%chk=000248320.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248320

0 1
O -0.632416 -2.201283 -0.764006
O 0.322235 -2.267015 1.260100
N -1.671918 0.188874 0.733779
C -0.295397 -0.075577 0.230885
C 0.778161 0.637809 1.073868
C -2.681555 0.261634 -0.367047
C -4.071813 0.475163 0.249693
C -5.160375 0.461345 -0.831467
C 2.134035 0.539751 0.428063
C -0.142364 -1.594974 0.374016
C -6.547796 0.677670 -0.232190
C 2.951654 -0.572558 0.679731
C 2.585889 1.557020 -0.425213
C 4.212109 -0.661889 0.085042
C 3.848597 1.461961 -1.017554
C 4.663576 0.354609 -0.763688
H -0.159822 0.189129 -0.854175
H 0.805791 0.196680 2.097681
H 0.498389 1.700446 1.223705
H -2.650332 -0.709601 -0.917382
H -2.458869 1.058602 -1.108346
H -1.700345 1.029843 1.316066
H -4.106350 1.428858 0.809486
H -4.270629 -0.317867 1.000187
H -5.136739 -0.503052 -1.377187
H -4.954456 1.243437 -1.588309
H -7.321420 0.659480 -1.008288
H -6.798342 -0.101584 0.497360
H -6.621808 1.642508 0.282194
H 2.596772 -1.370697 1.337065
H 1.958689 2.422174 -0.627179
H 4.844214 -1.526381 0.283661
H 4.197641 2.253802 -1.678221
H 5.646386 0.283287 -1.224854
H -0.595993 -3.192205 -0.718876


%chk=000248320-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248320

0 1
O -0.513371 -2.360216 -0.860058
O 0.382884 -2.271698 1.281968
N -1.680446 0.077059 0.577042
C -0.299204 -0.160025 0.126921
C 0.736357 0.652377 0.949021
C -2.732027 0.297764 -0.426194
C -4.121433 0.389175 0.235135
C -5.253285 0.638806 -0.787716
C 2.155230 0.554890 0.403015
C -0.063291 -1.672402 0.278230
C -6.643456 0.740981 -0.123980
C 3.049600 -0.449500 0.855778
C 2.601700 1.463021 -0.592538
C 4.356556 -0.541934 0.326018
C 3.907255 1.372349 -1.124886
C 4.790580 0.367394 -0.666095
H -0.199070 0.099644 -0.945803
H 0.699367 0.292907 1.994947
H 0.399849 1.706862 0.936989
H -2.721019 -0.552925 -1.135300
H -2.552109 1.221869 -1.032081
H -1.771186 0.602594 1.449745
H -4.122081 1.210880 0.983500
H -4.313996 -0.548459 0.792235
H -5.257126 -0.182107 -1.533007
H -5.041229 1.570700 -1.350518
H -7.437005 0.918259 -0.872787
H -6.892484 -0.189829 0.419382
H -6.674477 1.572774 0.605040
H 2.711024 -1.161928 1.616416
H 1.924388 2.251295 -0.946357
H 5.035693 -1.322191 0.688248
H 4.236729 2.084937 -1.889784
H 5.805034 0.296644 -1.074617
H -0.438555 -3.340568 -0.699310


