%chk=000299276.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299276

0 1
O -0.263216 0.511957 0.241903
N -0.521910 -1.741399 -0.178394
C 2.250567 0.563707 0.343332
C 2.366211 2.032860 0.611875
C 1.010114 -0.062610 0.181237
C 0.864301 -1.459020 -0.078010
C 2.680801 2.806447 -0.679743
C 3.360654 -0.276163 0.231235
C 3.243046 -1.665706 -0.027675
C 1.994790 -2.274628 -0.185352
C -1.148762 -0.589361 0.010032
C 2.816288 4.303434 -0.418576
C 4.491747 -2.481459 -0.130140
C -2.567664 -0.256229 0.020583
C -2.985980 1.070041 0.227776
C -3.517057 -1.274012 -0.179009
C -4.348440 1.372333 0.234893
C -4.877947 -0.959882 -0.169913
C -5.293988 0.359481 0.036471
H 1.422809 2.415101 1.056983
H 3.151288 2.224698 1.371439
H 3.612314 2.414756 -1.133713
H 1.880687 2.622843 -1.424963
H 4.356908 0.150228 0.345942
H 1.887562 -3.338121 -0.383333
H 1.894458 4.727186 -0.003363
H 3.624808 4.521445 0.288356
H 3.036280 4.846782 -1.344990
H 5.141192 -2.117434 -0.939286
H 5.074105 -2.438382 0.801597
H 4.291057 -3.541861 -0.333318
H -2.241886 1.854308 0.381416
H -3.184753 -2.303130 -0.340016
H -4.675435 2.398790 0.395150
H -5.615528 -1.746627 -0.324311
H -6.356720 0.599822 0.042785


%chk=000299276-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299276

0 1
O -0.132609 0.572004 0.238114
N -0.478978 -1.688540 -0.161171
C 2.398848 0.520479 0.367019
C 2.591091 2.006256 0.604857
C 1.131963 -0.064398 0.196704
C 0.913735 -1.446736 -0.046934
C 2.302497 2.867652 -0.657182
C 3.475709 -0.395595 0.273801
C 3.308010 -1.795135 0.026391
C 2.009860 -2.331190 -0.135593
C -1.062288 -0.505121 0.007467
C 2.495848 4.374388 -0.387515
C 4.532621 -2.692096 -0.054443
C -2.482858 -0.169662 -0.014383
C -2.926738 1.166209 0.183922
C -3.434570 -1.202507 -0.240366
C -4.305168 1.461009 0.155064
C -4.809468 -0.898866 -0.267417
C -5.250570 0.432508 -0.070245
H 1.919292 2.347023 1.417755
H 3.628399 2.194919 0.941873
H 2.969619 2.541273 -1.478714
H 1.266184 2.676036 -0.994892
H 4.494201 -0.005643 0.400023
H 1.851043 -3.397235 -0.322759
H 1.817238 4.724636 0.413279
H 3.532611 4.593814 -0.068738
H 2.287339 4.973246 -1.292729
H 5.216738 -2.368084 -0.861301
H 5.109625 -2.671507 0.889321
H 4.252174 -3.740341 -0.253292
H -2.190451 1.956814 0.357778
H -3.074617 -2.225250 -0.390896
H -4.643817 2.491533 0.307951
H -5.538899 -1.697251 -0.441853
H -6.320911 0.665555 -0.091994


