%chk=000216274.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216274

0 1
O 1.304916 2.075170 -0.428242
O -2.525018 2.707765 0.499763
O -0.561677 3.521807 0.091159
O -1.740333 -3.391152 -0.257884
O -3.361210 -2.039912 0.225908
N -1.346854 2.601815 0.200313
N -2.201346 -2.278915 -0.058957
C 3.383590 -0.756739 0.141618
C 2.395201 -0.574269 -1.037143
C 0.972177 -0.332744 -0.628369
C 3.454163 0.494297 1.023178
C 3.038595 -1.991866 0.975532
C 0.507182 0.993263 -0.370742
C 0.074972 -1.381042 -0.516705
C -0.849760 1.235995 -0.045654
C -1.277319 -1.135921 -0.171669
C -1.744547 0.157423 0.054428
H 4.396460 -0.916950 -0.314325
H 2.448374 -1.478275 -1.683849
H 2.749273 0.249514 -1.693222
H 2.582221 0.580192 1.684845
H 3.520580 1.418914 0.430823
H 4.336766 0.468195 1.675448
H 3.769302 -2.144574 1.779505
H 2.054565 -1.905805 1.451379
H 3.031465 -2.904112 0.368703
H 0.392916 -2.418308 -0.696259
H -2.802933 0.342842 0.312993
H 2.290082 1.829892 -0.542974


%chk=000216274-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216274

0 1
O 1.294688 2.166826 -0.444888
O -2.422278 2.697212 1.009763
O -1.024467 3.574044 -0.569261
O -1.695288 -3.465204 -0.281581
O -3.421298 -2.064719 0.241896
N -1.471006 2.598682 0.138882
N -2.188768 -2.289608 -0.066785
C 3.414496 -0.784083 0.163827
C 2.424151 -0.517197 -1.022205
C 0.970473 -0.270073 -0.637748
C 3.593160 0.444555 1.086818
C 3.017507 -2.035133 0.980010
C 0.476636 1.054212 -0.398341
C 0.070652 -1.347145 -0.535738
C -0.900033 1.245484 -0.074641
C -1.278262 -1.130028 -0.180821
C -1.779427 0.159344 0.060568
H 4.394482 -0.989621 -0.315259
H 2.452245 -1.400776 -1.686809
H 2.819971 0.321438 -1.634896
H 2.648349 0.722181 1.590168
H 3.978085 1.326982 0.534876
H 4.331245 0.224956 1.878879
H 3.786618 -2.256697 1.741726
H 2.057437 -1.887349 1.507256
H 2.918308 -2.926842 0.333522
H 0.402216 -2.370372 -0.733314
H -2.823153 0.317933 0.342532
H 2.245066 1.907497 -0.558836


