%chk=000296612.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296612

0 1
O -1.828825 2.327633 0.552081
O 4.368308 -0.803208 -1.205458
O 4.594475 -0.546383 0.932070
N -2.327413 -1.211776 -0.188172
N -3.470619 -1.894751 -0.375171
N 3.946979 -0.510010 -0.099805
C -0.118806 0.720490 0.179611
C -1.552035 1.183510 0.280847
C -2.573107 0.154027 0.033469
C 0.416621 0.383592 -1.070499
C 0.666531 0.667156 1.337204
C 2.528442 -0.078584 -0.002105
C 1.750358 -0.015742 -1.167622
C 2.000686 0.262645 1.251079
C -3.968244 0.309982 -0.023807
C -4.493672 -0.987143 -0.282044
H -0.199175 0.448967 -1.970475
H 0.243509 0.953347 2.303589
H 2.193719 -0.276323 -2.136212
H 2.635054 0.215003 2.144486
H -4.518024 1.224500 0.102566
H -1.428371 -1.674215 -0.204784
H -5.527193 -1.275016 -0.396246


%chk=000296612-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296612

0 1
O -1.837559 1.908065 1.370255
O 4.393340 -0.841675 -1.340714
O 4.866857 -0.034962 0.740709
N -2.497777 -1.227747 -0.416021
N -3.685301 -1.773339 -0.850399
N 4.046490 -0.317731 -0.213554
C -0.116051 0.528507 0.401353
C -1.558971 0.899113 0.650119
C -2.634445 0.079026 0.060747
C 0.325345 -0.036456 -0.826712
C 0.833020 0.835266 1.413136
C 2.603988 -0.020125 -0.000613
C 1.691449 -0.309247 -1.036721
C 2.197477 0.554237 1.224666
C -4.005412 0.389297 -0.084861
C -4.602978 -0.765107 -0.656930
H -0.386223 -0.214706 -1.639775
H 0.478823 1.301937 2.337401
H 2.059399 -0.728304 -1.976891
H 2.944689 0.770444 1.992509
H -4.472743 1.331140 0.190797
H -1.664224 -1.814341 -0.406425
H -5.639994 -0.935591 -0.937470


