%chk=000216308.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216308

0 1
O 1.425857 -2.123146 -0.541009
N 0.811874 -0.296777 0.736133
N 3.547055 0.501026 0.310537
C -0.589641 -0.257301 0.382607
C -1.416755 -1.366829 0.661570
C -1.102407 0.932094 -0.189041
C -2.788681 -1.277903 0.341658
C -2.480729 1.008268 -0.461464
C -3.302930 -0.096185 -0.201891
C -0.840643 -2.602943 1.269569
C -0.203749 2.090281 -0.490462
C -3.714915 -2.430341 0.574568
C -3.090768 2.250051 -1.033156
C 3.193826 -0.930387 0.566696
C 1.733357 -1.178561 0.163918
C 3.725319 0.740086 -1.153209
C 4.786430 0.872710 1.055709
H -4.365252 -0.033562 -0.432007
H 1.173184 0.559635 1.173261
H -0.248496 -3.151898 0.510956
H -0.157741 -2.368209 2.097168
H -1.595476 -3.291559 1.661347
H 0.829990 1.785039 -0.707560
H -0.540842 2.651535 -1.372835
H -0.173895 2.793712 0.353082
H 3.830143 -1.662059 0.019214
H 3.313270 -1.162230 1.648048
H -4.745584 -2.211793 0.268461
H -3.391124 -3.315064 0.006318
H -3.745647 -2.710828 1.636788
H -2.704979 2.452079 -2.042647
H -4.183112 2.181838 -1.115138
H -2.869043 3.127489 -0.410053
H 3.870168 1.819025 -1.321492
H 2.806887 0.444322 -1.688758
H 4.568241 0.202103 -1.611937
H 5.006801 1.937129 0.871041
H 5.679976 0.287940 0.792038
H 4.605432 0.764115 2.137174


%chk=000216308-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216308

0 1
O 1.402901 -2.391081 -0.762490
N 0.893163 -0.335804 0.295730
N 3.493476 0.389567 0.423286
C -0.534684 -0.272628 0.164772
C -1.346409 -1.346494 0.633171
C -1.091852 0.913584 -0.402955
C -2.758136 -1.244716 0.463885
C -2.503689 1.015825 -0.527790
C -3.304543 -0.073396 -0.107938
C -0.731329 -2.547963 1.322603
C -0.168830 2.028056 -0.870219
C -3.688228 -2.363304 0.905236
C -3.171618 2.248729 -1.118257
C 3.216676 -1.055378 0.226402
C 1.741056 -1.334450 -0.152328
C 3.774968 1.079520 -0.858593
C 4.526011 0.670152 1.446595
H -4.393488 -0.002194 -0.223790
H 1.427374 0.481314 0.642953
H -0.382578 -3.292556 0.583383
H 0.156594 -2.251855 1.909977
H -1.447860 -3.034719 2.004594
H 0.658132 1.625542 -1.483494
H -0.705395 2.775714 -1.474491
H 0.293099 2.569617 -0.019235
H 3.852800 -1.526048 -0.554370
H 3.414076 -1.592078 1.173890
H -4.729955 -2.144275 0.614631
H -3.406402 -3.332226 0.452956
H -3.671755 -2.504515 2.003648
H -2.881301 2.411543 -2.174354
H -4.269859 2.146408 -1.090826
H -2.907727 3.168990 -0.563560
H 3.815759 2.170963 -0.695087
H 2.967902 0.867278 -1.581000
H 4.740209 0.755584 -1.315722
H 4.602093 1.761137 1.602620
H 5.538008 0.291987 1.165357
H 4.236740 0.207072 2.406013


