%chk=000000123.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000123

0 1
O 3.509664 -0.645012 -0.595824
N -1.481173 0.055263 -0.364796
N 3.497325 1.378477 0.527672
N -3.365853 1.468328 -0.410371
N -3.588075 -0.610167 0.652910
C 0.694807 -1.101646 -0.206868
C 1.376656 0.137374 0.396383
C -0.800859 -1.152790 0.162556
C 2.868808 0.232732 0.051221
C -2.737421 0.258152 -0.054034
H 1.200363 -2.020003 0.141730
H 0.797216 -1.080297 -1.306388
H 0.842198 1.037938 0.035358
H 1.272689 0.132897 1.501307
H -0.904726 -1.236325 1.273583
H -1.234926 -2.085561 -0.269897
H 4.492387 1.509042 0.344367
H 2.985433 2.100026 1.034794
H -2.759619 2.137853 -0.881996
H -4.349175 1.450853 -0.689953
H -4.397984 -0.246995 1.152314
H -3.254933 -1.537940 0.894734


%chk=000000123-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000123

0 1
O 3.634312 -0.855375 0.533376
N -1.458192 0.113803 -0.339981
N 3.400449 1.415440 0.132124
N -3.334914 1.529739 -0.258036
N -3.587582 -0.666084 0.537059
C 0.725327 -1.034625 -0.213959
C 1.366114 0.098339 0.617517
C -0.789001 -1.147314 0.048228
C 2.883031 0.160282 0.425793
C -2.723508 0.283851 -0.033711
H 1.228788 -1.989226 0.027355
H 0.881996 -0.835406 -1.290729
H 0.871446 1.053313 0.365029
H 1.178783 -0.096456 1.693290
H -0.952604 -1.394230 1.126956
H -1.178288 -2.008785 -0.543391
H 4.408095 1.512293 0.006453
H 2.800502 2.229799 0.017913
H -2.712619 2.241016 -0.638960
H -4.311114 1.557642 -0.550343
H -4.410111 -0.368076 1.056652
H -3.258107 -1.617741 0.670169


