%chk=000190988.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190988

0 1
O 1.426773 -0.568203 -0.978401
O 3.890399 -1.315898 0.668642
O -1.241204 2.325364 -0.280429
N -0.582351 0.132073 -0.101098
N -2.945732 0.760210 -0.031238
N -4.572302 -0.874722 0.284969
C 1.543444 0.726703 1.088645
C 0.837252 0.548205 -0.261808
C 3.037794 0.964646 0.864711
C 3.670954 -0.097607 -0.046899
C 2.817581 -0.368261 -1.300257
C -0.913121 -1.202948 0.036194
C -1.640026 1.191085 -0.149422
C -2.227541 -1.582272 0.159746
C -3.239268 -0.557715 0.126544
H 0.882541 1.466501 -0.901037
H 1.386517 -0.158456 1.734345
H 1.091901 1.580111 1.636607
H 3.205661 1.972721 0.436847
H 3.566336 0.960758 1.841017
H 4.711662 0.188452 -0.334465
H 2.900698 0.445710 -2.040874
H 3.079705 -1.336505 -1.771362
H -0.092998 -1.937956 0.034306
H 3.034353 -1.714364 0.936395
H -2.497524 -2.624441 0.276905
H -5.274870 -0.152180 0.201035
H -4.883535 -1.828311 0.275580


%chk=000190988-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190988

0 1
O 1.522704 -0.743889 -0.918575
O 3.868796 -1.280206 0.826599
O -1.095635 2.290506 -0.036783
N -0.581166 0.006666 -0.133763
N -2.875167 0.755232 0.126270
N -4.595338 -0.789573 0.308004
C 1.510735 0.754978 1.050453
C 0.836449 0.397895 -0.288903
C 3.008433 1.069489 0.810511
C 3.708299 -0.059379 0.016332
C 2.917402 -0.379288 -1.266337
C -0.977293 -1.310436 -0.095121
C -1.544526 1.106886 -0.011216
C -2.310883 -1.641121 0.061934
C -3.248117 -0.543984 0.167047
H 0.857787 1.278886 -0.963141
H 1.396089 -0.096427 1.749629
H 0.993590 1.624975 1.489552
H 3.100860 2.019216 0.245278
H 3.528912 1.208718 1.773666
H 4.740894 0.232513 -0.243243
H 2.912213 0.484224 -1.963847
H 3.324305 -1.269340 -1.771497
H -0.188347 -2.054492 -0.220959
H 2.978776 -1.714004 0.893849
H -2.627304 -2.685611 0.084566
H -5.219154 0.013431 0.371744
H -4.970216 -1.733167 0.343147


