%chk=000217015.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217015

0 1
O 0.476825 -1.085178 -1.200749
N -0.797619 0.798867 -0.709883
N 1.448030 0.568378 0.083250
C -2.035291 0.115068 -1.173456
C -2.790661 -0.617732 -0.053813
C -3.456879 0.329147 0.938754
C 2.790511 -0.069749 -0.020623
C 0.381819 0.000010 -0.644952
C 3.587659 0.199613 1.251323
H -1.758009 -0.611580 -1.976500
H -2.677604 0.891913 -1.644220
H -3.555665 -1.276232 -0.513206
H -2.098128 -1.303213 0.477032
H -0.963644 1.458695 0.050458
H -2.724039 0.922072 1.495927
H -4.138284 1.027447 0.438966
H -4.046836 -0.228130 1.677027
H 2.647921 -1.168107 -0.174577
H 3.333822 0.309581 -0.914938
H 1.448299 1.556123 0.314168
H 3.801877 1.264618 1.392589
H 3.049828 -0.148506 2.143613
H 4.548970 -0.328205 1.224010


%chk=000217015-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217015

0 1
O 0.597431 -1.223456 -1.120978
N -0.781857 0.613910 -0.664469
N 1.525642 0.725834 -0.205096
C -2.006545 -0.065215 -1.113878
C -2.865149 -0.639887 0.039197
C -3.402610 0.437872 1.005081
C 2.889508 0.182471 -0.133613
C 0.455921 -0.036112 -0.686656
C 3.404353 0.037099 1.314470
H -1.681544 -0.884780 -1.777594
H -2.609787 0.646126 -1.713231
H -3.714399 -1.192881 -0.410140
H -2.258115 -1.380130 0.593933
H -0.862095 1.550281 -0.267514
H -2.574335 0.975717 1.504361
H -4.023104 1.182380 0.469589
H -4.027578 -0.011515 1.797914
H 2.846853 -0.802814 -0.628221
H 3.578816 0.822598 -0.720337
H 1.365657 1.675070 0.135215
H 3.430968 1.012607 1.836329
H 2.754219 -0.645660 1.888900
H 4.430650 -0.374615 1.316937


