0.297947 0.195230
C 1.220766 0.016619 0.116639
C -0.017597 0.842848 0.084683
C 2.406174 0.700725 0.128537
C -2.530304 0.713389 0.043900
C 1.168175 -1.399625 0.133536
H -5.052204 0.654359 0.907113
H -5.021448 0.630472 -0.903108
H 4.834164 1.395583 -0.745311
H 4.805735 1.411127 1.073996
H -6.652934 -1.163749 -0.001631
H -5.280583 -1.906852 -0.849827
H -5.310526 -1.883605 0.912007
H 6.876545 0.131596 0.210939
H 5.762862 -0.947462 1.078184
H 5.794834 -0.958536 -0.682594
H -1.230566 -0.915313 0.087426
H 2.454618 1.796711 0.115552


%chk=000230015-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230015

0 1
O -3.426981 -0.368757 0.042818
O 3.594876 -0.080881 0.160447
O 0.073178 2.119196 0.071819
O -2.857875 1.915575 0.021348
N -1.238098 0.156572 0.075174
N 0.916239 -2.641874 0.149720
C -4.873915 0.001888 0.010661
C 4.852393 0.741043 0.171743
C -5.658993 -1.305031 0.016411
C 6.017749 -0.238392 0.193213
C 1.195403 -0.028751 0.119652
C -0.019539 0.864373 0.086920
C 2.419693 0.605371 0.132073
C -2.532551 0.715610 0.043963
C 1.075391 -1.453098 0.136354
H -5.089647 0.631208 0.892912
H -5.056864 0.603547 -0.897906
H 4.856014 1.373229 -0.736250
H 4.832237 1.384495 1.071527
H -6.742189 -1.087761 -0.006802
H -5.409013 -1.920054 -0.864879
H -5.441835 -1.892445 0.924817
H 6.972055 0.318046 0.203846
H 5.975875 -0.877753 1.090753
H 6.001136 -0.887241 -0.698296
H -1.210359 -0.868877 0.089548
H 2.437419 1.706162 0.118016