%chk=000118568.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000118568

0 1
O 3.845211 1.152589 0.000567
O 0.300305 -1.214382 -0.000198
N -0.811704 0.837070 -0.000306
N 1.547062 0.753257 -0.000204
N 3.291023 -1.075938 -0.000680
C -2.169538 0.367851 -0.000188
C -3.178018 1.354418 -0.000021
C -2.501756 -0.995976 -0.000300
C 0.321783 -0.009228 -0.000393
C -4.515904 0.958135 0.000041
C -3.847964 -1.366690 -0.000240
C 2.811843 0.165406 -0.000153
C -4.856802 -0.398437 -0.000062
C 5.028085 0.395969 0.000431
C 4.701527 -0.935150 -0.000213
H -0.695566 1.850888 -0.000304
H -2.929613 2.411922 -0.000001
H -1.723009 -1.766347 -0.000515
H 1.547457 1.777112 0.000049
H -5.300045 1.715322 0.000116
H -4.109600 -2.425734 -0.000372
H -5.902074 -0.698607 -0.000052
H 5.912876 0.988772 0.000879
H 5.329719 -1.812224 -0.000484


%chk=000118568-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000118568

0 1
O 3.816984 1.211181 0.000896
O 0.337374 -1.361639 -0.000196
N -0.788847 0.717154 -0.000274
N 1.540881 0.670251 0.000027
N 3.341245 -1.048017 -0.001022
C -2.155346 0.309001 -0.000219
C -3.134905 1.339485 -0.000277
C -2.564519 -1.051076 -0.000109
C 0.345794 -0.107981 -0.000200
C -4.506788 1.017720 -0.000225
C -3.943247 -1.354410 -0.000053
C 2.836283 0.174051 -0.000115
C -4.921537 -0.334333 -0.000110
C 5.049035 0.496002 0.000559
C 4.750442 -0.848241 -0.000616
H -0.650426 1.730126 -0.000452
H -2.822657 2.392687 -0.000362
H -1.812279 -1.841433 -0.000086
H 1.489557 1.691114 0.000528
H -5.249473 1.823068 -0.000273
H -4.251813 -2.405804 0.000030
H -5.987111 -0.586196 -0.000069
H 5.951210 1.096728 0.001207
H 5.425441 -1.699441 -0.001192


