%chk=000200456.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200456

0 1
O -0.419304 2.724939 0.000269
O 3.301929 -1.589625 -0.000198
O 3.776750 0.522903 0.000541
N -0.102880 1.541927 0.000285
N 1.175675 1.212211 0.000203
N 3.007407 -0.404520 -0.000019
C -0.770924 -0.838948 -0.000052
C -1.137681 0.529096 0.000117
C 0.624884 -1.172302 -0.000085
C -1.800136 -1.820022 -0.000190
C -2.505671 0.914587 0.000134
C 1.519643 -0.134535 0.000034
C -3.124219 -1.433222 -0.000166
C -3.480937 -0.058523 -0.000003
H 0.950195 -2.217410 -0.000246
H -1.523337 -2.875516 -0.000329
H -2.751155 1.983078 0.000281
H -3.918807 -2.183485 -0.000288
H -4.537331 0.215967 0.000012


%chk=000200456-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200456

0 1
O -0.456828 2.788864 0.000066
O 3.329619 -1.656404 -0.000212
O 3.815283 0.575057 -0.000298
N -0.114197 1.535291 0.000488
N 1.214252 1.215268 0.000327
N 2.997253 -0.406258 0.000233
C -0.765641 -0.859517 0.000066
C -1.146645 0.523639 0.000215
C 0.627482 -1.188601 0.000105
C -1.807808 -1.839873 -0.000138
C -2.502114 0.929945 0.000108
C 1.512453 -0.118123 0.000227
C -3.149266 -1.442915 -0.000219
C -3.497829 -0.057845 -0.000100
H 0.993204 -2.216364 0.000004
H -1.537142 -2.900957 -0.000250
H -2.733993 1.997640 0.000227
H -3.941697 -2.198071 -0.000386
H -4.552285 0.235824 -0.000162


