%chk=000231287.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231287

0 1
O -0.503017 0.263446 -1.394087
O -2.967059 -1.205058 -0.699624
N -1.332403 -0.249267 0.687096
N -3.654787 -0.173567 1.231121
C 1.119455 -0.040190 0.403213
C 1.840544 -1.330231 -0.089164
C 1.869777 1.257710 0.055006
C 2.204784 -1.268244 -1.572926
C 3.080315 -1.602900 0.769785
C -0.266872 0.008624 -0.239120
C 1.321006 2.461576 0.814497
C -2.679038 -0.570272 0.288531
H 1.041304 -0.107372 1.516580
H 1.124965 -2.182309 0.056186
H 2.947134 1.126387 0.279855
H 1.807641 1.442087 -1.039286
H 2.517056 -2.249548 -1.946052
H 3.021529 -0.567530 -1.773007
H 1.346160 -0.946637 -2.184150
H 3.591036 -2.515032 0.437597
H 2.826039 -1.738163 1.825713
H 3.808954 -0.786414 0.705671
H 1.871794 3.373216 0.550217
H 1.402113 2.337437 1.899391
H 0.267006 2.647199 0.574483
H -1.120828 -0.271580 1.687079
H -3.497878 0.607415 1.846795
H -4.622332 -0.296082 0.953599


%chk=000231287-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231287

0 1
O -0.511781 0.744330 -1.383288
O -3.070986 -0.725209 -1.005850
N -1.334420 -0.282068 0.566016
N -3.545845 -0.606366 1.274468
C 1.098023 0.121103 0.383782
C 1.716820 -1.272844 -0.023640
C 1.970176 1.340326 0.000006
C 2.111657 -1.334219 -1.518046
C 2.914238 -1.634575 0.887616
C -0.303048 0.247082 -0.250157
C 1.514251 2.643571 0.691204
C -2.689681 -0.538098 0.172985
H 0.985761 0.106292 1.491387
H 0.927549 -2.036423 0.147725
H 3.024906 1.131892 0.261456
H 1.920386 1.473225 -1.095713
H 2.413608 -2.362497 -1.789791
H 2.966882 -0.666860 -1.730337
H 1.274834 -1.033819 -2.172149
H 3.296665 -2.640947 0.635770
H 2.628534 -1.637318 1.956923
H 3.749658 -0.921789 0.759674
H 2.158933 3.492043 0.398587
H 1.557298 2.553370 1.794064
H 0.477885 2.901050 0.405387
H -1.065315 -0.558235 1.513695
H -3.307003 -0.226348 2.188856
H -4.515585 -0.851965 1.084368


