%chk=000228827.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228827

0 1
O 2.864625 -1.653523 -0.001288
O 1.256156 2.658730 -0.001655
N 0.575951 -1.400039 -0.000372
N 2.062061 0.522323 -0.001364
N -1.790848 -1.112349 0.000191
N -1.454136 1.686341 -0.001077
N -2.628588 1.221429 -0.000689
N -4.112370 -0.666383 0.000439
C -0.527161 -0.561660 -0.000329
C -0.349177 0.860315 -0.000865
C 1.930038 -0.879918 -0.000809
C 0.974447 1.486927 -0.001240
C 0.396423 -2.876778 0.000087
C 3.461843 1.035622 -0.001088
C -2.831254 -0.207823 0.000038
H 1.382817 -3.380321 -0.000700
H -0.168210 -3.194463 -0.894591
H -0.166586 -3.194088 0.895913
H 4.005301 0.675186 -0.891213
H 3.998178 0.693487 0.900450
H 3.456285 2.143161 -0.012254
H -4.888683 -0.018754 0.000288
H -4.307710 -1.657222 0.000928


%chk=000228827-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228827

0 1
O 2.903949 -1.664770 0.000120
O 1.244750 2.715133 -0.002373
N 0.575429 -1.390850 0.000212
N 2.057713 0.512289 -0.001067
N -1.763619 -1.107596 0.000180
N -1.446129 1.715783 -0.001474
N -2.691027 1.191126 -0.001255
N -4.076633 -0.691163 -0.000218
C -0.522496 -0.544967 -0.000088
C -0.353090 0.875600 -0.000840
C 1.909862 -0.888807 -0.000251
C 0.993976 1.483512 -0.000731
C 0.376222 -2.858872 0.001002
C 3.455031 1.010986 -0.001783
C -2.798987 -0.217807 -0.000411
H 1.371473 -3.324812 0.000929
H -0.192319 -3.161621 -0.892896
H -0.191736 -3.160781 0.895561
H 3.985963 0.641304 -0.893764
H 3.984674 0.648340 0.893932
H 3.408234 2.109015 -0.005683
H -4.840457 -0.017677 -0.000667
H -4.251382 -1.693166 0.000364


