%chk=000299580.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299580

0 1
O -1.276443 1.641286 -1.857748
O -1.357078 -1.087483 1.372472
N -1.917869 1.408209 0.337695
N 0.178350 -0.940414 -0.328872
C -4.329828 0.864373 -0.121108
C -3.278161 1.959133 0.115696
C -4.537422 -0.038091 1.101561
C -5.680954 -1.026004 0.883136
C -1.069347 1.201391 -0.738627
C 0.236644 0.491168 -0.407367
C 1.385013 1.181846 -0.329610
C 2.706940 0.592747 -0.063102
C 2.949470 -0.113648 1.125829
C 3.739380 0.759205 -1.000846
C -0.621425 -1.652946 0.579790
C 4.216220 -0.649525 1.371420
C 5.000880 0.214129 -0.750775
C 5.241728 -0.489763 0.434069
C -0.497362 -3.144761 0.477090
H -5.287054 1.345641 -0.402800
H -4.038917 0.250517 -0.997071
H -3.539820 2.573739 1.005460
H -3.249878 2.647231 -0.763779
H -4.740622 0.577557 1.998783
H -3.600624 -0.595802 1.323061
H -1.801642 0.836400 1.188864
H -6.634506 -0.512622 0.716850
H -5.807008 -1.680055 1.753382
H -5.497964 -1.668303 0.014315
H 1.386579 2.267833 -0.487225
H 0.890219 -1.427825 -0.878136
H 2.152483 -0.230371 1.859100
H 3.554362 1.310783 -1.921852
H 4.405374 -1.190061 2.297784
H 5.800136 0.341469 -1.479825
H 6.227452 -0.908590 0.627749
H -1.190550 -3.628229 1.187434
H 0.511448 -3.503277 0.722727
H -0.755005 -3.520586 -0.523522


%chk=000299580-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299580

0 1
O -1.121117 2.232176 -0.658683
O -1.377786 -1.035513 2.592955
N -2.160080 0.988911 1.008642
N 0.249536 -0.880496 0.890476
C -4.388284 1.206818 -0.153056
C -3.412393 1.760051 0.914336
C -4.902427 -0.217720 0.151153
C -5.870500 -0.742392 -0.931232
C -1.099707 1.278876 0.192890
C 0.178396 0.445748 0.336486
C 1.292615 0.956926 -0.288619
C 2.655952 0.405735 -0.365878
C 3.265635 -0.372735 0.666415
C 3.437156 0.705105 -1.522454
C -0.430257 -1.540200 1.904850
C 4.585183 -0.854213 0.526733
C 4.750005 0.213621 -1.664773
C 5.329813 -0.576024 -0.643001
C 0.023160 -2.974716 2.150041
H -5.249607 1.902579 -0.225107
H -3.880931 1.226702 -1.136809
H -3.892476 1.741897 1.911003
H -3.153985 2.805039 0.664941
H -5.410255 -0.221618 1.137872
H -4.037900 -0.904916 0.242549
H -2.043451 0.263003 1.747150
H -6.756414 -0.085685 -1.022959
H -6.228352 -1.761799 -0.695855
H -5.376137 -0.776022 -1.920467
H 1.090592 1.878617 -0.849015
H 1.019469 -1.423878 0.482950
H 2.733827 -0.539766 1.609741
H 2.995099 1.321656 -2.313941
H 5.039091 -1.432864 1.339183
H 5.324710 0.450783 -2.566835
H 6.352705 -0.953192 -0.749518
H 0.096587 -3.140127 3.237072
H 0.989553 -3.224017 1.678695
H -0.743826 -3.670048 1.764072


