%chk=000281597.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281597

0 1
O -5.654887 0.187429 0.313528
O -4.020523 1.636862 -0.183385
N 0.670943 0.423366 1.510896
N -3.327280 -0.541213 -2.085876
N 1.931407 -0.961008 0.015027
N 2.633308 1.325767 0.592945
N 3.332096 -2.374275 -1.230481
N 4.605416 2.248335 -0.282377
C -2.618113 -1.169867 0.304041
C -1.460711 -0.169488 0.338752
C -3.740016 -0.782554 -0.682594
C -0.480300 -0.506856 1.475624
C -4.417518 0.497695 -0.198232
C 1.761377 0.249706 0.662297
C 3.114558 -1.113714 -0.680878
C 3.776942 1.137611 -0.152808
C 4.070134 -0.083262 -0.800646
H -2.234855 -2.174870 0.032335
H -3.053849 -1.287837 1.317804
H -1.845876 0.866248 0.454423
H -0.912754 -0.179104 -0.625739
H -4.509758 -1.609465 -0.698219
H -0.984764 -0.445206 2.466154
H -0.104262 -1.553277 1.364585
H 0.472017 1.381871 1.806395
H -2.841934 -1.352646 -2.459012
H -2.692913 0.254078 -2.154241
H 4.981154 -0.219432 -1.360535
H -6.153448 0.985816 0.635168
H 4.010301 -2.477981 -1.965035
H 2.571296 -3.038228 -1.233200
H 5.560158 2.115878 -0.567523
H 4.426755 3.052721 0.303508


%chk=000281597-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281597

0 1
O -5.235009 0.450036 0.573832
O -4.227851 1.416148 -1.281106
N 0.681478 0.443566 1.529519
N -3.180353 -1.031878 -2.058508
N 1.822327 -0.830058 -0.089596
N 2.731445 1.269467 0.797733
N 2.985225 -2.094511 -1.663858
N 4.786038 2.109615 0.089459
C -2.682037 -1.148886 0.454481
C -1.525852 -0.128243 0.456170
C -3.726045 -0.942306 -0.702263
C -0.469605 -0.462968 1.538846
C -4.395229 0.417972 -0.545937
C 1.780622 0.281611 0.709722
C 2.946629 -0.962970 -0.867165
C 3.834110 1.109529 0.000409
C 3.997299 -0.008752 -0.864246
H -2.269988 -2.172143 0.335508
H -3.222593 -1.129459 1.421173
H -1.913550 0.896545 0.623653
H -1.020978 -0.127471 -0.527964
H -4.519128 -1.702930 -0.551715
H -0.932225 -0.429112 2.544507
H -0.092946 -1.487893 1.370894
H 0.670964 1.305006 2.075087
H -2.469786 -1.752541 -2.193765
H -2.959288 -0.128706 -2.486671
H 4.882750 -0.125327 -1.494848
H -5.636209 1.357460 0.654640
H 3.774054 -2.291822 -2.271427
H 2.205123 -2.744359 -1.607261
H 5.636834 2.086633 -0.463558
H 4.607874 2.881847 0.726956


