%chk=000220708.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220708

0 1
O 2.867191 1.953542 -0.000429
N 0.668380 1.441204 0.000312
C -0.101136 -0.866717 0.000152
C -0.390955 0.521888 0.000251
C 1.293073 -1.299777 0.000180
C -1.750383 0.981339 0.000243
C -1.181674 -1.783708 -0.000178
C 2.294487 -0.381961 0.000187
C -2.770032 0.044356 -0.000069
C 2.050247 1.050300 0.000497
C -2.488971 -1.339722 -0.000294
C 1.605555 -2.759669 0.000138
C -2.062884 2.442089 0.000522
H 0.466812 2.444002 0.000297
H -0.974376 -2.853902 -0.000344
H 3.348548 -0.662433 0.000052
H -3.811546 0.369141 -0.000135
H -3.314545 -2.048723 -0.000630
H 2.687055 -2.960836 0.000020
H 1.191276 -3.260208 -0.888054
H 1.191446 -3.260115 0.888487
H -1.658297 2.945010 0.891287
H -1.659120 2.945158 -0.890530
H -3.145151 2.636244 0.001037


%chk=000220708-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220708

0 1
O 2.914178 1.994458 0.001299
N 0.654071 1.420240 -0.000184
C -0.111741 -0.890838 -0.000385
C -0.408206 0.513371 -0.000071
C 1.290350 -1.313394 -0.000169
C -1.757756 0.989597 0.000237
C -1.197670 -1.812063 -0.000417
C 2.291343 -0.359714 -0.000126
C -2.794579 0.036808 0.000092
C 2.029620 1.080784 -0.001283
C -2.524959 -1.357538 -0.000235
C 1.634665 -2.789341 0.000236
C -2.052091 2.478440 0.000594
H 0.462263 2.426324 0.000242
H -0.990686 -2.886727 -0.000535
H 3.347846 -0.643445 0.000521
H -3.833756 0.386801 0.000296
H -3.354468 -2.071886 -0.000254
H 2.726513 -2.936897 0.000397
H 1.219733 -3.298910 -0.889867
H 1.219556 -3.298394 0.890546
H -1.634796 2.984170 0.894294
H -1.635411 2.984455 -0.893232
H -3.139019 2.660201 0.001004


