%chk=000244579.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244579

0 1
O 3.175165 -2.731184 0.205718
O -4.032593 -1.877693 -0.309741
O -2.422163 2.438791 0.283713
N -2.797438 0.118295 -0.000100
C 0.912801 0.005295 -0.017154
C 1.141110 -1.400259 0.105436
C 2.225302 0.687050 -0.086752
C 3.251400 -0.305780 -0.008407
C 2.617692 -1.668575 0.116704
C -1.451105 -0.391974 0.036343
C -0.365833 0.521057 -0.055037
C 0.080760 -2.280013 0.192400
C -1.230860 -1.769900 0.159381
C 2.547614 2.025310 -0.204390
C 4.584618 0.043433 -0.049307
C 3.915152 2.379526 -0.245968
C 4.912186 1.413072 -0.170710
C -3.997928 -0.688291 -0.173638
C -3.173735 1.517852 0.132004
C -5.147510 0.296399 -0.141418
C -4.684308 1.536309 0.033593
H -0.531365 1.596921 -0.145034
H 0.249957 -3.355098 0.286309
H -2.066268 -2.473281 0.224401
H 1.778347 2.792485 -0.262659
H 5.366803 -0.714202 0.010436
H 4.183933 3.432416 -0.338556
H 5.960907 1.706249 -0.204540
H -6.162713 -0.058996 -0.252656
H -5.216228 2.474885 0.106429


%chk=000244579-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244579

0 1
O 3.200169 -2.756390 0.365265
O -3.968154 -1.774554 -0.933373
O -2.520899 2.325581 0.917866
N -2.821955 0.117647 0.012976
C 0.915555 0.010268 -0.016334
C 1.139205 -1.383613 0.188543
C 2.236482 0.687829 -0.129257
C 3.260091 -0.298244 0.003963
C 2.620195 -1.646234 0.209006
C -1.475565 -0.382540 0.071941
C -0.386399 0.523548 -0.086676
C 0.066713 -2.274125 0.336156
C -1.253827 -1.769211 0.285653
C 2.577407 2.037051 -0.323355
C 4.620337 0.039758 -0.056239
C 3.954118 2.384829 -0.385071
C 4.965591 1.401920 -0.254405
C -3.965019 -0.608083 -0.477946
C -3.247123 1.425955 0.434680
C -5.144976 0.313924 -0.341566
C -4.728614 1.493491 0.188131
H -0.573477 1.587830 -0.241278
H 0.251218 -3.341203 0.494818
H -2.103785 -2.444937 0.395099
H 1.809419 2.811919 -0.421919
H 5.386864 -0.735007 0.049561
H 4.238125 3.432385 -0.535365
H 6.018601 1.698567 -0.305727
H -6.143954 0.003686 -0.647528
H -5.302645 2.388050 0.429180


