%chk=000221974.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221974

0 1
O -0.037388 -0.379747 1.333851
O -0.287476 -0.151397 -0.960249
O 3.136857 -1.233713 0.792525
O 2.901035 -0.994147 -1.342747
N 2.685449 -0.676189 -0.189097
C -1.000076 -0.118629 0.286994
C -1.733938 1.202742 0.539602
C -1.873559 -1.377621 0.279375
C 1.831651 0.596458 0.047423
C -2.972455 1.320397 -0.356174
C -3.125462 -1.189739 -0.581504
C -3.881942 0.092758 -0.212965
C 1.095578 0.487048 1.402225
C 0.807473 0.756531 -1.098846
C 2.822844 1.758925 0.059315
H -1.067687 2.067900 0.380145
H -2.030411 1.236134 1.608169
H -2.138562 -1.628688 1.326249
H -1.270138 -2.231351 -0.095820
H -2.654526 1.426724 -1.413235
H -3.531199 2.240623 -0.103713
H -3.787007 -2.069503 -0.470906
H -2.830832 -1.156717 -1.650914
H -4.265274 0.022559 0.822897
H -4.771146 0.204675 -0.861379
H 1.720656 -0.009480 2.178097
H 0.776655 1.482778 1.756473
H 0.428412 1.792480 -1.146525
H 1.230682 0.459846 -2.084265
H 3.373365 1.841051 -0.890050
H 2.317362 2.720170 0.218851
H 3.571560 1.654623 0.858998


%chk=000221974-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221974

0 1
O 0.014262 -0.406741 1.413410
O -0.336004 -0.131517 -0.962430
O 3.121915 -1.313183 0.772988
O 2.782406 -1.060117 -1.460107
N 2.615714 -0.706040 -0.237744
C -0.996616 -0.147574 0.363160
C -1.782894 1.158403 0.629889
C -1.904089 -1.381422 0.361133
C 1.824286 0.631276 0.034902
C -2.966026 1.312050 -0.358342
C -3.093013 -1.219237 -0.614518
C -3.891019 0.073076 -0.320690
C 1.135970 0.534867 1.412928
C 0.768068 0.823756 -1.073135
C 2.892900 1.745812 0.006708
H -1.125108 2.046572 0.576220
H -2.162564 1.102160 1.668588
H -2.269365 -1.525367 1.395468
H -1.285438 -2.256736 0.098331
H -2.567662 1.435471 -1.384635
H -3.534351 2.229778 -0.113383
H -3.751554 -2.105108 -0.539933
H -2.706291 -1.185896 -1.650886
H -4.362941 -0.002420 0.681167
H -4.710598 0.190931 -1.055029
H 1.835641 0.149086 2.169123
H 0.810467 1.556953 1.700545
H 0.407329 1.873004 -1.018556
H 1.207825 0.640149 -2.064700
H 3.394506 1.783521 -0.975915
H 2.418352 2.725312 0.192437
H 3.656391 1.576684 0.785807


